Citation:

PANGAEA.939623

Name: Dissolved organic matter composition in the Fennoscandian Shield deep terrestrial biosphere (FT-ICR-MS), 2018 and 2019
Published: 2021-12-16
License: https://creativecommons.org/licenses/by/4.0/
Keywords: aquifer; FT-ICR-MS; groundwater

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Abstract:

Copious amounts of organic carbon are stored for long periods of time in deep continental groundwaters. Little is known about its composition and cycling, mainly due to the difficulties in obtaining sample material. Cool fracture waters of different origins can be obtained under clean conditions at Äspö Hard Rock Laboratory (Äspö HRL, Sweden), operated by the Swedish Nuclear Fuel and Waste Management Company (SKB). We sampled groundwater from different depth (171 to 507 meter below sea level) in the bedrock fractures in November 2018 and March-April 2019. We assessed water chemistry and dissolved organic matter composition via stable carbon isotopic and molecular-formula level analysis in recent Baltic Sea-influenced to old saline fracture waters in the granitic Fennoscandian shield.

Molecular-level dissolved organic matter composition via Fourier-transform ion cyclotron resonance mass spectrometry using electrospray ionization in negative mode (FT-ICR-MS, 15 T Bruker Solarix) was done on solid-phase extracted (PPL) DOM extracts. Relative peak intensities from FT-ICR-MS with molecular formula attributions, elemental ratios and compound group classification of the final dataset are given. ICBM-Ocean was used for processing of FT-ICR mass spectra and formula attribution (Merder et al., 2020; doi:10.1021/acs.analchem.9b05659).

Keyword(s):

aquifer; FT-ICR-MS; groundwater

Related to:

Osterholz, Helena; Turner, Stephanie; Alakangas, Linda J; Tullborg, Eva-Lena; Dittmar, Thorsten; Kalinowski, Birgitta E; Dopson, Mark (2022): Terrigenous dissolved organic matter persists in the energy-limited deep groundwaters of the Fennoscandian Shield. Nature Communications, 13(1), 4837, https://doi.org/10.1038/s41467-022-32457-z

Osterholz, Helena; Turner, Stephnie; Alakangas, Linda; Tullborg, Eva-Lena; Kalinowski, Birgitta; Dittmar, Thorsten; Dopson, Mark (2021): Water chemistry of unfiltered groundwater samples from the Fennoscandian Shield deep terrestrial biosphere in 2018 and 2019. PANGAEA, https://doi.org/10.1594/PANGAEA.939654

Coverage:

Median Latitude: 57.398037 * Median Longitude: 16.685330 * South-bound Latitude: 56.918333 * West-bound Longitude: 16.651667 * North-bound Latitude: 57.433440 * East-bound Longitude: 17.051667

Date/Time Start: 2018-11-16T00:00:00 * Date/Time End: 2019-10-04T00:00:00

Minimum Elevation: -507.0 m * Maximum Elevation: 0.0 m

Event(s):

BalticSea_Äspö * Latitude: 57.417500 * Longitude: 16.651667 * Date/Time: 2019-09-04T00:00:00 * Elevation: 0.0 m * Location: Sweden * Comment: Water type: BalticSea

BalticSea_Kalmar * Latitude: 56.918333 * Longitude: 17.051667 * Date/Time: 2019-04-16T00:00:00 * Elevation: 0.0 m * Location: Sweden * Comment: Water type: BalticSea

HA2780A_1 * Latitude: 57.433440 * Longitude: 16.659740 * Date/Time: 2019-03-18T00:00:00 * Elevation: -381.0 m * Location: Sweden * Comment: Water type: Saline

Parameter(s):

#	Name	Short Name	Principal Investigator	Method/Device	Comment
1	Molecular formula	Formula	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
2	Mass of molecular formulas	m/z	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
3	Hydrogen/Carbon ratio	H/C	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
4	Oxygen/Carbon ratio	O/C	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
5	Nitrogen/Carbon ratio	N/C	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
6	Sulfur/Carbon ratio	S/C	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
7	Phosphorus/Carbon ratio	P/C	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
8	Aromaticity index, modified	AI mod	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
9	Double bond equivalent	DBE	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)
10	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Aromatic
11	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Aromatic.O_rich
12	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Aromatic.O_poor
13	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Highly.unsaturated
14	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Highly.unsaturated.O_rich
15	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Highly.unsaturated.O_poor
16	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Unsaturated
17	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Unsaturated.O_rich
18	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Unsaturated.O_poor
19	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Unsaturated.with.N
20	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Saturated
21	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Saturated.O_rich
22	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Saturated.O_poor
23	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Lipid-like (D'Andrilli_et_al.2019_Biogeochemistry)
24	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Protein-like(D'Andrilli_et_al.2019_Biogeochemistry)
25	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Aminosugar_carbohydrate(D'Andrilli_et_al.2019_Biogeochemistry)
26	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Unsat_hydrocarbon(D'Andrilli_et_al.2019_Biogeochemistry)
27	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	CondensedAromatics(D'Andrilli_et_al.2019_Biogeochemistry)
28	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Lignin(D'Andrilli_et_al.2019_Biogeochemistry)
29	Presence/absence	Presence/absence	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	Tannin(D'Andrilli_et_al.2019_Biogeochemistry)
30	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1229A_1
31	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3105A_3
32	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1730A_1
33	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3600F_2
34	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA2600A_1
35	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA2600A_1
36	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA2600A_1
37	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2865A01_1
38	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2865A01_1
39	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2051A01_5
40	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2051A01_5
41	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3105A_3
42	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3105A_3
43	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3385A_1
44	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3385A_1
45	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3510A_2
46	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3510A_2
47	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at HA2780A_1
48	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at HA2780A_1
49	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1730A_1
50	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1730A_1
51	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA1755A_3
52	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA1755A_3
53	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2511A_5
54	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2511A_5
55	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2862A_1
56	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA2862A_1
57	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3600F_2
58	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at KA3600F_2
59	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at BalticSea_Kalmar
60	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at BalticSea_Kalmar
61	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1229A_1
62	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at SA1229A_1
63	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at BalticSea_Äspö
64	Peak intensity	Peak int	Osterholz, Helena	Fourier transform ion cyclotron resonance mass spectrometer (FT-ICR MS, 15 T Bruker Solarix)	at BalticSea_Äspö

License:

Creative Commons Attribution 4.0 International (CC-BY-4.0)

Status:

Curation Level: Enhanced curation (CurationLevelC)

Size:

814592 data points

Data

Download dataset as tab-delimited text — use the following character encoding:

1 Formula	2 m/z	3 H/C	4 O/C	5 N/C	6 S/C	7 P/C	8 AI mod	9 DBE	10 Presence/absence (Aromatic)	11 Presence/absence (Aromatic.O_rich)	12 Presence/absence (Aromatic.O_poor)	13 Presence/absence (Highly.unsaturated)	14 Presence/absence (Highly.unsaturated.O_rich)	15 Presence/absence (Highly.unsaturated.O_poor)	16 Presence/absence (Unsaturated)	17 Presence/absence (Unsaturated.O_rich)	18 Presence/absence (Unsaturated.O_poor)	19 Presence/absence (Unsaturated.with.N)	20 Presence/absence (Saturated)	22 Presence/absence (Saturated.O_poor)	23 Presence/absence (Lipid-like (D'Andrilli_et_al....)	24 Presence/absence (Protein-like(D'Andrilli_et_al...)	25 Presence/absence (Aminosugar_carbohydrate(D'And...)	26 Presence/absence (Unsat_hydrocarbon(D'Andrilli_...)	27 Presence/absence (CondensedAromatics(D'Andrilli...)	28 Presence/absence (Lignin(D'Andrilli_et_al.2019_...)	29 Presence/absence (Tannin(D'Andrilli_et_al.2019_...)	30 Peak int (at SA1229A_1)	31 Peak int (at KA3105A_3)	32 Peak int (at SA1730A_1)	33 Peak int (at KA3600F_2)	34 Peak int (at SA2600A_1)	35 Peak int (at SA2600A_1)	36 Peak int (at SA2600A_1)	37 Peak int (at KA2865A01_1)	38 Peak int (at KA2865A01_1)	39 Peak int (at KA2051A01_5)	40 Peak int (at KA2051A01_5)	41 Peak int (at KA3105A_3)	42 Peak int (at KA3105A_3)	43 Peak int (at KA3385A_1)	44 Peak int (at KA3385A_1)	45 Peak int (at KA3510A_2)	46 Peak int (at KA3510A_2)	47 Peak int (at HA2780A_1)	48 Peak int (at HA2780A_1)	49 Peak int (at SA1730A_1)	50 Peak int (at SA1730A_1)	51 Peak int (at KA1755A_3)	52 Peak int (at KA1755A_3)	53 Peak int (at KA2511A_5)	54 Peak int (at KA2511A_5)	55 Peak int (at KA2862A_1)	56 Peak int (at KA2862A_1)	57 Peak int (at KA3600F_2)	58 Peak int (at KA3600F_2)	59 Peak int (at BalticSea_Kalmar)	60 Peak int (at BalticSea_Kalmar)	61 Peak int (at SA1229A_1)	62 Peak int (at SA1229A_1)	63 Peak int (at BalticSea_Äspö)	64 Peak int (at BalticSea_Äspö)
C6H8O	96.057508	1.333	0.167	0.00	0.0000	0.0000	0.45	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300
C5H6O2	98.036782	1.200	0.400	0.00	0.0000	0.0000	0.50	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034800	0.000029600	0.000024700	0.000032200	0.000018600	0.000020200	0.000021400	0.000026400	0.000031500	0.000027000	0.000000000	0.000030000	0.000021700	0.000030200	0.000022100	0.000018800	0.000021200	0.000025400	0.000020900	0.000022200	0.000020600	0.000020300	0.000000000	0.000027900	0.000029500	0.000022800	0.000000000	0.000027900	0.000031800	0.000036700	0.000033400	0.000032200	0.000023700	0.000033800	0.000030300
C6H10O	98.073165	1.667	0.167	0.00	0.0000	0.0000	0.27	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000018800	0.000000000	0.000000000	0.000020400	0.000000000
C4H4O3	100.016043	1.000	0.750	0.00	0.0000	0.0000	0.60	3	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000021500	0.000023700	0.000000000	0.000018200	0.000000000	0.000020500	0.000000000	0.000019800	0.000000000	0.000024900	0.000022400	0.000027400	0.000027800	0.000000000	0.000022500	0.000000000	0.000021000	0.000000000	0.000000000	0.000022300	0.000024900	0.000020500	0.000000000	0.000029800	0.000029600	0.000000000	0.000019400	0.000000000	0.000021700	0.000045800	0.000039400	0.000038600	0.000030200	0.000046500	0.000044700
C5H8O2	100.052426	1.600	0.400	0.00	0.0000	0.0000	0.25	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000021400	0.000021200	0.000000000	0.000019100	0.000024000	0.000023800	0.000021000	0.000023000	0.000031600	0.000020000	0.000027500	0.000035500	0.000022200	0.000028500	0.000020200	0.000000000	0.000024200	0.000020700	0.000018900	0.000020200	0.000021900	0.000000000	0.000019800	0.000034000	0.000034900	0.000020300	0.000020100	0.000019500	0.000019600	0.000045100	0.000032600	0.000029800	0.000022400	0.000030700	0.000040400
C4H6O3	102.031692	1.500	0.750	0.00	0.0000	0.0000	0.20	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000022700	0.000021200	0.000000000	0.000029300	0.000000000	0.000020600	0.000024300	0.000032100	0.000030500	0.000024500	0.000025800	0.000033500	0.000032500	0.000000000	0.000000000	0.000000000	0.000000000	0.000029500	0.000000000	0.000021600	0.000030100	0.000018400	0.000000000	0.000024300	0.000026900	0.000000000	0.000000000	0.000000000	0.000024300	0.000034900	0.000033100	0.000027900	0.000000000	0.000041400	0.000041800
C6H7NO	109.052775	1.167	0.167	0.17	0.0000	0.0000	0.56	4	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500
C6H6O2	110.036775	1.000	0.333	0.00	0.0000	0.0000	0.60	4	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000048200	0.000041200	0.000033400	0.000040200	0.000039700	0.000032300	0.000037900	0.000044100	0.000054900	0.000042300	0.000047000	0.000051500	0.000000000	0.000036700	0.000033600	0.000023000	0.000000000	0.000029900	0.000028400	0.000000000	0.000032300	0.000035400	0.000023700	0.000040800	0.000000000	0.000000000	0.000034200	0.000035000	0.000000000	0.000061800	0.000066200	0.000000000	0.000000000	0.000000000	0.000096500
C7H10O	110.073161	1.429	0.143	0.00	0.0000	0.0000	0.38	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034900	0.000029000	0.000025100	0.000038600	0.000026900	0.000031300	0.000024900	0.000046700	0.000046100	0.000033100	0.000030100	0.000038800	0.000030400	0.000041000	0.000026800	0.000038600	0.000030700	0.000047200	0.000047300	0.000037600	0.000034500	0.000040200	0.000020300	0.000035200	0.000034800	0.000032000	0.000036300	0.000033700	0.000036400	0.000070200	0.000059100	0.000043400	0.000031000	0.000048200	0.000048400
C5H5NO2	111.032023	1.000	0.400	0.20	0.0000	0.0000	0.67	4	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000021000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026900	0.000000000	0.000000000	0.000000000	0.000020600
C5H4O3	112.016041	0.800	0.600	0.00	0.0000	0.0000	0.71	4	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000052900	0.000044100	0.000025100	0.000040000	0.000030900	0.000036700	0.000043800	0.000043200	0.000052000	0.000039800	0.000052900	0.000036400	0.000039000	0.000025900	0.000030900	0.000000000	0.000027400	0.000029200	0.000031900	0.000041200	0.000038100	0.000027800	0.000023300	0.000058000	0.000052800	0.000030500	0.000033400	0.000040400	0.000041700	0.000068600	0.000073900	0.000063200	0.000058000	0.000085800	0.000096100
C6H8O2	112.052429	1.333	0.333	0.00	0.0000	0.0000	0.40	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000045000	0.000048500	0.000045300	0.000038600	0.000035800	0.000045900	0.000046200	0.000064000	0.000063000	0.000063300	0.000051100	0.000064600	0.000043800	0.000040600	0.000052300	0.000036100	0.000040100	0.000037100	0.000052500	0.000043700	0.000048200	0.000028700	0.000034200	0.000047900	0.000057700	0.000037100	0.000029000	0.000044000	0.000048200	0.000085700	0.000073100	0.000068900	0.000050900	0.000075200	0.000079500
C7H12O	112.088814	1.714	0.143	0.00	0.0000	0.0000	0.23	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000030600	0.000000000	0.000020700	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000026000	0.000025200	0.000019400	0.000000000	0.000019000	0.000021700
C5H7NO2	113.047679	1.400	0.400	0.20	0.0000	0.0000	0.33	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026800	0.000019800	0.000000000	0.000000000	0.000018800	0.000018500
C5H6O3	114.031688	1.200	0.600	0.00	0.0000	0.0000	0.43	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000056500	0.000054400	0.000041300	0.000047900	0.000042600	0.000055000	0.000045200	0.000064800	0.000066600	0.000059300	0.000059000	0.000060300	0.000053000	0.000048700	0.000000000	0.000037500	0.000044500	0.000052500	0.000047200	0.000041600	0.000046700	0.000037700	0.000029500	0.000056500	0.000063400	0.000038600	0.000044500	0.000048300	0.000046200	0.000097700	0.000083000	0.000060400	0.000066000	0.000088700	0.000096100
C6H10O2	114.068084	1.667	0.333	0.00	0.0000	0.0000	0.20	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000020300	0.000022800	0.000020400	0.000000000	0.000019200	0.000022000	0.000000000	0.000024900	0.000024600	0.000000000	0.000028700	0.000000000	0.000024500	0.000000000	0.000021500	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000023700	0.000020000	0.000023200	0.000000000	0.000021800	0.000032900	0.000034700	0.000033700	0.000018500	0.000000000	0.000031400
C4H4O4	116.010948	1.000	1.000	0.00	0.0000	0.0000	0.50	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000027300	0.000021900	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000021500	0.000022100	0.000033200	0.000029500	0.000032500	0.000028800	0.000031400	0.000031300
C5H8O3	116.047347	1.600	0.600	0.00	0.0000	0.0000	0.14	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000028800	0.000033600	0.000025300	0.000030200	0.000027700	0.000029500	0.000030100	0.000037900	0.000049100	0.000000000	0.000037700	0.000041400	0.000037100	0.000000000	0.000025300	0.000028800	0.000034500	0.000000000	0.000033200	0.000000000	0.000026100	0.000021800	0.000000000	0.000029200	0.000039500	0.000028800	0.000032800	0.000033300	0.000021700	0.000000000	0.000052200	0.000037100	0.000027600	0.000042400	0.000043400
C4H6O4	118.026609	1.500	1.000	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000020500	0.000022300	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000025100	0.000019800	0.000028300	0.000018000	0.000030100	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000021500	0.000000000	0.000037800	0.000027900	0.000022600	0.000000000	0.000028300	0.000027300
C8H8O	120.057508	1.000	0.125	0.00	0.0000	0.0000	0.60	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018900	0.000035200	0.000000000	0.000021400	0.000000000	0.000024400	0.000000000	0.000031600	0.000028900	0.000023100	0.000019300	0.000024400	0.000025800	0.000000000	0.000022300	0.000023600	0.000019800	0.000020200	0.000033400	0.000000000	0.000031300	0.000021500	0.000000000	0.000019400	0.000025800	0.000024400	0.000026400	0.000024800	0.000025200	0.000046800	0.000046100	0.000044400	0.000027600	0.000040800	0.000050100
C7H7NO	121.052777	1.000	0.143	0.14	0.0000	0.0000	0.64	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000
C7H6O2	122.036784	0.857	0.286	0.00	0.0000	0.0000	0.67	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000059700	0.000078400	0.000061500	0.000076800	0.000055400	0.000047500	0.000100600	0.000074600	0.000132000	0.000086700	0.000081200	0.000091400	0.000059300	0.000057200	0.000067000	0.000077300	0.000067900	0.000076200	0.000057500	0.000067300	0.000044200	0.000122500	0.000058300	0.000061000	0.000066900	0.000088400	0.000059600	0.000056500	0.000059900	0.000166600	0.000094400	0.000081400	0.000056100	0.000117700	0.000116100
C8H10O	122.073160	1.250	0.125	0.00	0.0000	0.0000	0.47	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000061300	0.000061000	0.000049600	0.000060000	0.000053500	0.000054300	0.000050300	0.000066100	0.000080900	0.000078700	0.000064200	0.000076400	0.000053100	0.000064500	0.000067800	0.000061100	0.000057900	0.000067600	0.000081600	0.000056500	0.000062000	0.000041000	0.000055700	0.000077500	0.000072700	0.000064900	0.000053600	0.000065300	0.000063900	0.000120000	0.000100100	0.000079800	0.000068100	0.000080900	0.000094100
C7H9NO	123.068412	1.286	0.143	0.14	0.0000	0.0000	0.45	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000018400	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000018200	0.000000000	0.000020900	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000027600	0.000023000	0.000000000	0.000026700	0.000000000	0.000000000	0.000000000
C6H4O3	124.016036	0.667	0.500	0.00	0.0000	0.0000	0.78	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029500	0.000021600	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000027700	0.000021200	0.000000000	0.000025100	0.000026000	0.000022600	0.000000000	0.000022700	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031200	0.000027600	0.000036700	0.000000000	0.000049200	0.000050900
C7H8O2	124.052440	1.143	0.286	0.00	0.0000	0.0000	0.50	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000069000	0.000000000	0.000000000	0.000066900	0.000000000	0.000000000	0.000000000	0.000000000	0.000091500	0.000000000	0.000085200	0.000000000	0.000070800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000081300	0.000084900	0.000000000	0.000000000	0.000070000	0.000062000	0.000114500	0.000096100	0.000093500	0.000077200	0.000111400	0.000106700
C8H12O	124.088808	1.500	0.125	0.00	0.0000	0.0000	0.33	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000042400	0.000054300	0.000049400	0.000061800	0.000057400	0.000058400	0.000043000	0.000065800	0.000060600	0.000060700	0.000050600	0.000071700	0.000047200	0.000058800	0.000062100	0.000062700	0.000062400	0.000071400	0.000075700	0.000043000	0.000052300	0.000050800	0.000052600	0.000067600	0.000062900	0.000054700	0.000057100	0.000060000	0.000054400	0.000111300	0.000092100	0.000070700	0.000059000	0.000081400	0.000077000
C6H7NO2	125.047689	1.167	0.333	0.17	0.0000	0.0000	0.50	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000021100	0.000018000	0.000000000	0.000031100	0.000018800	0.000018800	0.000000000	0.000019900	0.000024200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000019600	0.000018700	0.000000000	0.000000000	0.000018500	0.000030900	0.000027400	0.000000000	0.000022500	0.000028200	0.000025700
C6H6OS	126.013945	1.000	0.167	0.00	0.1667	0.0000	0.56	4	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000
C6H9NO2	127.063314	1.500	0.333	0.17	0.0000	0.0000	0.25	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000021400	0.000020600	0.000023300	0.000000000	0.000000000	0.000000000
C5H4O4	128.010952	0.800	0.800	0.00	0.0000	0.0000	0.67	4	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000026400	0.000020400	0.000000000	0.000018000	0.000023500	0.000000000	0.000000000	0.000023200	0.000019600	0.000027500	0.000020200	0.000024300	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000018100	0.000023800	0.000000000	0.000000000	0.000000000	0.000021400	0.000028700	0.000025700	0.000026800	0.000019600	0.000049300	0.000055200
C7H12O2	128.083730	1.714	0.286	0.00	0.0000	0.0000	0.17	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000000000	0.000022200	0.000027500	0.000026500	0.000027300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000049700	0.000035100	0.000000000	0.000023800	0.000032000	0.000031900
C5H7NO3	129.042607	1.400	0.600	0.20	0.0000	0.0000	0.20	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000
C5H6O4	130.026603	1.200	0.800	0.00	0.0000	0.0000	0.33	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000055900	0.000051500	0.000031200	0.000036600	0.000039200	0.000034500	0.000031000	0.000044700	0.000039500	0.000036800	0.000038800	0.000042400	0.000039600	0.000026600	0.000022700	0.000026300	0.000000000	0.000000000	0.000022200	0.000000000	0.000031400	0.000022300	0.000000000	0.000045100	0.000049000	0.000024400	0.000044700	0.000037900	0.000033000	0.000000000	0.000067700	0.000059400	0.000049900	0.000070600	0.000069700
C5H8O2S	132.024491	1.600	0.400	0.00	0.2000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000030700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030300	0.000027800	0.000027100	0.000000000	0.000000000	0.000018100	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000
C5H8O4	132.042272	1.600	0.800	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000023800	0.000025500	0.000018300	0.000020000	0.000000000	0.000020100	0.000023200	0.000027900	0.000033200	0.000030700	0.000032400	0.000043100	0.000026700	0.000000000	0.000021700	0.000021000	0.000027600	0.000025400	0.000000000	0.000022200	0.000020700	0.000000000	0.000000000	0.000032900	0.000029100	0.000022700	0.000024800	0.000024800	0.000024400	0.000037600	0.000029500	0.000027900	0.000022700	0.000038300	0.000034800
C9H8O	132.057530	0.889	0.111	0.00	0.0000	0.0000	0.65	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000021100	0.000023900	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000000000	0.000022800	0.000023500	0.000019900	0.000028100	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000023500	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026400	0.000000000	0.000031000	0.000020700	0.000018500	0.000044000	0.000035300	0.000031000	0.000018600	0.000037600	0.000033600
C8H6O2	134.036797	0.750	0.250	0.00	0.0000	0.0000	0.71	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000027500	0.000029700	0.000018500	0.000020300	0.000019900	0.000000000	0.000000000	0.000023600	0.000022600	0.000025000	0.000023200	0.000019900	0.000027400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000025400	0.000026400	0.000019500	0.000020100	0.000023300	0.000000000	0.000033300	0.000027400	0.000030800	0.000028000	0.000043300	0.000047100
C9H10O	134.073179	1.111	0.111	0.00	0.0000	0.0000	0.53	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000037600	0.000043400	0.000029400	0.000041800	0.000041000	0.000037000	0.000029900	0.000045600	0.000052600	0.000048900	0.000039900	0.000052600	0.000034800	0.000036500	0.000044300	0.000040200	0.000040600	0.000046100	0.000047900	0.000034300	0.000037700	0.000036800	0.000039200	0.000049800	0.000049900	0.000044900	0.000031200	0.000048000	0.000044200	0.000069300	0.000072300	0.000062500	0.000052000	0.000054400	0.000068800
C8H9NO	135.068414	1.125	0.125	0.13	0.0000	0.0000	0.54	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000028500	0.000019600	0.000019800	0.000000000	0.000000000	0.000000000
C7H4O3	136.016047	0.571	0.429	0.00	0.0000	0.0000	0.82	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000023100	0.000021000	0.000000000	0.000031700	0.000033900
C8H8O2	136.052432	1.000	0.250	0.00	0.0000	0.0000	0.57	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000092300	0.000079900	0.000064600	0.000070300	0.000072800	0.000072400	0.000067900	0.000092500	0.000095300	0.000099100	0.000075600	0.000090000	0.000078900	0.000067300	0.000064500	0.000058000	0.000060100	0.000066700	0.000070400	0.000080100	0.000070800	0.000057400	0.000060400	0.000090600	0.000097800	0.000078200	0.000063100	0.000082200	0.000072000	0.000153800	0.000136600	0.000117400	0.000082500	0.000152200	0.000148600
C9H12O	136.088818	1.333	0.111	0.00	0.0000	0.0000	0.41	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000078500	0.000095300	0.000073400	0.000079700	0.000088500	0.000083500	0.000066300	0.000105100	0.000094700	0.000101900	0.000083700	0.000100800	0.000074300	0.000082000	0.000107200	0.000101800	0.000085100	0.000100700	0.000108100	0.000075800	0.000071100	0.000077400	0.000070100	0.000100000	0.000107400	0.000082400	0.000075800	0.000088600	0.000091400	0.000150000	0.000127700	0.000117000	0.000096000	0.000109300	0.000102700
C7H7NO2	137.047696	1.000	0.286	0.14	0.0000	0.0000	0.60	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018800	0.000000000	0.000020200	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000019000	0.000018700	0.000022400	0.000029800	0.000030600	0.000029100	0.000021600	0.000030600	0.000023100
C8H11NO	137.084060	1.375	0.125	0.13	0.0000	0.0000	0.38	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020300	0.000020400	0.000000000	0.000018800	0.000019300	0.000021300	0.000000000	0.000000000	0.000022000	0.000020600	0.000020500	0.000021400	0.000022700	0.000022600	0.000021900	0.000025100	0.000026200	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000032100	0.000026400	0.000024300	0.000030500	0.000000000	0.000048100	0.000039300	0.000030200	0.000036300	0.000022100	0.000019300
C7H6O3	138.031691	0.857	0.429	0.00	0.0000	0.0000	0.64	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000105200	0.000090500	0.000063800	0.000074400	0.000064800	0.000072100	0.000072000	0.000101800	0.000108000	0.000093300	0.000085300	0.000100700	0.000073800	0.000051800	0.000076400	0.000066100	0.000051000	0.000058300	0.000065200	0.000087200	0.000074300	0.000059200	0.000000000	0.000105200	0.000110000	0.000065700	0.000064400	0.000084400	0.000079900	0.000144600	0.000116400	0.000142000	0.000121600	0.000193800	0.000205000
C8H10O2	138.068076	1.250	0.250	0.00	0.0000	0.0000	0.43	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000141000	0.000141500	0.000103900	0.000118900	0.000123000	0.000127200	0.000104700	0.000165600	0.000149900	0.000152400	0.000142500	0.000150200	0.000125700	0.000115100	0.000131800	0.000112900	0.000111300	0.000152200	0.000137400	0.000123000	0.000117500	0.000104500	0.000094900	0.000141100	0.000150500	0.000119100	0.000113200	0.000128000	0.000126900	0.000229800	0.000208100	0.000166800	0.000151300	0.000199900	0.000215000
C9H14O	138.104463	1.556	0.111	0.00	0.0000	0.0000	0.29	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000062600	0.000071400	0.000062800	0.000080000	0.000069200	0.000061800	0.000073700	0.000085100	0.000073300	0.000074500	0.000065200	0.000071600	0.000054900	0.000076300	0.000078200	0.000095600	0.000082100	0.000086900	0.000092100	0.000062600	0.000059800	0.000071400	0.000065100	0.000073600	0.000084000	0.000075700	0.000067300	0.000072800	0.000072500	0.000119100	0.000115600	0.000088500	0.000076200	0.000087100	0.000093600
C6H5NO3	139.026944	0.833	0.500	0.17	0.0000	0.0000	0.71	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019500	0.000018600	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000039200	0.000032200	0.000000000	0.000000000	0.000032900	0.000028600
C7H9NO2	139.063346	1.286	0.286	0.14	0.0000	0.0000	0.40	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022800	0.000033200	0.000024400	0.000024300	0.000022700	0.000029000	0.000027800	0.000030400	0.000028200	0.000033100	0.000021800	0.000031900	0.000026600	0.000025600	0.000026800	0.000035000	0.000031800	0.000027300	0.000022900	0.000022400	0.000000000	0.000026200	0.000023900	0.000021300	0.000039600	0.000030800	0.000028400	0.000035500	0.000035200	0.000054800	0.000053500	0.000048000	0.000033800	0.000041500	0.000035400
C6H4O4	140.010957	0.667	0.667	0.00	0.0000	0.0000	0.75	5	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000032700	0.000018800	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000021200	0.000031400	0.000027500	0.000025800	0.000024500	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000000000	0.000020400	0.000028800	0.000000000	0.000000000	0.000000000	0.000000000	0.000030700	0.000026800	0.000024800	0.000023000	0.000069200	0.000066200
C7H8OS	140.029581	1.143	0.143	0.00	0.1429	0.0000	0.45	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023800	0.000000000	0.000025600	0.000023900	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000022700	0.000021200	0.000000000	0.000018400	0.000024400	0.000038400	0.000000000	0.000000000	0.000030400	0.000036100	0.000000000	0.000000000
C7H8O3	140.047354	1.143	0.429	0.00	0.0000	0.0000	0.45	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000104000	0.000000000	0.000000000	0.000000000	0.000084800	0.000080700	0.000000000	0.000115700	0.000107600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000084000	0.000080500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000098100	0.000000000	0.000158400	0.000139300	0.000124500	0.000000000	0.000152800	0.000177800
C8H12O2	140.083728	1.500	0.250	0.00	0.0000	0.0000	0.29	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000075900	0.000101900	0.000067700	0.000074800	0.000086700	0.000086900	0.000082500	0.000113200	0.000109900	0.000098100	0.000100100	0.000103400	0.000093100	0.000096100	0.000091900	0.000092900	0.000103900	0.000105800	0.000113400	0.000081300	0.000075100	0.000071800	0.000076100	0.000103900	0.000105200	0.000099600	0.000090700	0.000089900	0.000091200	0.000189000	0.000163900	0.000110500	0.000086500	0.000127200	0.000140300
C9H16O	140.120133	1.778	0.111	0.00	0.0000	0.0000	0.18	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000019200	0.000026500	0.000000000	0.000020600	0.000022800	0.000024400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000
C6H7NO3	141.042602	1.167	0.500	0.17	0.0000	0.0000	0.43	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000027500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000022000	0.000027400	0.000025300	0.000025500	0.000024100	0.000020200	0.000028800
C7H11NO2	141.078969	1.571	0.286	0.14	0.0000	0.0000	0.20	3	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026100	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030700	0.000023500	0.000022900	0.000000000	0.000000000	0.000019000
C6H6O2S	142.008870	1.000	0.333	0.00	0.1667	0.0000	0.50	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000023500	0.000000000	0.000000000	0.000024400	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000073000	0.000078300	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000029200	0.000022200	0.000000000	0.000000000
C6H6O4	142.026613	1.000	0.667	0.00	0.0000	0.0000	0.50	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000048500	0.000000000	0.000036800	0.000000000	0.000029800	0.000000000	0.000000000	0.000049100	0.000054200	0.000053400	0.000041900	0.000000000	0.000040700	0.000000000	0.000023400	0.000019000	0.000000000	0.000023200	0.000030400	0.000000000	0.000043800	0.000000000	0.000018600	0.000044500	0.000057000	0.000000000	0.000031100	0.000034700	0.000034600	0.000070200	0.000000000	0.000000000	0.000000000	0.000105800	0.000103800
C7H10O3	142.063000	1.429	0.429	0.00	0.0000	0.0000	0.27	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000065300	0.000075000	0.000000000	0.000069300	0.000000000	0.000071800	0.000065200	0.000076200	0.000070600	0.000074900	0.000072600	0.000074200	0.000071000	0.000000000	0.000069800	0.000070600	0.000062600	0.000073600	0.000075300	0.000068300	0.000070600	0.000000000	0.000058900	0.000075700	0.000000000	0.000071400	0.000062400	0.000065900	0.000062300	0.000000000	0.000097300	0.000087000	0.000068900	0.000107000	0.000102800
C8H14O2	142.099384	1.750	0.250	0.00	0.0000	0.0000	0.14	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000019800	0.000022500	0.000000000	0.000030900	0.000024000	0.000025500	0.000022300	0.000026300	0.000026600	0.000030300	0.000021900	0.000000000	0.000029000	0.000027100	0.000030300	0.000023700	0.000023000	0.000026800	0.000037000	0.000020900	0.000019400	0.000019800	0.000022500	0.000036100	0.000026900	0.000022900	0.000027500	0.000028600	0.000033900	0.000064100	0.000041900	0.000033500	0.000025900	0.000034200	0.000039100
C6H9NO3	143.058259	1.500	0.500	0.17	0.0000	0.0000	0.14	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000020000
C6H8O2S	144.024491	1.333	0.333	0.00	0.1667	0.0000	0.25	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C6H8O4	144.042256	1.333	0.667	0.00	0.0000	0.0000	0.25	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000051500	0.000047800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000047800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000041100	0.000038300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H8O	144.057531	0.800	0.100	0.00	0.0000	0.0000	0.68	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022200	0.000022000	0.000000000	0.000020600	0.000000000	0.000023700	0.000000000	0.000022400	0.000027200	0.000000000	0.000023100	0.000000000	0.000023800	0.000019100	0.000000000	0.000019400	0.000019100	0.000020300	0.000018600	0.000020800	0.000021800	0.000000000	0.000000000	0.000024700	0.000037300	0.000020200	0.000000000	0.000000000	0.000000000	0.000031700	0.000035600	0.000032900	0.000034900	0.000040400	0.000045500
C7H12O3	144.078648	1.714	0.429	0.00	0.0000	0.0000	0.09	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026100	0.000000000	0.000000000	0.000022300	0.000021800	0.000000000	0.000034500
C9H7NO	145.052777	0.778	0.111	0.11	0.0000	0.0000	0.73	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000018500	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000026300	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000018200	0.000000000	0.000022200	0.000020800	0.000020200	0.000025900	0.000019100	0.000000000	0.000000000	0.000022200
C5H6O5	146.021530	1.200	1.000	0.00	0.0000	0.0000	0.20	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000000000	0.000021500	0.000000000	0.000000000	0.000019900	0.000026400	0.000018400	0.000023500	0.000035500	0.000029500
C9H6O2	146.036774	0.667	0.222	0.00	0.0000	0.0000	0.75	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000038700	0.000032700	0.000026900	0.000022700	0.000032300	0.000026100	0.000030800	0.000039700	0.000043500	0.000030800	0.000039300	0.000035200	0.000031300	0.000017900	0.000023500	0.000019000	0.000026500	0.000028600	0.000022500	0.000025300	0.000035300	0.000022100	0.000018700	0.000038900	0.000048400	0.000029000	0.000019000	0.000025900	0.000031500	0.000066500	0.000064300	0.000050800	0.000053500	0.000082500	0.000089600
C6H10O2S	146.040137	1.667	0.333	0.00	0.1667	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000025700	0.000018700	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000
C6H10O4	146.057907	1.667	0.667	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000022200	0.000022900	0.000025100	0.000025500	0.000000000	0.000026900	0.000026900	0.000036600	0.000036600	0.000026500	0.000022200	0.000026600	0.000020700	0.000021700	0.000023800	0.000028600	0.000024900	0.000029200	0.000035100	0.000025200	0.000023800	0.000025000	0.000019600	0.000036800	0.000038200	0.000025100	0.000034100	0.000034200	0.000000000	0.000034700	0.000035300	0.000033800	0.000030900	0.000028800	0.000041200
C10H10O	146.073164	1.000	0.100	0.00	0.0000	0.0000	0.58	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000052500	0.000040200	0.000042200	0.000048800	0.000045300	0.000040400	0.000042000	0.000058100	0.000048400	0.000043300	0.000055800	0.000050200	0.000050300	0.000044100	0.000049900	0.000053100	0.000053600	0.000062300	0.000064100	0.000041600	0.000052900	0.000038900	0.000047100	0.000064400	0.000056600	0.000047300	0.000047800	0.000056800	0.000061500	0.000073700	0.000079500	0.000071100	0.000059100	0.000073400	0.000078600
C8H5NO2	147.032038	0.625	0.250	0.13	0.0000	0.0000	0.83	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000022400	0.000000000	0.000000000	0.000021700	0.000024000
C9H9NO	147.068410	1.000	0.111	0.11	0.0000	0.0000	0.60	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023700	0.000000000	0.000000000	0.000023100	0.000000000	0.000026200	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000021800	0.000027100	0.000025500	0.000023900	0.000029400	0.000021000	0.000019700	0.000019800	0.000025700	0.000022400	0.000024700	0.000024900	0.000022200	0.000025200	0.000020500	0.000022800	0.000022900
C8H4O3	148.016045	0.500	0.375	0.00	0.0000	0.0000	0.85	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000028800	0.000019400	0.000000000	0.000021000	0.000027200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000020300	0.000000000	0.000000000	0.000020000	0.000022500	0.000000000	0.000000000	0.000000000	0.000045400	0.000018700	0.000025700	0.000024400	0.000052400	0.000053400
C5H8O5	148.037200	1.600	1.000	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000025000	0.000000000
C9H8O2	148.052451	0.889	0.222	0.00	0.0000	0.0000	0.62	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000080900	0.000070500	0.000052200	0.000063000	0.000059400	0.000055300	0.000064000	0.000066600	0.000078700	0.000080400	0.000068200	0.000080800	0.000067700	0.000040000	0.000055400	0.000055300	0.000060700	0.000064500	0.000060000	0.000065700	0.000066300	0.000055300	0.000041200	0.000083500	0.000082400	0.000062100	0.000060900	0.000073800	0.000072100	0.000123800	0.000116800	0.000092200	0.000082900	0.000138100	0.000131600
C10H12O	148.088826	1.200	0.100	0.00	0.0000	0.0000	0.47	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000070500	0.000081700	0.000065100	0.000082600	0.000075400	0.000074300	0.000073400	0.000083300	0.000092000	0.000094100	0.000075400	0.000095600	0.000076200	0.000071600	0.000086600	0.000081700	0.000082000	0.000092800	0.000097300	0.000069200	0.000074000	0.000069000	0.000059800	0.000097800	0.000097400	0.000076800	0.000087500	0.000088600	0.000079200	0.000121800	0.000107900	0.000110100	0.000081200	0.000097700	0.000102700
C11H16	148.125177	1.455	0.000	0.00	0.0000	0.0000	0.36	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000
C8H7NO2	149.047697	0.875	0.250	0.13	0.0000	0.0000	0.67	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029200	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000024000	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000023700	0.000021800	0.000023700	0.000000000	0.000022600	0.000021700	0.000000000	0.000020900	0.000000000	0.000023500	0.000032000	0.000021600	0.000026600	0.000026000	0.000021800	0.000026200
C9H11NO	149.084065	1.222	0.111	0.11	0.0000	0.0000	0.47	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025700	0.000019500	0.000025900	0.000027800	0.000022000	0.000000000	0.000022900	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000020200	0.000026500	0.000027400	0.000024200	0.000026700	0.000019600	0.000019200	0.000033500	0.000022800	0.000000000	0.000026500	0.000029300	0.000019500	0.000026900	0.000019200	0.000030400	0.000028600	0.000036700	0.000031700	0.000019100	0.000019900
C8H6OS	150.013938	0.750	0.125	0.00	0.1250	0.0000	0.69	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000
C8H6O3	150.031715	0.750	0.375	0.00	0.0000	0.0000	0.69	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000065400	0.000050000	0.000030800	0.000044000	0.000031900	0.000045500	0.000041700	0.000055000	0.000055600	0.000053200	0.000044300	0.000053200	0.000046100	0.000027300	0.000035600	0.000036400	0.000031000	0.000032500	0.000030100	0.000049000	0.000049300	0.000031100	0.000019700	0.000058900	0.000062100	0.000041300	0.000029400	0.000052200	0.000041700	0.000087000	0.000080500	0.000068800	0.000062000	0.000114000	0.000123700
C9H10O2	150.068075	1.111	0.222	0.00	0.0000	0.0000	0.50	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000176600	0.000172400	0.000128800	0.000147400	0.000134600	0.000149700	0.000145200	0.000188500	0.000186800	0.000173000	0.000175800	0.000185700	0.000166400	0.000126700	0.000148100	0.000146300	0.000132000	0.000168100	0.000181500	0.000147800	0.000158700	0.000126500	0.000118800	0.000188200	0.000198400	0.000155100	0.000141100	0.000165900	0.000164100	0.000280400	0.000272600	0.000221400	0.000199700	0.000273700	0.000289600
C10H14O	150.104477	1.400	0.100	0.00	0.0000	0.0000	0.37	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000101400	0.000117400	0.000084000	0.000105000	0.000104300	0.000112300	0.000117800	0.000123400	0.000125000	0.000119400	0.000106600	0.000124800	0.000101200	0.000121600	0.000140600	0.000121800	0.000119400	0.000131000	0.000159000	0.000092200	0.000099500	0.000101100	0.000101500	0.000127400	0.000122200	0.000111800	0.000115200	0.000111800	0.000117200	0.000155500	0.000140900	0.000128500	0.000101600	0.000116000	0.000130700
C8H9NO2	151.063352	1.125	0.250	0.13	0.0000	0.0000	0.50	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000029200	0.000024000	0.000024200	0.000029700	0.000030400	0.000027100	0.000030400	0.000000000	0.000026700	0.000019200	0.000000000	0.000027900	0.000023100	0.000000000	0.000023300	0.000031000	0.000024600	0.000023800	0.000026200	0.000025700	0.000027900	0.000030700	0.000000000	0.000034100	0.000022600	0.000027200	0.000022300	0.000034800	0.000030800	0.000055000	0.000046200	0.000044000	0.000038900	0.000032500	0.000034500
C9H13NO	151.099728	1.444	0.111	0.11	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000020900	0.000000000	0.000000000	0.000026900	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000026600	0.000019400	0.000000000	0.000022400	0.000019400	0.000022700	0.000019000	0.000024900	0.000000000	0.000020900	0.000000000	0.000000000	0.000027400	0.000021400	0.000028800	0.000023000	0.000026300	0.000019900	0.000000000	0.000000000
C7H4O4	152.010988	0.571	0.571	0.00	0.0000	0.0000	0.80	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037700	0.000024900	0.000000000	0.000018100	0.000020600	0.000018800	0.000000000	0.000025400	0.000025900	0.000019700	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000026000	0.000000000	0.000000000	0.000019700	0.000019300	0.000000000	0.000000000	0.000023700	0.000000000	0.000019400	0.000021100	0.000034700	0.000024200	0.000053800	0.000052500
C8H8OS	152.029584	1.000	0.125	0.00	0.1250	0.0000	0.54	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000021100	0.000030800	0.000022600	0.000000000	0.000025500	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000028500	0.000000000	0.000000000	0.000000000	0.000025000	0.000028500	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000029700	0.000032200	0.000000000	0.000019300	0.000029900	0.000028300	0.000000000	0.000000000
C8H8O3	152.047368	1.000	0.375	0.00	0.0000	0.0000	0.54	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000120300	0.000109100	0.000077100	0.000096400	0.000078400	0.000094200	0.000091600	0.000125200	0.000128200	0.000114000	0.000112100	0.000130300	0.000118800	0.000070700	0.000076000	0.000071400	0.000072000	0.000099900	0.000094600	0.000103200	0.000099500	0.000073600	0.000063700	0.000119200	0.000129200	0.000085100	0.000077600	0.000102200	0.000109200	0.000163900	0.000163700	0.000154000	0.000131800	0.000212500	0.000221500
C9H12O2	152.083751	1.333	0.222	0.00	0.0000	0.0000	0.38	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000150100	0.000165600	0.000120900	0.000143400	0.000131400	0.000140400	0.000129600	0.000164500	0.000176900	0.000179400	0.000144900	0.000177900	0.000154900	0.000133100	0.000151200	0.000140800	0.000145900	0.000156000	0.000174200	0.000127800	0.000124500	0.000115200	0.000106100	0.000162700	0.000175500	0.000143100	0.000135900	0.000140200	0.000144200	0.000256300	0.000231700	0.000186900	0.000134500	0.000191600	0.000196500
C10H16O	152.120134	1.600	0.100	0.00	0.0000	0.0000	0.26	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000046700	0.000054200	0.000038300	0.000057400	0.000055600	0.000046000	0.000049700	0.000066900	0.000062700	0.000054400	0.000055200	0.000064900	0.000043100	0.000067800	0.000061700	0.000074500	0.000064500	0.000073500	0.000074800	0.000046300	0.000054300	0.000048300	0.000044800	0.000063300	0.000064900	0.000050400	0.000060400	0.000054900	0.000053600	0.000086000	0.000071500	0.000064200	0.000051400	0.000051200	0.000052100
C7H7NO3	153.042605	1.000	0.429	0.14	0.0000	0.0000	0.56	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033400	0.000023300	0.000019600	0.000025200	0.000028500	0.000025100	0.000000000	0.000023100	0.000025800	0.000027400	0.000024300	0.000022300	0.000023200	0.000022400	0.000018200	0.000020800	0.000000000	0.000021400	0.000000000	0.000018900	0.000022200	0.000021100	0.000021700	0.000032000	0.000025700	0.000028400	0.000019300	0.000018300	0.000020900	0.000060300	0.000051600	0.000029400	0.000037400	0.000048400	0.000045200
C8H11NO2	153.078975	1.375	0.250	0.13	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000035100	0.000018500	0.000024800	0.000037300	0.000019900	0.000026400	0.000023700	0.000027400	0.000029800	0.000028300	0.000000000	0.000021100	0.000000000	0.000024100	0.000020400	0.000033200	0.000032300	0.000000000	0.000026900	0.000023300	0.000023700	0.000033300	0.000034500	0.000027500	0.000032400	0.000028200	0.000039900	0.000034500	0.000038500	0.000055300	0.000040700	0.000045600	0.000038900	0.000036900	0.000040200
C7H6O4	154.026623	0.857	0.571	0.00	0.0000	0.0000	0.60	5	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000128000	0.000093800	0.000075500	0.000096200	0.000085300	0.000074800	0.000084000	0.000117400	0.000118900	0.000113500	0.000111400	0.000095700	0.000102100	0.000055800	0.000063000	0.000048800	0.000062400	0.000072000	0.000067200	0.000106700	0.000109400	0.000058600	0.000052400	0.000114000	0.000127100	0.000064700	0.000063400	0.000097300	0.000101900	0.000135400	0.000121500	0.000152000	0.000158000	0.000235600	0.000227300
C8H10OS	154.045235	1.250	0.125	0.00	0.1250	0.0000	0.38	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018600	0.000000000	0.000022600	0.000029600	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000020600	0.000000000	0.000025600	0.000021100	0.000023000	0.000023800	0.000030400	0.000038000	0.000024200	0.000000000	0.000000000	0.000000000	0.000022600	0.000030800	0.000027800	0.000000000	0.000000000	0.000024500	0.000023000	0.000000000	0.000000000
C8H10O3	154.063012	1.250	0.375	0.00	0.0000	0.0000	0.38	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000125000	0.000143700	0.000100500	0.000115700	0.000000000	0.000000000	0.000000000	0.000142700	0.000141500	0.000000000	0.000118200	0.000143800	0.000000000	0.000000000	0.000110700	0.000000000	0.000107500	0.000125800	0.000126400	0.000107800	0.000103600	0.000000000	0.000000000	0.000000000	0.000000000	0.000107900	0.000110400	0.000000000	0.000000000	0.000213200	0.000187500	0.000151400	0.000000000	0.000194200	0.000197400
C9H14O2	154.099375	1.556	0.222	0.00	0.0000	0.0000	0.25	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000114800	0.000115400	0.000099800	0.000117200	0.000117200	0.000117000	0.000112300	0.000128700	0.000123900	0.000129800	0.000112800	0.000125700	0.000110300	0.000123000	0.000126800	0.000146900	0.000125500	0.000150100	0.000166800	0.000113300	0.000097600	0.000115600	0.000111100	0.000133900	0.000133000	0.000124100	0.000120300	0.000134000	0.000137000	0.000251400	0.000192100	0.000149900	0.000126900	0.000157500	0.000178100
C6H5NO4	155.021877	0.833	0.667	0.17	0.0000	0.0000	0.67	5	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000021000	0.000024200	0.000022200	0.000025800	0.000029900
C7H9NO3	155.058254	1.286	0.429	0.14	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033200	0.000000000	0.000019000	0.000019300	0.000000000	0.000023100	0.000000000	0.000020300	0.000028400	0.000019600	0.000022000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000019500	0.000021800	0.000021600	0.000022100	0.000000000	0.000020500	0.000029600	0.000025300	0.000021800	0.000000000	0.000029800	0.000025300	0.000049100	0.000036200	0.000023700	0.000031800	0.000033000	0.000033000
C6H4O5	156.005876	0.667	0.833	0.00	0.0000	0.0000	0.71	5	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000019300	0.000020700	0.000000000	0.000042900	0.000037700
C7H8O2S	156.024494	1.143	0.286	0.00	0.1429	0.0000	0.40	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000032200	0.000019700	0.000000000	0.000018500	0.000000000	0.000000000	0.000027900	0.000028100	0.000000000	0.000022600	0.000000000	0.000000000	0.000030100	0.000028100	0.000000000	0.000000000	0.000031300	0.000000000	0.000000000	0.000000000
C7H8O4	156.042257	1.143	0.571	0.00	0.0000	0.0000	0.40	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000108300	0.000094200	0.000062800	0.000075500	0.000000000	0.000000000	0.000000000	0.000000000	0.000093800	0.000000000	0.000085400	0.000000000	0.000081100	0.000051500	0.000000000	0.000060200	0.000000000	0.000000000	0.000059300	0.000075000	0.000069200	0.000050200	0.000038800	0.000097300	0.000101700	0.000068800	0.000054900	0.000082800	0.000000000	0.000136100	0.000131400	0.000108900	0.000100000	0.000163000	0.000169100
C8H12OS	156.060898	1.500	0.125	0.00	0.1250	0.0000	0.23	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000
C8H12O3	156.078666	1.500	0.375	0.00	0.0000	0.0000	0.23	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000059400	0.000000000	0.000048700	0.000060300	0.000065100	0.000000000	0.000059700	0.000060000	0.000000000	0.000054600	0.000049800	0.000071300	0.000061900	0.000063500	0.000000000	0.000000000	0.000000000	0.000000000	0.000085200	0.000055600	0.000058500	0.000000000	0.000043300	0.000000000	0.000000000	0.000000000	0.000069400	0.000053800	0.000000000	0.000124800	0.000111500	0.000078700	0.000061100	0.000000000	0.000091500
C9H16O2	156.115048	1.778	0.222	0.00	0.0000	0.0000	0.12	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000019900	0.000021300	0.000022700	0.000020000	0.000000000	0.000026100	0.000018900	0.000030000	0.000029500	0.000018500	0.000019000	0.000024200	0.000020300	0.000028700	0.000026300	0.000029900	0.000026700	0.000035000	0.000035600	0.000026700	0.000018600	0.000032500	0.000030000	0.000025500	0.000020800	0.000020600	0.000018600	0.000027600	0.000022500	0.000047800	0.000044300	0.000024900	0.000020300	0.000026500	0.000026900
C6H7NO4	157.037529	1.167	0.667	0.17	0.0000	0.0000	0.33	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000020000	0.000000000	0.000000000	0.000019700	0.000025400
C7H11NO3	157.073888	1.571	0.429	0.14	0.0000	0.0000	0.11	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000018800	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000019000	0.000020600	0.000000000	0.000019200	0.000000000	0.000018500	0.000026300	0.000024200	0.000021800	0.000000000	0.000000000
C6H6O5	158.021550	1.000	0.833	0.00	0.0000	0.0000	0.43	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000035300	0.000019300	0.000023600	0.000000000	0.000000000	0.000026100	0.000000000	0.000023100	0.000027000	0.000025300	0.000024000	0.000019400	0.000025200	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000026000	0.000000000	0.000000000	0.000031500	0.000029100	0.000000000	0.000029400	0.000000000	0.000020100	0.000050300	0.000042100	0.000027500	0.000027500	0.000064500	0.000055600
C10H6O2	158.036784	0.600	0.200	0.00	0.0000	0.0000	0.78	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000027400	0.000023800
C7H10O4	158.057932	1.429	0.571	0.00	0.0000	0.0000	0.20	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000046600	0.000061100	0.000029900	0.000049200	0.000041200	0.000035300	0.000044700	0.000061100	0.000055900	0.000051400	0.000053600	0.000057000	0.000000000	0.000034500	0.000000000	0.000044400	0.000043200	0.000041000	0.000047700	0.000047400	0.000037500	0.000000000	0.000033700	0.000059700	0.000055200	0.000052200	0.000047200	0.000000000	0.000041200	0.000077600	0.000079300	0.000064700	0.000044500	0.000082300	0.000079800
C11H10O	158.073162	0.909	0.091	0.00	0.0000	0.0000	0.62	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000044900	0.000049200	0.000037700	0.000049600	0.000043100	0.000048600	0.000049000	0.000057100	0.000049900	0.000049500	0.000046500	0.000058400	0.000046800	0.000042200	0.000046000	0.000047400	0.000044000	0.000055300	0.000058500	0.000051200	0.000049900	0.000042300	0.000041200	0.000060000	0.000064400	0.000049400	0.000041800	0.000050700	0.000051300	0.000080300	0.000083500	0.000063500	0.000064600	0.000076700	0.000078500
C8H14O3	158.094322	1.750	0.375	0.00	0.0000	0.0000	0.08	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000018300	0.000000000	0.000000000	0.000018700	0.000024800	0.000028500	0.000020900	0.000023000	0.000000000	0.000000000	0.000020300	0.000026400	0.000000000	0.000024200	0.000020100	0.000030200	0.000026100	0.000026500	0.000031600	0.000019100	0.000022800	0.000027400	0.000000000	0.000018700	0.000018900	0.000026700	0.000025900	0.000020500	0.000021600	0.000031600	0.000024700	0.000022300	0.000021400	0.000023700	0.000026100
C10H9NO	159.068415	0.900	0.100	0.10	0.0000	0.0000	0.65	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000026100	0.000023400	0.000024000	0.000031100	0.000000000	0.000000000	0.000019500	0.000022600	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000021100	0.000023300	0.000030700	0.000034300	0.000031700	0.000020200	0.000021500	0.000026600	0.000035300	0.000020600	0.000024800	0.000027700	0.000025800	0.000039400	0.000027900	0.000032600	0.000027900	0.000032900	0.000037000	0.000035400	0.000000000	0.000000000
C6H8O5	160.037190	1.333	0.833	0.00	0.0000	0.0000	0.14	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000039800	0.000043500	0.000035100	0.000035000	0.000034000	0.000031500	0.000024200	0.000039700	0.000036800	0.000037500	0.000025500	0.000030500	0.000039400	0.000024800	0.000000000	0.000020700	0.000000000	0.000028200	0.000021100	0.000025800	0.000021200	0.000018800	0.000000000	0.000040100	0.000047000	0.000027100	0.000021100	0.000031300	0.000029700	0.000045200	0.000051100	0.000042000	0.000031400	0.000065100	0.000053000
C10H8O2	160.052459	0.800	0.200	0.00	0.0000	0.0000	0.67	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000084800	0.000066800	0.000054600	0.000063200	0.000061000	0.000064600	0.000060900	0.000083700	0.000088600	0.000073900	0.000076600	0.000086100	0.000070100	0.000059900	0.000047700	0.000060800	0.000038300	0.000065300	0.000064200	0.000069500	0.000072400	0.000043800	0.000049200	0.000088900	0.000077100	0.000059600	0.000060200	0.000066700	0.000066600	0.000105100	0.000099100	0.000095700	0.000084000	0.000133200	0.000143300
C9H8N2O	160.063667	0.889	0.111	0.22	0.0000	0.0000	0.69	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000024300	0.000000000	0.000021000	0.000000000	0.000000000
C7H12O4	160.073553	1.714	0.571	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000023000	0.000000000	0.000000000	0.000026300	0.000022700	0.000000000	0.000031400	0.000029700	0.000025300	0.000025200	0.000018600	0.000022600	0.000024600	0.000023300	0.000027500	0.000022100	0.000030500	0.000032700	0.000000000	0.000019600	0.000026400	0.000000000	0.000023500	0.000023600	0.000027800	0.000023300	0.000025200	0.000020000	0.000030300	0.000000000	0.000025600	0.000000000	0.000027800	0.000022900
C11H12O	160.088821	1.091	0.091	0.00	0.0000	0.0000	0.52	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000064500	0.000069700	0.000057100	0.000080500	0.000077100	0.000069500	0.000061500	0.000072600	0.000076400	0.000075600	0.000066300	0.000081800	0.000061100	0.000064900	0.000079800	0.000069800	0.000071100	0.000085200	0.000092500	0.000063300	0.000068600	0.000068300	0.000059000	0.000077300	0.000084200	0.000070100	0.000079300	0.000079200	0.000073600	0.000096300	0.000094200	0.000085200	0.000078700	0.000071100	0.000086800
C9H7NO2	161.047704	0.778	0.222	0.11	0.0000	0.0000	0.71	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000021800	0.000022100	0.000025500	0.000026400	0.000000000	0.000029200	0.000031100	0.000021900	0.000030100	0.000023800	0.000026800	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000020300	0.000023900	0.000022400	0.000020300	0.000023300	0.000028700	0.000028700	0.000028900	0.000023000	0.000028400	0.000026100	0.000037200	0.000032200	0.000032500	0.000035100	0.000032600
C10H11NO	161.084066	1.100	0.100	0.10	0.0000	0.0000	0.53	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020900	0.000022100	0.000000000	0.000019600	0.000024000	0.000000000	0.000019700	0.000000000	0.000023600	0.000020100	0.000019000	0.000000000	0.000000000	0.000024700	0.000000000	0.000025500	0.000017900	0.000025500	0.000018900	0.000020000	0.000028600	0.000032200	0.000030700	0.000029800	0.000022900	0.000022500	0.000032500	0.000029400	0.000034900	0.000037800	0.000032000	0.000026900	0.000019800	0.000020700	0.000021700
C9H6O3	162.031720	0.667	0.333	0.00	0.0000	0.0000	0.73	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000080900	0.000064900	0.000044600	0.000043700	0.000051000	0.000055300	0.000050300	0.000065500	0.000078600	0.000062800	0.000060300	0.000063500	0.000054700	0.000026200	0.000033200	0.000033100	0.000036700	0.000042000	0.000046800	0.000057800	0.000060900	0.000044600	0.000036100	0.000070700	0.000067200	0.000042600	0.000046200	0.000054900	0.000050600	0.000114100	0.000094200	0.000079400	0.000074500	0.000166400	0.000162200
C6H10O5	162.052817	1.667	0.833	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028700	0.000022800	0.000000000	0.000000000	0.000000000	0.000023600
C10H10O2	162.068074	1.000	0.200	0.00	0.0000	0.0000	0.56	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000178700	0.000166700	0.000140000	0.000162600	0.000155700	0.000162400	0.000149500	0.000190000	0.000185900	0.000190500	0.000171700	0.000190900	0.000169800	0.000127000	0.000141500	0.000147400	0.000137000	0.000172300	0.000186300	0.000159300	0.000148100	0.000139200	0.000125300	0.000180000	0.000201000	0.000153600	0.000160000	0.000174800	0.000181300	0.000262000	0.000245300	0.000214600	0.000207100	0.000264300	0.000265100
C11H14O	162.104487	1.273	0.091	0.00	0.0000	0.0000	0.43	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000082900	0.000114400	0.000066900	0.000097300	0.000098600	0.000089600	0.000093700	0.000113300	0.000109700	0.000117600	0.000101500	0.000127700	0.000091300	0.000102600	0.000115500	0.000103600	0.000102700	0.000108100	0.000119000	0.000080000	0.000086900	0.000083800	0.000082700	0.000123600	0.000099700	0.000105800	0.000093400	0.000095300	0.000091200	0.000131200	0.000123600	0.000110700	0.000076100	0.000100100	0.000095500
C8H5NO3	163.026944	0.625	0.375	0.13	0.0000	0.0000	0.82	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019200	0.000000000	0.000000000	0.000018000	0.000000000	0.000021900	0.000000000	0.000000000	0.000029100	0.000018600	0.000018700	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000020100	0.000021400	0.000000000	0.000000000	0.000019700	0.000000000	0.000024300	0.000022900	0.000020300	0.000000000	0.000038800	0.000028200
C9H9NO2	163.063353	1.000	0.222	0.11	0.0000	0.0000	0.57	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036100	0.000031600	0.000034400	0.000033700	0.000030800	0.000039300	0.000028100	0.000033500	0.000027500	0.000022300	0.000032000	0.000032900	0.000032200	0.000026700	0.000036100	0.000035000	0.000035600	0.000040600	0.000027100	0.000030500	0.000036200	0.000037800	0.000035000	0.000029300	0.000038300	0.000033900	0.000037800	0.000037200	0.000030600	0.000062800	0.000053800	0.000043200	0.000043600	0.000043100	0.000042100
C10H13NO	163.099739	1.300	0.100	0.10	0.0000	0.0000	0.41	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000025400	0.000000000	0.000019700	0.000018700	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000021300	0.000029200	0.000025100	0.000023500	0.000031300	0.000019700	0.000027200	0.000018700	0.000027900	0.000022300	0.000025000	0.000023700	0.000021700	0.000022900	0.000030300	0.000026400	0.000026700	0.000034400	0.000035100	0.000035300	0.000024500	0.000025700	0.000000000
C8H4O4	164.010966	0.500	0.500	0.00	0.0000	0.0000	0.83	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000039600	0.000035300	0.000019200	0.000022800	0.000027500	0.000021000	0.000023300	0.000037700	0.000036700	0.000034000	0.000036700	0.000027700	0.000028000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000032400	0.000029300	0.000000000	0.000000000	0.000025300	0.000036600	0.000000000	0.000000000	0.000022500	0.000025600	0.000046600	0.000044000	0.000050900	0.000042500	0.000094800	0.000095700
C9H8OS	164.029618	0.889	0.111	0.00	0.1111	0.0000	0.60	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022100	0.000000000	0.000022300	0.000030200	0.000022000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000019000	0.000000000	0.000000000	0.000021800	0.000022300	0.000024500	0.000021900	0.000017900	0.000000000	0.000000000	0.000019800	0.000019400	0.000019900	0.000000000	0.000000000	0.000029000	0.000026900	0.000000000	0.000000000
C9H8O3	164.047340	0.889	0.333	0.00	0.0000	0.0000	0.60	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000154400	0.000135600	0.000109600	0.000116600	0.000114600	0.000115100	0.000104600	0.000155100	0.000155400	0.000144900	0.000133500	0.000149700	0.000140200	0.000086500	0.000098500	0.000089200	0.000091800	0.000119300	0.000117000	0.000134200	0.000124300	0.000084700	0.000078600	0.000142600	0.000152500	0.000120500	0.000111000	0.000133700	0.000127700	0.000212700	0.000196700	0.000184900	0.000179800	0.000295000	0.000301000
C8H8N2O2	164.058589	1.000	0.250	0.25	0.0000	0.0000	0.60	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000024300	0.000018600	0.000000000	0.000018500	0.000000000	0.000000000
C10H12O2	164.083724	1.200	0.200	0.00	0.0000	0.0000	0.44	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000239500	0.000261400	0.000199100	0.000241200	0.000228900	0.000228200	0.000213200	0.000289600	0.000276400	0.000276000	0.000249300	0.000289300	0.000251100	0.000209000	0.000232100	0.000242900	0.000223600	0.000271900	0.000279200	0.000214800	0.000215600	0.000204300	0.000190400	0.000265000	0.000290100	0.000255600	0.000243400	0.000255200	0.000258300	0.000381700	0.000350100	0.000303400	0.000266700	0.000324900	0.000332300
C11H16O	164.120116	1.455	0.091	0.00	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000086200	0.000124100	0.000102200	0.000116500	0.000113900	0.000119700	0.000106300	0.000140400	0.000121100	0.000125600	0.000109200	0.000132500	0.000107500	0.000128200	0.000136900	0.000131600	0.000124800	0.000128700	0.000161600	0.000105400	0.000105200	0.000109400	0.000100100	0.000127200	0.000119900	0.000117700	0.000102600	0.000123200	0.000121800	0.000139800	0.000134600	0.000121800	0.000117200	0.000115800	0.000114300
C8H7NO3	165.042593	0.875	0.375	0.13	0.0000	0.0000	0.64	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000030200	0.000020100	0.000000000	0.000032100	0.000026800	0.000029800	0.000023800	0.000037500	0.000023200	0.000023200	0.000000000	0.000024200	0.000000000	0.000018000	0.000018500	0.000019700	0.000029800	0.000020200	0.000000000	0.000020100	0.000024500	0.000022600	0.000023600	0.000030500	0.000027700	0.000022900	0.000000000	0.000031500	0.000026300	0.000040000	0.000042300	0.000034600	0.000038800	0.000040300	0.000050400
C9H11NO2	165.078976	1.222	0.222	0.11	0.0000	0.0000	0.43	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000055100	0.000038200	0.000047300	0.000045400	0.000041800	0.000035800	0.000044300	0.000042000	0.000038400	0.000035100	0.000033600	0.000033300	0.000040900	0.000041400	0.000033000	0.000052900	0.000047800	0.000054000	0.000047300	0.000049600	0.000042500	0.000060300	0.000048300	0.000044200	0.000054800	0.000042800	0.000041000	0.000056300	0.000048200	0.000073500	0.000073000	0.000065700	0.000057800	0.000053600	0.000045900
C10H15NO	165.115355	1.500	0.100	0.10	0.0000	0.0000	0.29	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000021700	0.000026400	0.000000000	0.000021300	0.000000000	0.000018300	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000021100	0.000027600	0.000031100	0.000024000	0.000000000	0.000000000	0.000000000	0.000025500	0.000000000	0.000019900	0.000022600	0.000019400	0.000022700	0.000023200	0.000022700	0.000022700	0.000000000	0.000025000	0.000000000	0.000000000	0.000021700
C8H6O2S	166.008877	0.750	0.250	0.00	0.1250	0.0000	0.67	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000021100	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000020200	0.000019600	0.000031500	0.000019100	0.000000000	0.000000000	0.000029600	0.000000000	0.000000000	0.000000000
C8H6O4	166.026625	0.750	0.500	0.00	0.0000	0.0000	0.67	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000131200	0.000154400	0.000121700	0.000132900	0.000099700	0.000113100	0.000147100	0.000136900	0.000303400	0.000164200	0.000164500	0.000187700	0.000119900	0.000102300	0.000130400	0.000135500	0.000102900	0.000129700	0.000096700	0.000157600	0.000077000	0.000181100	0.000105500	0.000129500	0.000136900	0.000144500	0.000143400	0.000117000	0.000070800	0.000307000	0.000179900	0.000149900	0.000112200	0.000249500	0.000271000
C9H10OS	166.045246	1.111	0.111	0.00	0.1111	0.0000	0.47	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000029700	0.000021200	0.000023400	0.000037300	0.000027300	0.000031000	0.000025600	0.000000000	0.000022700	0.000020700	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000034500	0.000040400	0.000020700	0.000024800	0.000025000	0.000036300	0.000038000	0.000042600	0.000031000	0.000022600	0.000024400	0.000020700	0.000039500	0.000039400	0.000000000	0.000000000	0.000027900	0.000025300	0.000000000	0.000000000
C9H10O3	166.063022	1.111	0.333	0.00	0.0000	0.0000	0.47	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000175600	0.000169400	0.000133600	0.000152700	0.000146000	0.000156400	0.000145100	0.000185700	0.000179300	0.000175400	0.000178700	0.000200100	0.000172600	0.000125000	0.000130800	0.000145400	0.000137000	0.000153000	0.000162200	0.000144700	0.000150600	0.000115500	0.000115000	0.000183300	0.000196700	0.000157500	0.000155900	0.000157300	0.000166200	0.000281800	0.000252500	0.000232900	0.000179900	0.000283800	0.000283800
C8H10N2O2	166.074248	1.250	0.250	0.25	0.0000	0.0000	0.40	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000020800	0.000024500	0.000000000	0.000019200	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000
C10H14O2	166.099409	1.400	0.200	0.00	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000165800	0.000191400	0.000151700	0.000176300	0.000177800	0.000183900	0.000168100	0.000206600	0.000216300	0.000200900	0.000177500	0.000225100	0.000172100	0.000186500	0.000192400	0.000201400	0.000182200	0.000201900	0.000221800	0.000154300	0.000165600	0.000163200	0.000149700	0.000204800	0.000211400	0.000190500	0.000183300	0.000182100	0.000188000	0.000282100	0.000255100	0.000216500	0.000169700	0.000212700	0.000208000
C11H18O	166.135784	1.636	0.091	0.00	0.0000	0.0000	0.24	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000033400	0.000042400	0.000035800	0.000039700	0.000038200	0.000048400	0.000036000	0.000039800	0.000038800	0.000045700	0.000046200	0.000043900	0.000047600	0.000054100	0.000057400	0.000050800	0.000048100	0.000055100	0.000060400	0.000035300	0.000043600	0.000044200	0.000039600	0.000041900	0.000041900	0.000048900	0.000041500	0.000037700	0.000041100	0.000050200	0.000044500	0.000046900	0.000040100	0.000030000	0.000041200
C7H5NO4	167.021856	0.714	0.571	0.14	0.0000	0.0000	0.75	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000
C8H9NOS	167.040511	1.125	0.125	0.13	0.1250	0.0000	0.45	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000
C8H9NO3	167.058247	1.125	0.375	0.13	0.0000	0.0000	0.45	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000048200	0.000030100	0.000038200	0.000030600	0.000032700	0.000034800	0.000031100	0.000037900	0.000033500	0.000028500	0.000020400	0.000027800	0.000034300	0.000029900	0.000022100	0.000034200	0.000025000	0.000027300	0.000030500	0.000030400	0.000022900	0.000039200	0.000032700	0.000031500	0.000047500	0.000032600	0.000028600	0.000040200	0.000040500	0.000065500	0.000056900	0.000047900	0.000050100	0.000051400	0.000045500
C9H13NO2	167.094659	1.444	0.222	0.11	0.0000	0.0000	0.29	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000026700	0.000000000	0.000026300	0.000021500	0.000022400	0.000019900	0.000022000	0.000000000	0.000000000	0.000018900	0.000019200	0.000024900	0.000020400	0.000018800	0.000026000	0.000022500	0.000025300	0.000000000	0.000021400	0.000019900	0.000028300	0.000024800	0.000031300	0.000024800	0.000024900	0.000020500	0.000024500	0.000027700	0.000024100	0.000042100	0.000028800	0.000034900	0.000030400	0.000021300	0.000020700
C7H4O5	168.005865	0.571	0.714	0.00	0.0000	0.0000	0.78	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000019800	0.000000000	0.000000000	0.000023500	0.000000000	0.000022100	0.000018700	0.000044100	0.000039400
C8H8O2S	168.024532	1.000	0.250	0.00	0.1250	0.0000	0.50	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018300	0.000000000	0.000000000	0.000022500	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000036800	0.000023500	0.000000000	0.000000000	0.000000000	0.000023200	0.000019100	0.000019700	0.000019000	0.000029800	0.000000000	0.000000000	0.000029000	0.000030700	0.000024800	0.000000000	0.000027500	0.000033700	0.000000000	0.000023100
C8H8O4	168.042279	1.000	0.500	0.00	0.0000	0.0000	0.50	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000117400	0.000097500	0.000080100	0.000073500	0.000055500	0.000067800	0.000067600	0.000100500	0.000111900	0.000102900	0.000086300	0.000105300	0.000095900	0.000065400	0.000060900	0.000055600	0.000055400	0.000066300	0.000072300	0.000084800	0.000097200	0.000056800	0.000051600	0.000097600	0.000102400	0.000066300	0.000067600	0.000084800	0.000085000	0.000143200	0.000136500	0.000124500	0.000110600	0.000213800	0.000213500
C7H8N2O3	168.053507	1.143	0.429	0.29	0.0000	0.0000	0.43	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000
C9H12OS	168.060884	1.333	0.111	0.00	0.1111	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023600	0.000000000	0.000030500	0.000038300	0.000018900	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000042600	0.000023600	0.000019100	0.000021300	0.000031700	0.000026100	0.000040500	0.000046500	0.000000000	0.000034000	0.000023400	0.000021800	0.000032900	0.000042100	0.000000000	0.000000000	0.000034000	0.000018700	0.000000000	0.000000000
C9H12O3	168.078664	1.333	0.333	0.00	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000160800	0.000180300	0.000134600	0.000147800	0.000150700	0.000151700	0.000142000	0.000180100	0.000176800	0.000176600	0.000151000	0.000179800	0.000153500	0.000149300	0.000159900	0.000166500	0.000149600	0.000179500	0.000190400	0.000134900	0.000145300	0.000130600	0.000127000	0.000178600	0.000174400	0.000169100	0.000156300	0.000157900	0.000152300	0.000301500	0.000278300	0.000193200	0.000152000	0.000226400	0.000235900
C10H16O2	168.115026	1.600	0.200	0.00	0.0000	0.0000	0.22	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000103200	0.000105600	0.000106200	0.000129200	0.000126400	0.000127700	0.000108300	0.000130900	0.000121400	0.000122500	0.000101700	0.000122200	0.000092600	0.000129800	0.000145800	0.000134100	0.000134700	0.000151500	0.000157700	0.000118100	0.000106800	0.000117200	0.000111800	0.000133400	0.000137200	0.000121500	0.000113300	0.000134200	0.000127500	0.000203200	0.000169100	0.000146900	0.000134700	0.000129100	0.000145400
C7H7NO4	169.037539	1.000	0.571	0.14	0.0000	0.0000	0.50	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000024500	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000027700	0.000036600	0.000024400	0.000018600	0.000033000	0.000028700
C8H11NOS	169.056135	1.375	0.125	0.13	0.1250	0.0000	0.27	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H11NO3	169.073888	1.375	0.375	0.13	0.0000	0.0000	0.27	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000036400	0.000026800	0.000027100	0.000038200	0.000025600	0.000025000	0.000023500	0.000021900	0.000032800	0.000018700	0.000000000	0.000021400	0.000020500	0.000024700	0.000022700	0.000028700	0.000039900	0.000031300	0.000026400	0.000031200	0.000038100	0.000045200	0.000028100	0.000036500	0.000029000	0.000031800	0.000028400	0.000037700	0.000045000	0.000061700	0.000047200	0.000045900	0.000053700	0.000039400	0.000039900
C7H6O3S	170.003755	0.857	0.429	0.00	0.1429	0.0000	0.56	5	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000022200	0.000000000	0.000000000	0.000022800	0.000020500	0.000000000	0.000000000	0.000018400	0.000020000	0.000000000	0.000000000
C7H6O5	170.021519	0.857	0.714	0.00	0.0000	0.0000	0.56	5	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000058800	0.000045300	0.000035200	0.000035400	0.000031000	0.000034000	0.000031400	0.000052700	0.000045800	0.000042800	0.000045400	0.000045900	0.000044100	0.000019100	0.000000000	0.000021400	0.000000000	0.000025100	0.000021500	0.000036500	0.000044000	0.000000000	0.000000000	0.000040300	0.000049000	0.000023600	0.000029300	0.000027100	0.000033100	0.000054200	0.000055300	0.000054400	0.000062300	0.000104400	0.000114500
C8H10O2S	170.040159	1.250	0.250	0.00	0.1250	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028800	0.000025900	0.000000000	0.000000000	0.000000000	0.000023300	0.000026900	0.000032600	0.000000000	0.000020000	0.000027000	0.000000000	0.000027400	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000
C8H10O4	170.057935	1.250	0.500	0.00	0.0000	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000095500	0.000098400	0.000068600	0.000076500	0.000077700	0.000000000	0.000000000	0.000086400	0.000094600	0.000090200	0.000091900	0.000000000	0.000092500	0.000000000	0.000000000	0.000064400	0.000068200	0.000078700	0.000079200	0.000080700	0.000077800	0.000064000	0.000055300	0.000097300	0.000099300	0.000078900	0.000073900	0.000071900	0.000080100	0.000148600	0.000146100	0.000111500	0.000085300	0.000137000	0.000145300
C12H10O	170.073157	0.833	0.083	0.00	0.0000	0.0000	0.65	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031600	0.000024900	0.000022600	0.000022500	0.000031100	0.000026900	0.000033900	0.000025700	0.000029800	0.000022400	0.000025400	0.000029100	0.000029000	0.000023500	0.000022600	0.000023000	0.000023000	0.000024900	0.000019400	0.000025900	0.000036300	0.000022200	0.000027600	0.000022100	0.000033100	0.000022400	0.000026300	0.000036900	0.000025700	0.000045300	0.000038700	0.000044400	0.000035600	0.000044500	0.000048400
C9H14O3	170.094302	1.556	0.333	0.00	0.0000	0.0000	0.20	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000079200	0.000089200	0.000074200	0.000086900	0.000087900	0.000094700	0.000087700	0.000097400	0.000089800	0.000085500	0.000070300	0.000094200	0.000077600	0.000093400	0.000100700	0.000113200	0.000097400	0.000127900	0.000130500	0.000085800	0.000082000	0.000092600	0.000072600	0.000098000	0.000096000	0.000099000	0.000094900	0.000099300	0.000097200	0.000208100	0.000159600	0.000111500	0.000090900	0.000118900	0.000133500
C10H18O2	170.130680	1.800	0.200	0.00	0.0000	0.0000	0.11	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000020300	0.000022000	0.000028400	0.000021300	0.000000000	0.000026000	0.000000000	0.000020600	0.000019000	0.000022200	0.000000000	0.000019300	0.000018200	0.000024200	0.000025300	0.000024500	0.000018900	0.000030400	0.000026300	0.000023200	0.000000000	0.000018600	0.000020300	0.000022400	0.000024100	0.000020400	0.000027200	0.000024700	0.000021600	0.000039100	0.000028400	0.000025700	0.000000000	0.000000000	0.000025000
C7H9NO4	171.053168	1.286	0.571	0.14	0.0000	0.0000	0.25	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028800	0.000000000	0.000019600	0.000022400	0.000019500	0.000023800	0.000000000	0.000000000	0.000025200	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000018100	0.000020600	0.000026200	0.000019100	0.000000000	0.000000000	0.000022400	0.000000000	0.000024200	0.000025000	0.000023600	0.000000000	0.000032300	0.000030600	0.000037700	0.000043700	0.000033800	0.000030500	0.000032300	0.000031000
C8H13NO3	171.089528	1.625	0.375	0.13	0.0000	0.0000	0.09	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000018900	0.000000000	0.000000000	0.000000000	0.000025900	0.000018500	0.000000000	0.000000000	0.000018500	0.000025300	0.000000000	0.000000000	0.000024100	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000
C7H8O3S	172.019420	1.143	0.429	0.00	0.1429	0.0000	0.33	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000033100	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C7H8O5	172.037183	1.143	0.714	0.00	0.0000	0.0000	0.33	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000065800	0.000044500	0.000037500	0.000043800	0.000036500	0.000044100	0.000042100	0.000051800	0.000056000	0.000046300	0.000056700	0.000060100	0.000062700	0.000041800	0.000026600	0.000035300	0.000039900	0.000039800	0.000037800	0.000039600	0.000038700	0.000025800	0.000021500	0.000049800	0.000062100	0.000032600	0.000039600	0.000039300	0.000043000	0.000087700	0.000078800	0.000066100	0.000054900	0.000091700	0.000092300
C11H8O2	172.052431	0.727	0.182	0.00	0.0000	0.0000	0.70	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000056500	0.000044100	0.000032600	0.000045300	0.000037400	0.000046600	0.000052400	0.000052300	0.000060300	0.000047400	0.000057500	0.000049800	0.000044500	0.000036000	0.000029500	0.000032700	0.000028800	0.000042200	0.000045100	0.000042400	0.000043600	0.000038800	0.000027700	0.000053600	0.000061800	0.000030400	0.000043800	0.000050000	0.000048200	0.000081600	0.000066600	0.000072600	0.000068800	0.000098100	0.000101900
C8H12O4	172.073583	1.500	0.500	0.00	0.0000	0.0000	0.17	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000056000	0.000070600	0.000043800	0.000055600	0.000057600	0.000062100	0.000055500	0.000068600	0.000060200	0.000068800	0.000050500	0.000066600	0.000054700	0.000054600	0.000054200	0.000060400	0.000058000	0.000070300	0.000084800	0.000000000	0.000054600	0.000049700	0.000052100	0.000065900	0.000062200	0.000000000	0.000061900	0.000054200	0.000064900	0.000114500	0.000094500	0.000072800	0.000055400	0.000079400	0.000083500
C12H12O	172.088809	1.000	0.083	0.00	0.0000	0.0000	0.57	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000058300	0.000064100	0.000053900	0.000068900	0.000065500	0.000067300	0.000056300	0.000073900	0.000078800	0.000062200	0.000057000	0.000057100	0.000056000	0.000062300	0.000069700	0.000065700	0.000058200	0.000062700	0.000072600	0.000065400	0.000057100	0.000059300	0.000053000	0.000079000	0.000067100	0.000059100	0.000055400	0.000080600	0.000074400	0.000088900	0.000078200	0.000085100	0.000084800	0.000076600	0.000083500
C9H16O3	172.109971	1.778	0.333	0.00	0.0000	0.0000	0.07	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000019200	0.000021300	0.000023700	0.000022400	0.000025400	0.000000000	0.000022400	0.000018600	0.000000000	0.000000000	0.000020400	0.000000000	0.000024400	0.000023900	0.000031400	0.000021200	0.000027700	0.000034000	0.000023700	0.000022500	0.000026000	0.000025700	0.000021000	0.000019300	0.000026000	0.000022600	0.000024700	0.000000000	0.000035200	0.000023700	0.000020300	0.000000000	0.000027100	0.000018500
C10H7NO2	173.047685	0.700	0.200	0.10	0.0000	0.0000	0.75	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000026700	0.000000000	0.000018200	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027900	0.000000000	0.000023300	0.000024800	0.000019300
C11H11NO	173.084071	1.000	0.091	0.09	0.0000	0.0000	0.58	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020400	0.000000000	0.000026300	0.000020700	0.000022300	0.000021700	0.000020400	0.000018100	0.000023800	0.000000000	0.000000000	0.000000000	0.000000000	0.000028900	0.000030300	0.000032400	0.000030900	0.000030000	0.000030100	0.000029200	0.000030900	0.000032300	0.000037100	0.000026500	0.000026000	0.000018900	0.000028600	0.000031700	0.000038500	0.000019700	0.000022300	0.000041200	0.000033300	0.000000000	0.000018800
C10H6O3	174.031690	0.600	0.300	0.00	0.0000	0.0000	0.76	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000046500	0.000029300	0.000035300	0.000019500	0.000033700	0.000023100	0.000036900	0.000043400	0.000044500	0.000037100	0.000035900	0.000038400	0.000038700	0.000019000	0.000000000	0.000000000	0.000027700	0.000026800	0.000023200	0.000042600	0.000043800	0.000018200	0.000000000	0.000037600	0.000046500	0.000023300	0.000037100	0.000031300	0.000032500	0.000064600	0.000058900	0.000062400	0.000067900	0.000107800	0.000117100
C7H10O3S	174.035111	1.429	0.429	0.00	0.1429	0.0000	0.11	3	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C7H10O5	174.052846	1.429	0.714	0.00	0.0000	0.0000	0.11	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000036700	0.000032200	0.000030700	0.000037000	0.000034500	0.000032900	0.000032000	0.000037200	0.000041600	0.000043000	0.000039700	0.000033600	0.000029500	0.000028900	0.000027200	0.000030800	0.000027500	0.000032200	0.000030700	0.000033300	0.000022400	0.000022900	0.000018600	0.000039800	0.000040100	0.000028100	0.000020400	0.000040600	0.000033700	0.000053700	0.000051400	0.000052100	0.000036400	0.000059200	0.000052500
C11H10O2	174.068078	0.909	0.182	0.00	0.0000	0.0000	0.60	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000154800	0.000148800	0.000115400	0.000132300	0.000129300	0.000131800	0.000124300	0.000169200	0.000162300	0.000156200	0.000141100	0.000166300	0.000148300	0.000106300	0.000126200	0.000114800	0.000113900	0.000145200	0.000142000	0.000133400	0.000147000	0.000116200	0.000116400	0.000153700	0.000178700	0.000136000	0.000134300	0.000152900	0.000147800	0.000193100	0.000188100	0.000190700	0.000179200	0.000208400	0.000224300
C8H14O4	174.089228	1.750	0.500	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000020700	0.000000000	0.000023000	0.000028600	0.000000000	0.000028900	0.000000000	0.000000000	0.000000000	0.000022600	0.000019800	0.000023500	0.000000000	0.000023300	0.000000000	0.000033900	0.000020900	0.000024300	0.000036200	0.000019400	0.000018200	0.000031500	0.000020900	0.000025100	0.000025000	0.000024500	0.000028000	0.000024700	0.000022500	0.000032200	0.000018900	0.000000000	0.000000000	0.000023000	0.000021900
C12H14O	174.104469	1.167	0.083	0.00	0.0000	0.0000	0.48	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000075800	0.000082700	0.000073800	0.000087600	0.000085500	0.000089500	0.000086600	0.000108300	0.000098400	0.000106900	0.000097400	0.000108600	0.000084400	0.000084500	0.000116800	0.000094100	0.000095600	0.000104500	0.000115800	0.000083900	0.000082300	0.000076500	0.000072600	0.000096000	0.000095400	0.000081000	0.000081100	0.000088500	0.000079000	0.000093900	0.000086500	0.000097000	0.000091500	0.000093500	0.000092500
C10H9NO2	175.063360	0.900	0.200	0.10	0.0000	0.0000	0.62	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000038800	0.000028000	0.000023500	0.000037600	0.000026300	0.000036100	0.000037300	0.000027400	0.000034200	0.000026700	0.000025900	0.000028600	0.000033400	0.000037500	0.000030600	0.000043300	0.000030300	0.000035000	0.000036800	0.000032900	0.000032000	0.000041300	0.000037500	0.000024200	0.000038300	0.000031200	0.000042000	0.000046900	0.000041000	0.000049800	0.000037500	0.000055600	0.000037300	0.000040200	0.000029000
C11H13NO	175.099739	1.182	0.091	0.09	0.0000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000027800	0.000019800	0.000023700	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000025900	0.000024400	0.000030000	0.000028800	0.000018700	0.000023100	0.000023100	0.000024300	0.000026000	0.000030800	0.000018000	0.000020400	0.000000000	0.000020600	0.000024000	0.000020900	0.000025000	0.000024500	0.000025100	0.000022400	0.000000000	0.000000000
C9H4O4	176.010951	0.444	0.444	0.00	0.0000	0.0000	0.86	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000035400	0.000033100
C10H8OS	176.029594	0.800	0.100	0.00	0.1000	0.0000	0.65	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000019300	0.000000000	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000027500	0.000000000	0.000019800	0.000023200	0.000000000	0.000000000	0.000000000	0.000024400	0.000024000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000
C6H8O6	176.032090	1.333	1.000	0.00	0.0000	0.0000	0.00	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000024200	0.000000000
C10H8O3	176.047374	0.800	0.300	0.00	0.0000	0.0000	0.65	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000140400	0.000119500	0.000096600	0.000100500	0.000095400	0.000103700	0.000103700	0.000146500	0.000148300	0.000116500	0.000113400	0.000135800	0.000109300	0.000077600	0.000082300	0.000082300	0.000088000	0.000124300	0.000106600	0.000115200	0.000121900	0.000085000	0.000077400	0.000126300	0.000145600	0.000103100	0.000097900	0.000120900	0.000111700	0.000177800	0.000168500	0.000169800	0.000149900	0.000240400	0.000241600
C9H8N2O2	176.058600	0.889	0.222	0.22	0.0000	0.0000	0.67	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000018900	0.000022400	0.000018600	0.000020500	0.000029900	0.000026700	0.000019300	0.000000000	0.000000000	0.000000000
C7H12O5	176.068470	1.714	0.714	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000
C11H12O2	176.083753	1.091	0.182	0.00	0.0000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000183700	0.000193400	0.000164000	0.000185500	0.000179100	0.000184000	0.000168500	0.000210900	0.000203900	0.000208400	0.000198300	0.000231400	0.000190200	0.000171200	0.000189800	0.000193200	0.000197100	0.000200200	0.000224200	0.000164500	0.000174400	0.000173700	0.000158400	0.000216600	0.000223600	0.000201200	0.000183700	0.000178200	0.000187900	0.000256100	0.000248100	0.000219100	0.000174900	0.000222900	0.000221700
C12H16O	176.120111	1.333	0.083	0.00	0.0000	0.0000	0.39	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000094100	0.000124600	0.000101500	0.000117000	0.000126600	0.000123300	0.000120800	0.000153400	0.000148500	0.000144400	0.000132900	0.000134200	0.000114400	0.000127600	0.000154200	0.000138300	0.000118700	0.000133700	0.000158900	0.000109300	0.000110200	0.000109600	0.000116000	0.000131600	0.000122900	0.000127700	0.000121600	0.000126500	0.000118400	0.000142900	0.000127400	0.000134000	0.000103200	0.000119200	0.000128700
C9H7NO3	177.042596	0.778	0.333	0.11	0.0000	0.0000	0.69	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000041000	0.000027500	0.000026300	0.000042700	0.000031000	0.000031000	0.000022500	0.000033000	0.000041900	0.000030500	0.000030800	0.000034400	0.000034700	0.000022600	0.000019100	0.000029600	0.000028300	0.000022900	0.000027600	0.000029300	0.000029100	0.000000000	0.000024900	0.000032900	0.000033300	0.000034200	0.000021800	0.000035300	0.000032400	0.000046000	0.000048900	0.000043600	0.000041500	0.000048500	0.000052500
C10H11NO2	177.079011	1.100	0.200	0.10	0.0000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000040300	0.000028700	0.000048100	0.000053200	0.000048100	0.000044700	0.000038700	0.000034200	0.000040000	0.000041000	0.000031200	0.000053600	0.000029200	0.000035500	0.000050000	0.000054400	0.000050100	0.000049800	0.000050000	0.000043600	0.000036200	0.000060800	0.000051600	0.000042200	0.000052400	0.000054500	0.000046700	0.000052500	0.000048400	0.000069000	0.000060600	0.000064000	0.000052100	0.000047800	0.000046400
C11H15NO	177.115363	1.364	0.091	0.09	0.0000	0.0000	0.37	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020000	0.000025000	0.000025600	0.000026900	0.000027200	0.000019100	0.000022000	0.000000000	0.000019300	0.000020400	0.000000000	0.000027000	0.000000000	0.000025700	0.000028600	0.000028800	0.000035300	0.000024700	0.000026400	0.000022500	0.000021200	0.000032200	0.000022700	0.000022900	0.000024600	0.000018500	0.000033100	0.000032800	0.000034700	0.000030600	0.000034300	0.000032500	0.000026200	0.000000000	0.000018800
C9H6O2S	178.008839	0.667	0.222	0.00	0.1111	0.0000	0.71	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021600	0.000000000	0.000018200	0.000028300	0.000020300	0.000019800	0.000000000	0.000000000	0.000018500	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000025700	0.000020400	0.000000000	0.000021100	0.000019700	0.000000000	0.000000000	0.000021900	0.000023300	0.000018200	0.000000000	0.000025100	0.000023000	0.000000000	0.000000000
C9H6O4	178.026626	0.667	0.444	0.00	0.0000	0.0000	0.71	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000100900	0.000082400	0.000056300	0.000065000	0.000061100	0.000061800	0.000067000	0.000098200	0.000110600	0.000091500	0.000083900	0.000083900	0.000084300	0.000037500	0.000046700	0.000047800	0.000045900	0.000055700	0.000045500	0.000087200	0.000084800	0.000033200	0.000037400	0.000094400	0.000103900	0.000063200	0.000058600	0.000072900	0.000070200	0.000125600	0.000114800	0.000128300	0.000106100	0.000228000	0.000222100
C10H10OS	178.045273	1.000	0.100	0.00	0.1000	0.0000	0.53	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021900	0.000000000	0.000019700	0.000034100	0.000026400	0.000021600	0.000019000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000025500	0.000023200	0.000029000	0.000032300	0.000019500	0.000025000	0.000023600	0.000029600	0.000046700	0.000042400	0.000000000	0.000021900	0.000029200	0.000032500	0.000038700	0.000033600	0.000000000	0.000000000	0.000029900	0.000020900	0.000000000	0.000000000
C10H10O3	178.063007	1.000	0.300	0.00	0.0000	0.0000	0.53	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000208600	0.000203700	0.000171200	0.000184200	0.000166800	0.000182500	0.000178100	0.000220300	0.000224800	0.000220400	0.000198500	0.000222600	0.000210600	0.000148300	0.000151900	0.000174600	0.000168700	0.000199400	0.000189900	0.000179700	0.000200000	0.000151500	0.000148300	0.000225700	0.000225900	0.000195200	0.000193000	0.000188600	0.000192300	0.000290200	0.000287700	0.000256900	0.000218700	0.000331300	0.000327400
C9H10N2O2	178.074220	1.111	0.222	0.22	0.0000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000026000	0.000020400	0.000022800	0.000023800	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000021700	0.000018700	0.000023700	0.000025300	0.000020700	0.000000000	0.000000000	0.000000000	0.000022400	0.000023600	0.000026700	0.000020300	0.000021900	0.000026200	0.000031700	0.000028400	0.000039800	0.000028700	0.000031800	0.000023600	0.000024600	0.000022700
C11H14O2	178.099383	1.273	0.182	0.00	0.0000	0.0000	0.40	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000260900	0.000309800	0.000246500	0.000295600	0.000286600	0.000276300	0.000259500	0.000348300	0.000314800	0.000332000	0.000302200	0.000339000	0.000291900	0.000299900	0.000321900	0.000305900	0.000295500	0.000323200	0.000362100	0.000252500	0.000262400	0.000249500	0.000246000	0.000316000	0.000316600	0.000307500	0.000297000	0.000293400	0.000277600	0.000387800	0.000375700	0.000336200	0.000287700	0.000333800	0.000336400
C12H18O	178.135793	1.500	0.083	0.00	0.0000	0.0000	0.30	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000063600	0.000069500	0.000056400	0.000067000	0.000082400	0.000073000	0.000072500	0.000090000	0.000090300	0.000087700	0.000077700	0.000088200	0.000064700	0.000081800	0.000108100	0.000097400	0.000075700	0.000084300	0.000098300	0.000063600	0.000062000	0.000064200	0.000070800	0.000076000	0.000084300	0.000068100	0.000067200	0.000068900	0.000079500	0.000083500	0.000074400	0.000076800	0.000052400	0.000069400	0.000070000
C8H5NO4	179.021861	0.625	0.500	0.13	0.0000	0.0000	0.80	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000023200	0.000000000	0.000000000	0.000035600	0.000023400
C9H9NOS	179.040522	1.000	0.111	0.11	0.1111	0.0000	0.54	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000026000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H9NO3	179.058251	1.000	0.333	0.11	0.0000	0.0000	0.54	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000053200	0.000024900	0.000038900	0.000046200	0.000042800	0.000044100	0.000040800	0.000031100	0.000039400	0.000034500	0.000026300	0.000037400	0.000038100	0.000033100	0.000038800	0.000044900	0.000040300	0.000046100	0.000029300	0.000034500	0.000044900	0.000044300	0.000038100	0.000045300	0.000043200	0.000046700	0.000049300	0.000047500	0.000047700	0.000078000	0.000069800	0.000057200	0.000050500	0.000060300	0.000062000
C10H13NO2	179.094646	1.300	0.200	0.10	0.0000	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044800	0.000031500	0.000047100	0.000058900	0.000046500	0.000053800	0.000044200	0.000048700	0.000047900	0.000033500	0.000022000	0.000037100	0.000032300	0.000055200	0.000045700	0.000053300	0.000053700	0.000048000	0.000046600	0.000039000	0.000047400	0.000056700	0.000055800	0.000047200	0.000051300	0.000041300	0.000055700	0.000050300	0.000047500	0.000070100	0.000070400	0.000059400	0.000047600	0.000042900	0.000046100
C11H17NO	179.131008	1.545	0.091	0.09	0.0000	0.0000	0.26	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000018300	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000020100	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H4O5	180.005899	0.500	0.625	0.00	0.0000	0.0000	0.82	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022800	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000024900	0.000025900	0.000020500	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000027100	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000022300	0.000023500	0.000018800	0.000070700	0.000065700
C9H8O2S	180.024534	0.889	0.222	0.00	0.1111	0.0000	0.57	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031600	0.000000000	0.000026900	0.000041800	0.000020400	0.000032000	0.000027800	0.000022500	0.000031400	0.000000000	0.000000000	0.000023200	0.000024300	0.000021300	0.000000000	0.000028200	0.000026800	0.000023200	0.000000000	0.000026500	0.000026600	0.000032200	0.000018600	0.000024800	0.000036500	0.000026800	0.000028200	0.000034700	0.000041200	0.000000000	0.000000000	0.000043400	0.000037400	0.000022000	0.000000000
C9H8O4	180.042251	0.889	0.444	0.00	0.0000	0.0000	0.57	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000175000	0.000141300	0.000102900	0.000110900	0.000115600	0.000117700	0.000123500	0.000171500	0.000180200	0.000155500	0.000143400	0.000143900	0.000140800	0.000076200	0.000085200	0.000094900	0.000083800	0.000108400	0.000109600	0.000147900	0.000146100	0.000086700	0.000081700	0.000153200	0.000164000	0.000108500	0.000093800	0.000128200	0.000133100	0.000230500	0.000213000	0.000211600	0.000194200	0.000332100	0.000342800
C8H8N2O3	180.053500	1.000	0.375	0.25	0.0000	0.0000	0.56	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000021400	0.000021400
C10H12OS	180.060901	1.200	0.100	0.00	0.1000	0.0000	0.41	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020200	0.000000000	0.000035700	0.000041900	0.000025300	0.000034700	0.000024600	0.000020400	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000027900	0.000043400	0.000039800	0.000049100	0.000028800	0.000034800	0.000042200	0.000036900	0.000046100	0.000043300	0.000018600	0.000023700	0.000033500	0.000033300	0.000048300	0.000048900	0.000000000	0.000000000	0.000047400	0.000035800	0.000000000	0.000000000
C10H12O3	180.078675	1.200	0.300	0.00	0.0000	0.0000	0.41	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000251100	0.000281400	0.000216500	0.000241200	0.000234500	0.000234400	0.000225500	0.000278700	0.000284900	0.000275700	0.000254900	0.000299700	0.000265500	0.000226700	0.000236400	0.000246200	0.000231400	0.000266700	0.000270800	0.000215800	0.000221200	0.000209600	0.000194300	0.000286400	0.000274700	0.000265400	0.000263900	0.000225500	0.000241600	0.000406700	0.000388600	0.000310200	0.000238400	0.000344600	0.000341900
C9H12N2O2	180.089871	1.333	0.222	0.22	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021900	0.000000000	0.000019200	0.000000000	0.000021200	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000019400	0.000024500	0.000027100	0.000024200	0.000024300	0.000024200	0.000020500	0.000022900	0.000022900	0.000022700	0.000023700	0.000028600	0.000000000	0.000000000	0.000023000	0.000028800	0.000030900	0.000030100	0.000032500	0.000030800	0.000019700	0.000020400
C11H16O2	180.115036	1.455	0.182	0.00	0.0000	0.0000	0.30	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000204500	0.000245200	0.000203300	0.000235900	0.000241100	0.000240100	0.000232600	0.000279000	0.000273500	0.000274200	0.000233700	0.000273800	0.000231100	0.000263000	0.000282200	0.000272900	0.000248300	0.000284500	0.000310600	0.000214000	0.000212900	0.000224600	0.000218300	0.000263900	0.000267600	0.000248400	0.000232800	0.000248500	0.000246500	0.000341200	0.000318400	0.000273700	0.000244800	0.000265100	0.000268800
C12H20O	180.151420	1.667	0.083	0.00	0.0000	0.0000	0.22	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000022800	0.000028800	0.000024500	0.000027900	0.000029200	0.000032300	0.000032000	0.000024600	0.000000000	0.000021900	0.000000000	0.000042900	0.000044200	0.000033000	0.000025900	0.000037800	0.000040600	0.000020300	0.000028500	0.000024700	0.000031000	0.000000000	0.000021800	0.000024600	0.000025400	0.000019500	0.000033700	0.000028100	0.000022900	0.000026800	0.000027700	0.000000000	0.000022900
C8H7NO4	181.037503	0.875	0.500	0.13	0.0000	0.0000	0.60	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029500	0.000019700	0.000000000	0.000018400	0.000000000	0.000019800	0.000000000	0.000018900	0.000031100	0.000023400	0.000022100	0.000030400	0.000022400	0.000019600	0.000021000	0.000018400	0.000000000	0.000023300	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000030300	0.000024500	0.000000000	0.000027000	0.000024000	0.000046400	0.000042000	0.000031800	0.000036700	0.000052000	0.000052600
C9H11NOS	181.056149	1.222	0.111	0.11	0.1111	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000018000	0.000022800	0.000018700	0.000000000	0.000018400	0.000000000	0.000023800	0.000022200	0.000000000	0.000000000	0.000026400	0.000029000	0.000020100	0.000019300	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000
C9H11NO3	181.073921	1.222	0.333	0.11	0.0000	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000056700	0.000039700	0.000035600	0.000053000	0.000036500	0.000031200	0.000042600	0.000042600	0.000040800	0.000033100	0.000034900	0.000032500	0.000028200	0.000045500	0.000036100	0.000052500	0.000049200	0.000049900	0.000045900	0.000036600	0.000042100	0.000055900	0.000051800	0.000047100	0.000048700	0.000046000	0.000049100	0.000054000	0.000054900	0.000070900	0.000073100	0.000062800	0.000051200	0.000048800	0.000055700
C10H15NO2	181.110305	1.500	0.200	0.10	0.0000	0.0000	0.25	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000019800	0.000000000	0.000020300	0.000000000	0.000021000	0.000027100	0.000022200	0.000021600	0.000021900	0.000000000	0.000019100	0.000018700	0.000000000	0.000020000	0.000021900	0.000030600	0.000033500	0.000025900	0.000000000	0.000024200	0.000020100	0.000027700	0.000030600	0.000000000	0.000021300	0.000018000	0.000023300	0.000023600	0.000026400	0.000031400	0.000029300	0.000028000	0.000000000	0.000000000	0.000000000
C8H6O3S	182.003805	0.750	0.375	0.00	0.1250	0.0000	0.64	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000027700	0.000021300	0.000000000	0.000000000
C8H6O5	182.021516	0.750	0.625	0.00	0.0000	0.0000	0.64	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000075200	0.000090400	0.000063500	0.000064600	0.000048900	0.000060100	0.000071700	0.000082500	0.000119000	0.000082200	0.000077700	0.000098700	0.000057000	0.000043800	0.000079300	0.000062900	0.000040800	0.000061000	0.000048000	0.000088900	0.000060400	0.000071400	0.000040300	0.000068700	0.000077500	0.000069100	0.000054200	0.000062200	0.000042800	0.000176900	0.000098800	0.000098200	0.000077900	0.000206200	0.000196700
C9H10O2S	182.040165	1.111	0.222	0.00	0.1111	0.0000	0.43	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000037100	0.000019100	0.000043400	0.000041600	0.000034700	0.000028000	0.000024700	0.000022600	0.000029100	0.000000000	0.000000000	0.000023000	0.000019800	0.000020800	0.000027300	0.000047200	0.000038000	0.000032300	0.000029600	0.000020200	0.000036000	0.000041100	0.000041100	0.000027600	0.000036900	0.000033300	0.000029000	0.000047300	0.000051200	0.000019400	0.000000000	0.000049200	0.000043100	0.000000000	0.000000000
C9H10O4	182.057924	1.111	0.444	0.00	0.0000	0.0000	0.43	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000192900	0.000159500	0.000135300	0.000156500	0.000133800	0.000125600	0.000124900	0.000164000	0.000164700	0.000148500	0.000155600	0.000173200	0.000154700	0.000104500	0.000109500	0.000138400	0.000113000	0.000131500	0.000132300	0.000129800	0.000144000	0.000115400	0.000102000	0.000172200	0.000180600	0.000130100	0.000141900	0.000151300	0.000154400	0.000239200	0.000243100	0.000204700	0.000180200	0.000266500	0.000278400
C8H10N2O3	182.069135	1.250	0.375	0.25	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020800	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000021300	0.000000000	0.000020600	0.000021600	0.000000000
C13H10O	182.073204	0.769	0.077	0.00	0.0000	0.0000	0.68	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025200	0.000018200	0.000000000	0.000018900	0.000000000	0.000000000	0.000018800	0.000022200	0.000020300	0.000000000	0.000028700	0.000021500	0.000000000	0.000018400	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000	0.000024600	0.000028600	0.000025200	0.000000000	0.000000000	0.000000000	0.000034100	0.000030100	0.000025500	0.000021700	0.000028300	0.000030700
C10H14OS	182.076527	1.400	0.100	0.00	0.1000	0.0000	0.29	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000025200	0.000029800	0.000019700	0.000032200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027100	0.000021700	0.000041200	0.000038500	0.000022900	0.000000000	0.000031600	0.000033600	0.000048300	0.000040800	0.000000000	0.000021500	0.000025900	0.000021000	0.000039400	0.000033600	0.000000000	0.000000000	0.000033300	0.000027500	0.000000000	0.000000000
C10H14O3	182.094329	1.400	0.300	0.00	0.0000	0.0000	0.29	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000194100	0.000217100	0.000180600	0.000217000	0.000215900	0.000216800	0.000189800	0.000243700	0.000233100	0.000235500	0.000199400	0.000245600	0.000209800	0.000229600	0.000228900	0.000237200	0.000242000	0.000258200	0.000276900	0.000203300	0.000202700	0.000208200	0.000180900	0.000228100	0.000250200	0.000224000	0.000228200	0.000216800	0.000214900	0.000381900	0.000354700	0.000247700	0.000200900	0.000270000	0.000274700
C9H14N2O2	182.105530	1.556	0.222	0.22	0.0000	0.0000	0.17	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000
C11H18O2	182.130700	1.636	0.182	0.00	0.0000	0.0000	0.20	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000055800	0.000084400	0.000073600	0.000085100	0.000088800	0.000094900	0.000095400	0.000094900	0.000093900	0.000087800	0.000083000	0.000090400	0.000065300	0.000096500	0.000116300	0.000110900	0.000103800	0.000111100	0.000125400	0.000079000	0.000083400	0.000087900	0.000090900	0.000093500	0.000083000	0.000086900	0.000084300	0.000090400	0.000089800	0.000122900	0.000105800	0.000091600	0.000076900	0.000075800	0.000087500
C7H5NO5	183.016800	0.714	0.714	0.14	0.0000	0.0000	0.71	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000
C8H9NO2S	183.035407	1.125	0.250	0.13	0.1250	0.0000	0.40	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020500	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H9NO4	183.053196	1.125	0.500	0.13	0.0000	0.0000	0.40	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029000	0.000029400	0.000023500	0.000024500	0.000020100	0.000026400	0.000024400	0.000028600	0.000026000	0.000020600	0.000019300	0.000018200	0.000019600	0.000023000	0.000000000	0.000018300	0.000028400	0.000023900	0.000021000	0.000000000	0.000000000	0.000019700	0.000000000	0.000027800	0.000024000	0.000026700	0.000025800	0.000024900	0.000020000	0.000055700	0.000042600	0.000038000	0.000026000	0.000043200	0.000041500
C9H13NOS	183.071773	1.444	0.111	0.11	0.1111	0.0000	0.23	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000017800	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000018400	0.000000000	0.000000000
C9H13NO3	183.089572	1.444	0.333	0.11	0.0000	0.0000	0.23	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037900	0.000032800	0.000033700	0.000032700	0.000034100	0.000028100	0.000030600	0.000023700	0.000020000	0.000024200	0.000000000	0.000020900	0.000026400	0.000037200	0.000026500	0.000035500	0.000031300	0.000036900	0.000027100	0.000033900	0.000030900	0.000038600	0.000030600	0.000024700	0.000036900	0.000035100	0.000037000	0.000042200	0.000034400	0.000060100	0.000050100	0.000037500	0.000031900	0.000038400	0.000032100
C8H8O3S	184.019444	1.000	0.375	0.00	0.1250	0.0000	0.45	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022500	0.000022200	0.000000000	0.000023100	0.000023200	0.000028200	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000018300	0.000000000	0.000021700	0.000020700	0.000028900	0.000020400	0.000000000	0.000025700	0.000000000	0.000020900	0.000021000	0.000031100	0.000030100	0.000028800	0.000000000	0.000025300	0.000027500	0.000000000	0.000020300
C8H8O5	184.037171	1.000	0.625	0.00	0.0000	0.0000	0.45	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000100100	0.000069500	0.000057800	0.000056400	0.000046300	0.000047700	0.000050300	0.000070900	0.000069900	0.000061600	0.000075800	0.000070900	0.000066500	0.000046000	0.000039100	0.000032200	0.000037200	0.000043400	0.000038800	0.000074300	0.000062300	0.000038400	0.000035700	0.000069200	0.000082800	0.000045800	0.000036700	0.000064000	0.000064100	0.000096600	0.000109800	0.000103800	0.000107600	0.000160300	0.000165100
C12H8O2	184.052422	0.667	0.167	0.00	0.0000	0.0000	0.73	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000053000	0.000037000	0.000026200	0.000039500	0.000000000	0.000025100	0.000033700	0.000035600	0.000038900	0.000040200	0.000035700	0.000045000	0.000029700	0.000000000	0.000025900	0.000020200	0.000018000	0.000019500	0.000028600	0.000032400	0.000028200	0.000022300	0.000018600	0.000042500	0.000042600	0.000033700	0.000022800	0.000031700	0.000027700	0.000055300	0.000059500	0.000051500	0.000051000	0.000077700	0.000069600
C9H12O2S	184.055843	1.333	0.222	0.00	0.1111	0.0000	0.29	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027100	0.000000000	0.000031600	0.000036800	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000020500	0.000021000	0.000032400	0.000031900	0.000020500	0.000020300	0.000027800	0.000021900	0.000031200	0.000030000	0.000021400	0.000000000	0.000026400	0.000029300	0.000030200	0.000032200	0.000000000	0.000000000	0.000019200	0.000022900	0.000000000	0.000000000
C9H12O4	184.073555	1.333	0.444	0.00	0.0000	0.0000	0.29	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000158200	0.000173000	0.000134600	0.000137500	0.000139700	0.000140900	0.000144900	0.000174700	0.000174600	0.000168500	0.000000000	0.000170600	0.000154200	0.000132400	0.000149600	0.000159600	0.000149800	0.000194100	0.000189100	0.000139400	0.000139000	0.000122200	0.000130900	0.000177000	0.000178700	0.000153600	0.000156500	0.000165600	0.000164900	0.000301100	0.000287900	0.000194400	0.000176700	0.000246600	0.000260300
C13H12O	184.088809	0.923	0.077	0.00	0.0000	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034000	0.000028900	0.000029100	0.000035100	0.000039500	0.000036900	0.000034800	0.000044400	0.000041000	0.000034100	0.000035700	0.000032800	0.000035900	0.000032900	0.000037300	0.000024800	0.000043400	0.000037600	0.000036500	0.000035400	0.000041000	0.000032400	0.000029100	0.000041700	0.000035500	0.000038400	0.000030600	0.000033800	0.000041100	0.000046600	0.000046100	0.000045900	0.000047900	0.000039800	0.000050800
C10H16O3	184.109937	1.600	0.300	0.00	0.0000	0.0000	0.18	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000098100	0.000112400	0.000113500	0.000124500	0.000135600	0.000138400	0.000135500	0.000126500	0.000131200	0.000123300	0.000096800	0.000133400	0.000087800	0.000155200	0.000168100	0.000167900	0.000152000	0.000180000	0.000200200	0.000123000	0.000118500	0.000139500	0.000145500	0.000133300	0.000145800	0.000141900	0.000139400	0.000144400	0.000130800	0.000224900	0.000181300	0.000154800	0.000138200	0.000139700	0.000155300
C11H20O2	184.146323	1.818	0.182	0.00	0.0000	0.0000	0.10	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000019300	0.000000000	0.000000000	0.000023000	0.000020800	0.000020000	0.000000000	0.000024800	0.000000000	0.000000000	0.000018400	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000
C7H7NO5	185.032466	1.000	0.714	0.14	0.0000	0.0000	0.43	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000020600	0.000021700
C11H7NO2	185.047706	0.636	0.182	0.09	0.0000	0.0000	0.78	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100
C8H11NO4	185.068847	1.375	0.500	0.13	0.0000	0.0000	0.20	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022900	0.000022400	0.000000000	0.000022500	0.000000000	0.000018700	0.000020400	0.000021200	0.000023300	0.000025000	0.000000000	0.000022700	0.000000000	0.000018100	0.000018600	0.000024500	0.000020700	0.000020900	0.000000000	0.000019300	0.000021600	0.000020400	0.000022000	0.000025700	0.000027900	0.000018400	0.000026700	0.000028100	0.000025700	0.000048900	0.000032300	0.000031000	0.000031700	0.000024500	0.000031800
C12H11NO	185.084101	0.917	0.083	0.08	0.0000	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025900	0.000000000	0.000022600	0.000020100	0.000018200	0.000033600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000023400	0.000023200	0.000020900	0.000000000	0.000000000	0.000020400	0.000019000	0.000018900	0.000000000	0.000000000	0.000000000	0.000025600	0.000024000	0.000022700	0.000000000	0.000032500	0.000000000	0.000000000	0.000000000
C9H15NO3	185.105233	1.667	0.333	0.11	0.0000	0.0000	0.08	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C7H6O6	186.016465	0.857	0.857	0.00	0.0000	0.0000	0.50	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000026400
C11H6O3	186.031724	0.545	0.273	0.00	0.0000	0.0000	0.79	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000026500	0.000022600	0.000019700	0.000000000	0.000000000	0.000023600	0.000019900	0.000021700	0.000035000	0.000021200	0.000022800	0.000023000	0.000024400	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000020400	0.000027100	0.000000000	0.000000000	0.000000000	0.000019300	0.000028100	0.000021300	0.000033800	0.000028200	0.000056200	0.000055100
C8H10O3S	186.035063	1.250	0.375	0.00	0.1250	0.0000	0.27	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028600	0.000000000	0.000032300	0.000036500	0.000018800	0.000027700	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000021900	0.000034900	0.000025500	0.000019200	0.000020000	0.000023400	0.000022900	0.000029600	0.000032100	0.000000000	0.000021200	0.000029900	0.000027800	0.000024700	0.000040500	0.000000000	0.000020500	0.000033100	0.000028300	0.000000000	0.000000000
C8H10O5	186.052855	1.250	0.625	0.00	0.0000	0.0000	0.27	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000070400	0.000071800	0.000048400	0.000049100	0.000053500	0.000059200	0.000048700	0.000080300	0.000072100	0.000068400	0.000054400	0.000073600	0.000067900	0.000050800	0.000037800	0.000061100	0.000060200	0.000062600	0.000062500	0.000052800	0.000057600	0.000040600	0.000033600	0.000070000	0.000078900	0.000052300	0.000050100	0.000064400	0.000056300	0.000114800	0.000112900	0.000074000	0.000065300	0.000107500	0.000107600
C12H10O2	186.068113	0.833	0.167	0.00	0.0000	0.0000	0.64	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000083000	0.000073600	0.000061100	0.000069300	0.000080200	0.000074800	0.000073900	0.000089900	0.000083100	0.000085600	0.000081900	0.000086900	0.000082600	0.000065100	0.000065300	0.000069000	0.000069100	0.000077800	0.000078900	0.000074200	0.000083700	0.000064800	0.000069400	0.000094600	0.000102300	0.000069900	0.000076600	0.000073800	0.000075500	0.000109000	0.000110400	0.000114600	0.000098200	0.000116400	0.000121700
C9H14O2S	186.071444	1.556	0.222	0.00	0.1111	0.0000	0.14	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000027400	0.000029600	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000033000	0.000024800	0.000023700	0.000021200	0.000022800	0.000020400	0.000034000	0.000037000	0.000020400	0.000000000	0.000000000	0.000000000	0.000025800	0.000030100	0.000000000	0.000000000	0.000031900	0.000022900	0.000000000	0.000000000
C11H10N2O	186.079304	0.909	0.091	0.18	0.0000	0.0000	0.65	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000019300	0.000000000	0.000000000
C9H14O4	186.089235	1.556	0.444	0.00	0.0000	0.0000	0.14	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000064600	0.000073100	0.000073300	0.000084100	0.000075600	0.000077100	0.000069500	0.000078500	0.000074400	0.000066700	0.000069100	0.000081900	0.000060300	0.000070200	0.000085800	0.000100800	0.000076700	0.000097000	0.000116700	0.000077900	0.000072500	0.000071600	0.000071300	0.000085700	0.000082700	0.000093000	0.000077000	0.000068800	0.000068800	0.000175200	0.000151300	0.000079400	0.000060800	0.000101300	0.000109700
C13H14O	186.104494	1.077	0.077	0.00	0.0000	0.0000	0.52	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036800	0.000046300	0.000041000	0.000049500	0.000044100	0.000054400	0.000052400	0.000054700	0.000056400	0.000059000	0.000048400	0.000055800	0.000047000	0.000054000	0.000061700	0.000055800	0.000044500	0.000056100	0.000061200	0.000040400	0.000054000	0.000052900	0.000053400	0.000071000	0.000042600	0.000045100	0.000045100	0.000054600	0.000043400	0.000044300	0.000051700	0.000062700	0.000044400	0.000050800	0.000057400
C10H18O3	186.125600	1.800	0.300	0.00	0.0000	0.0000	0.06	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000020100	0.000022700	0.000018200	0.000019600	0.000031100	0.000000000	0.000022300	0.000024600	0.000000000	0.000000000	0.000021500	0.000000000	0.000033500	0.000025800	0.000026900	0.000018300	0.000031600	0.000043100	0.000022600	0.000000000	0.000031200	0.000021000	0.000023700	0.000023400	0.000021200	0.000000000	0.000019500	0.000020100	0.000023500	0.000021100	0.000018900	0.000000000	0.000000000	0.000031800
C7H9NO5	187.048095	1.286	0.714	0.14	0.0000	0.0000	0.14	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000019000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000
C11H9NO2	187.063338	0.818	0.182	0.09	0.0000	0.0000	0.67	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037200	0.000028000	0.000029300	0.000037900	0.000032800	0.000028000	0.000038000	0.000033000	0.000039000	0.000027900	0.000021500	0.000031200	0.000026600	0.000033200	0.000032200	0.000034600	0.000035400	0.000035500	0.000034500	0.000029000	0.000025800	0.000035500	0.000035500	0.000045200	0.000037900	0.000035000	0.000026800	0.000045700	0.000047800	0.000035300	0.000035100	0.000047200	0.000048800	0.000038800	0.000039900
C12H13NO	187.099760	1.083	0.083	0.08	0.0000	0.0000	0.52	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000025600	0.000022800	0.000022700	0.000000000	0.000020200	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000024100	0.000028000	0.000029400	0.000000000	0.000021900	0.000000000	0.000000000	0.000026300	0.000027000	0.000020700	0.000000000	0.000022200	0.000018700	0.000019800	0.000026200	0.000021800	0.000022500	0.000018300	0.000021900	0.000000000	0.000000000
C7H8O4S	188.014322	1.143	0.571	0.00	0.1429	0.0000	0.25	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H8OS	188.029594	0.727	0.091	0.00	0.0909	0.0000	0.68	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000018600	0.000000000	0.000000000
C7H8O6	188.032120	1.143	0.857	0.00	0.0000	0.0000	0.25	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000027800	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000019000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000022500	0.000018300	0.000000000	0.000020000	0.000018500	0.000000000	0.000032900	0.000031000	0.000027200	0.000000000	0.000044200	0.000047100
C11H8O3	188.047380	0.727	0.273	0.00	0.0000	0.0000	0.68	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000119200	0.000090800	0.000078700	0.000076900	0.000073300	0.000077900	0.000084200	0.000114600	0.000130800	0.000100600	0.000097400	0.000116400	0.000100500	0.000055300	0.000058800	0.000068000	0.000059200	0.000081300	0.000068100	0.000089100	0.000099700	0.000061000	0.000058700	0.000109200	0.000112200	0.000072600	0.000081100	0.000090200	0.000093200	0.000159200	0.000147900	0.000132900	0.000123300	0.000202300	0.000200300
C8H12O3S	188.050712	1.500	0.375	0.00	0.1250	0.0000	0.09	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025900	0.000018600	0.000000000	0.000000000	0.000027400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000022400	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000029700	0.000024700	0.000000000	0.000000000	0.000000000	0.000022700	0.000020200	0.000022800	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000
C10H8N2O2	188.058577	0.800	0.200	0.20	0.0000	0.0000	0.71	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019900	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000020400	0.000000000	0.000021200	0.000000000	0.000000000	0.000023800	0.000020400	0.000020000	0.000021000	0.000026800	0.000029000	0.000000000	0.000000000	0.000000000
C8H12O5	188.068480	1.500	0.625	0.00	0.0000	0.0000	0.09	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000048000	0.000059300	0.000040600	0.000049000	0.000049900	0.000044300	0.000047100	0.000058300	0.000067700	0.000061500	0.000066500	0.000055700	0.000058900	0.000042600	0.000040900	0.000048800	0.000046800	0.000067900	0.000075800	0.000054300	0.000041500	0.000037800	0.000036600	0.000051600	0.000063200	0.000049800	0.000053600	0.000050100	0.000050400	0.000095900	0.000091700	0.000061100	0.000056800	0.000079700	0.000086100
C12H12O2	188.083734	1.000	0.167	0.00	0.0000	0.0000	0.55	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000166500	0.000178700	0.000151000	0.000172300	0.000177500	0.000179200	0.000169600	0.000228400	0.000200500	0.000201500	0.000179600	0.000204200	0.000181500	0.000163600	0.000189400	0.000168300	0.000172500	0.000202700	0.000219300	0.000175700	0.000178600	0.000175300	0.000159200	0.000199000	0.000196500	0.000177500	0.000174600	0.000187000	0.000186700	0.000219200	0.000221000	0.000223400	0.000193200	0.000215600	0.000223000
C11H12N2O	188.095027	1.091	0.091	0.18	0.0000	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H16O4	188.104854	1.778	0.444	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000029700	0.000029000	0.000047700	0.000047300	0.000058400	0.000058300	0.000050200	0.000033200	0.000042200	0.000028800	0.000030400	0.000025700	0.000023100	0.000056000	0.000050800	0.000055600	0.000068900	0.000058500	0.000064400	0.000027200	0.000034700	0.000060300	0.000033500	0.000058800	0.000038300	0.000061000	0.000047000	0.000038100	0.000039000	0.000073900	0.000054700	0.000036600	0.000031600	0.000040400	0.000040600
C13H16O	188.120111	1.231	0.077	0.00	0.0000	0.0000	0.44	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000068500	0.000087400	0.000074900	0.000089400	0.000092200	0.000096700	0.000094300	0.000115800	0.000108000	0.000110400	0.000104800	0.000118800	0.000093200	0.000110200	0.000118900	0.000113200	0.000107300	0.000113100	0.000130500	0.000078000	0.000088900	0.000088600	0.000086600	0.000102700	0.000090800	0.000095600	0.000095700	0.000096000	0.000084200	0.000092000	0.000089600	0.000094700	0.000088600	0.000094000	0.000104300
C10H7NO3	189.042629	0.700	0.300	0.10	0.0000	0.0000	0.73	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000027900	0.000024900	0.000019600	0.000029400	0.000000000	0.000025900	0.000028600	0.000020500	0.000030800	0.000018100	0.000023500	0.000026200	0.000020300	0.000021900	0.000027300	0.000000000	0.000022300	0.000020800	0.000025000	0.000022600	0.000027200	0.000024100	0.000018600	0.000034200	0.000031800	0.000027000	0.000021900	0.000027200	0.000024000	0.000026400	0.000044200	0.000042300	0.000027100	0.000043500	0.000042200
C11H11NO2	189.078988	1.000	0.182	0.09	0.0000	0.0000	0.56	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000068600	0.000041000	0.000056000	0.000071000	0.000051100	0.000055700	0.000054100	0.000038000	0.000048300	0.000037000	0.000038200	0.000043000	0.000045400	0.000060200	0.000060500	0.000070200	0.000072300	0.000055900	0.000065500	0.000055200	0.000061100	0.000079800	0.000072400	0.000066700	0.000066100	0.000054300	0.000051500	0.000070400	0.000069900	0.000065500	0.000053100	0.000080500	0.000075100	0.000044200	0.000046700
C12H15NO	189.115367	1.250	0.083	0.08	0.0000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000022700	0.000026100	0.000023300	0.000023000	0.000023400	0.000019100	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025200	0.000029600	0.000027500	0.000025100	0.000024500	0.000000000	0.000000000	0.000000000	0.000024900	0.000022600	0.000022000	0.000026000	0.000025200	0.000023600	0.000022900	0.000026400	0.000026400	0.000024600	0.000032900	0.000027200	0.000000000	0.000000000
C10H6O4	190.026625	0.600	0.400	0.00	0.0000	0.0000	0.75	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000083600	0.000070100	0.000056400	0.000055000	0.000046600	0.000055900	0.000063000	0.000073800	0.000098400	0.000076600	0.000072600	0.000076300	0.000077100	0.000037100	0.000028200	0.000022700	0.000042800	0.000044800	0.000051500	0.000076000	0.000074800	0.000035900	0.000022900	0.000085200	0.000080200	0.000047600	0.000049100	0.000050800	0.000056700	0.000107200	0.000109500	0.000098800	0.000090500	0.000200400	0.000189500
C11H10OS	190.045268	0.909	0.091	0.00	0.0909	0.0000	0.58	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000030200	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000027200	0.000029800	0.000000000	0.000000000	0.000025900	0.000000000	0.000026300	0.000024400	0.000019500	0.000000000	0.000020500	0.000019700	0.000030800	0.000029800	0.000000000	0.000000000	0.000030700	0.000030800	0.000000000	0.000000000
C7H10O6	190.047731	1.429	0.857	0.00	0.0000	0.0000	0.00	3	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000024400	0.000018400	0.000000000	0.000018500	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031200	0.000028600	0.000028900	0.000000000	0.000034300	0.000034300
C11H10O3	190.062996	0.909	0.273	0.00	0.0000	0.0000	0.58	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000261600	0.000231400	0.000199500	0.000215400	0.000207800	0.000216200	0.000214300	0.000268100	0.000276600	0.000245100	0.000244000	0.000263800	0.000243000	0.000183300	0.000188800	0.000197000	0.000194400	0.000240800	0.000232200	0.000235900	0.000234200	0.000199200	0.000187700	0.000274300	0.000290500	0.000230200	0.000222100	0.000231100	0.000239300	0.000324700	0.000320500	0.000314000	0.000307400	0.000384500	0.000395600
C10H10N2O2	190.074244	1.000	0.200	0.20	0.0000	0.0000	0.57	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000029000	0.000000000	0.000023100	0.000034300	0.000020200	0.000018900	0.000018200	0.000023800	0.000030000	0.000000000	0.000000000	0.000021500	0.000020300	0.000024100	0.000019200	0.000024300	0.000018500	0.000029500	0.000021200	0.000026400	0.000000000	0.000036000	0.000025500	0.000027800	0.000029000	0.000034000	0.000021800	0.000030800	0.000033200	0.000027500	0.000028400	0.000036600	0.000029900	0.000030000	0.000029100
C8H14O5	190.084160	1.750	0.625	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027700	0.000000000	0.000000000	0.000000000	0.000021000
C12H14O2	190.099413	1.167	0.167	0.00	0.0000	0.0000	0.45	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000195200	0.000240900	0.000195200	0.000214400	0.000244000	0.000238900	0.000228800	0.000288000	0.000265800	0.000267600	0.000256700	0.000279700	0.000228000	0.000234900	0.000267600	0.000258600	0.000244500	0.000258800	0.000289900	0.000215200	0.000220600	0.000214500	0.000213700	0.000247000	0.000261200	0.000254100	0.000232600	0.000210900	0.000218000	0.000248400	0.000257400	0.000257400	0.000212500	0.000232900	0.000245100
C13H18O	190.135757	1.385	0.077	0.00	0.0000	0.0000	0.36	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000069200	0.000103200	0.000083400	0.000093800	0.000099000	0.000105200	0.000095600	0.000140800	0.000121800	0.000124200	0.000107700	0.000124600	0.000099100	0.000114400	0.000150800	0.000115800	0.000119600	0.000117500	0.000144100	0.000102200	0.000095900	0.000097800	0.000086300	0.000099900	0.000104000	0.000107500	0.000099100	0.000108700	0.000103200	0.000099500	0.000102500	0.000112000	0.000101000	0.000099000	0.000104800
C9H5NO4	191.021900	0.556	0.444	0.11	0.0000	0.0000	0.83	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033100	0.000020100	0.000000000	0.000000000	0.000022800	0.000024400
C10H9NO3	191.058239	0.900	0.300	0.10	0.0000	0.0000	0.60	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000078300	0.000057400	0.000060600	0.000069200	0.000065700	0.000059700	0.000063300	0.000053200	0.000060200	0.000054800	0.000050400	0.000047400	0.000052200	0.000050000	0.000053000	0.000070500	0.000069100	0.000071700	0.000058500	0.000066200	0.000065500	0.000083800	0.000067600	0.000065800	0.000069900	0.000063300	0.000063100	0.000077500	0.000082800	0.000085500	0.000082900	0.000093900	0.000093700	0.000075200	0.000082500
C11H13NO2	191.094663	1.182	0.182	0.09	0.0000	0.0000	0.44	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000048900	0.000041400	0.000058300	0.000058400	0.000051200	0.000051000	0.000053300	0.000043500	0.000053200	0.000040400	0.000035200	0.000058300	0.000046200	0.000055000	0.000052500	0.000072600	0.000063600	0.000053000	0.000068200	0.000057000	0.000059400	0.000064100	0.000065500	0.000054500	0.000063400	0.000052400	0.000061700	0.000059000	0.000071000	0.000070300	0.000058900	0.000067200	0.000057000	0.000042900	0.000049400
C12H17NO	191.131008	1.417	0.083	0.08	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000018100	0.000022100	0.000019500	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000025000	0.000000000	0.000017900	0.000028200	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000	0.000020800	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000
C9H4O5	192.005887	0.444	0.556	0.00	0.0000	0.0000	0.85	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034100	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000034100	0.000043300	0.000031600	0.000019800	0.000025300	0.000030400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000020200	0.000000000	0.000000000	0.000025300	0.000024600	0.000000000	0.000000000	0.000021600	0.000018400	0.000056400	0.000045600	0.000030000	0.000034700	0.000092000	0.000081400
C10H8O2S	192.024542	0.800	0.200	0.00	0.1000	0.0000	0.62	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000032300	0.000000000	0.000030000	0.000039100	0.000022800	0.000027500	0.000024000	0.000019600	0.000031000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000022100	0.000027800	0.000030300	0.000018700	0.000027900	0.000000000	0.000024800	0.000025300	0.000024900	0.000031700	0.000022900	0.000026800	0.000027400	0.000034000	0.000038100	0.000000000	0.000000000	0.000039400	0.000032300	0.000000000	0.000000000
C10H8O4	192.042283	0.800	0.400	0.00	0.0000	0.0000	0.62	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000165500	0.000126800	0.000113000	0.000120800	0.000120700	0.000126900	0.000125500	0.000159500	0.000164600	0.000139900	0.000136600	0.000151500	0.000138100	0.000088500	0.000084900	0.000096100	0.000101600	0.000134500	0.000113500	0.000137500	0.000146100	0.000087800	0.000079600	0.000151000	0.000164900	0.000124600	0.000113300	0.000137500	0.000147800	0.000199300	0.000202600	0.000200100	0.000196500	0.000309600	0.000313400
C7H12O4S	192.045615	1.714	0.571	0.00	0.1429	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000
C9H8N2O3	192.053478	0.889	0.333	0.22	0.0000	0.0000	0.64	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000018200	0.000027700	0.000020300	0.000000000	0.000000000	0.000020000	0.000018700	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000021300	0.000000000	0.000017800	0.000023600	0.000024700	0.000032200	0.000021900	0.000030300	0.000023500	0.000019800	0.000024200
C11H12OS	192.060875	1.091	0.091	0.00	0.0909	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000033700	0.000000000	0.000026800	0.000048300	0.000031800	0.000029900	0.000020900	0.000000000	0.000020100	0.000000000	0.000000000	0.000018500	0.000000000	0.000037500	0.000033000	0.000041600	0.000048300	0.000030400	0.000030100	0.000039300	0.000036000	0.000048900	0.000044200	0.000034300	0.000026700	0.000030000	0.000024900	0.000051100	0.000047800	0.000000000	0.000000000	0.000048200	0.000044700	0.000000000	0.000000000
C11H12O3	192.078641	1.091	0.273	0.00	0.0000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000337400	0.000347700	0.000284000	0.000322600	0.000311600	0.000319900	0.000296200	0.000375800	0.000369800	0.000360800	0.000341800	0.000374400	0.000338800	0.000282700	0.000302600	0.000301500	0.000293700	0.000352500	0.000364600	0.000304400	0.000316200	0.000282900	0.000260600	0.000361400	0.000380000	0.000352800	0.000334900	0.000322400	0.000337900	0.000411200	0.000422700	0.000401200	0.000361800	0.000434700	0.000453600
C10H12N2O2	192.089918	1.200	0.200	0.20	0.0000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019600	0.000000000	0.000020300	0.000000000	0.000024600	0.000020000	0.000020000	0.000020400	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000019600	0.000018600	0.000023100	0.000028500	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000020600	0.000024400	0.000024200	0.000021900	0.000000000	0.000028000	0.000024900	0.000033800	0.000030500	0.000026100	0.000027800	0.000000000	0.000020300
C12H16O2	192.115068	1.333	0.167	0.00	0.0000	0.0000	0.36	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000199800	0.000266800	0.000210100	0.000234400	0.000241500	0.000234800	0.000230200	0.000298500	0.000279200	0.000281500	0.000263100	0.000296700	0.000245200	0.000276500	0.000286100	0.000269200	0.000253100	0.000279500	0.000308500	0.000213900	0.000227800	0.000220900	0.000212400	0.000245600	0.000256600	0.000256100	0.000249600	0.000232500	0.000228900	0.000297700	0.000282200	0.000258200	0.000216200	0.000243700	0.000257500
C13H20O	192.151407	1.538	0.077	0.00	0.0000	0.0000	0.28	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000037500	0.000051500	0.000046400	0.000054100	0.000061400	0.000066500	0.000049800	0.000064900	0.000066300	0.000061900	0.000054900	0.000067600	0.000046700	0.000066800	0.000073600	0.000076000	0.000056500	0.000064600	0.000080100	0.000051900	0.000050900	0.000057300	0.000051600	0.000059800	0.000055900	0.000054000	0.000057800	0.000071900	0.000064700	0.000054200	0.000047800	0.000060200	0.000060300	0.000041100	0.000059500
C9H7NO2S	193.019753	0.778	0.222	0.11	0.1111	0.0000	0.67	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000
C9H7NO4	193.037503	0.778	0.444	0.11	0.0000	0.0000	0.67	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034800	0.000018200	0.000000000	0.000024000	0.000020500	0.000000000	0.000000000	0.000023200	0.000037400	0.000024900	0.000025800	0.000023900	0.000031400	0.000000000	0.000018200	0.000019600	0.000000000	0.000000000	0.000024700	0.000023000	0.000023900	0.000022900	0.000000000	0.000031500	0.000032600	0.000022800	0.000025500	0.000025800	0.000033100	0.000051200	0.000047300	0.000029800	0.000045600	0.000056200	0.000055300
C10H11NOS	193.056142	1.100	0.100	0.10	0.1000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028500	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000024400	0.000000000	0.000000000	0.000000000	0.000018800	0.000026800	0.000030800	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000
C10H11NO3	193.073915	1.100	0.300	0.10	0.0000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000067800	0.000038700	0.000046200	0.000066900	0.000052100	0.000045400	0.000057900	0.000048400	0.000044500	0.000030100	0.000038000	0.000049400	0.000043100	0.000052200	0.000051000	0.000052900	0.000062200	0.000051100	0.000056800	0.000046300	0.000061000	0.000063700	0.000059800	0.000065900	0.000055200	0.000054900	0.000059000	0.000063400	0.000057300	0.000072500	0.000077100	0.000081400	0.000064800	0.000063200	0.000064900
C11H15NO2	193.110301	1.364	0.182	0.09	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000031900	0.000023700	0.000032600	0.000051800	0.000040700	0.000039600	0.000038900	0.000031100	0.000034600	0.000027800	0.000019200	0.000033700	0.000034700	0.000046900	0.000042600	0.000055700	0.000051900	0.000035100	0.000043700	0.000034300	0.000044100	0.000054900	0.000043900	0.000039400	0.000038700	0.000048100	0.000045500	0.000040400	0.000044600	0.000049000	0.000051900	0.000053500	0.000043400	0.000030300	0.000037600
C9H6O3S	194.003761	0.667	0.333	0.00	0.1111	0.0000	0.69	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000024000	0.000000000	0.000000000	0.000030500	0.000023700	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000020600	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000023300	0.000020300	0.000030000	0.000000000	0.000029000	0.000030500	0.000030400	0.000000000	0.000000000	0.000033100	0.000035900	0.000020600	0.000023000
C9H6O5	194.021516	0.667	0.556	0.00	0.0000	0.0000	0.69	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000077500	0.000065500	0.000050200	0.000055200	0.000039400	0.000048700	0.000056200	0.000071900	0.000088800	0.000067100	0.000066200	0.000069900	0.000072000	0.000023200	0.000035000	0.000031600	0.000027000	0.000035500	0.000032200	0.000079700	0.000075500	0.000044400	0.000027600	0.000064900	0.000065600	0.000042300	0.000046200	0.000060300	0.000045700	0.000094500	0.000081000	0.000094600	0.000086600	0.000198900	0.000188800
C10H10O2S	194.040164	1.000	0.200	0.00	0.1000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000048200	0.000027800	0.000045500	0.000047400	0.000035500	0.000035300	0.000043900	0.000026700	0.000032800	0.000019300	0.000000000	0.000021200	0.000024600	0.000031100	0.000033500	0.000057900	0.000056400	0.000034100	0.000032600	0.000036600	0.000036200	0.000058800	0.000051300	0.000035600	0.000043200	0.000045000	0.000042300	0.000048700	0.000051600	0.000028100	0.000018800	0.000053800	0.000054100	0.000000000	0.000000000
C10H10O4	194.057933	1.000	0.400	0.00	0.0000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000181100	0.000162700	0.000133500	0.000149200	0.000140000	0.000146700	0.000138700	0.000171300	0.000185400	0.000175800	0.000154500	0.000185000	0.000175200	0.000127000	0.000114500	0.000124800	0.000124500	0.000149500	0.000159100	0.000152000	0.000148100	0.000123200	0.000113600	0.000187100	0.000207200	0.000154000	0.000150700	0.000151400	0.000161100	0.000257800	0.000259100	0.000211300	0.000179200	0.000311900	0.000313800
C9H10N2O3	194.069172	1.111	0.333	0.22	0.0000	0.0000	0.45	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000018000	0.000000000	0.000000000	0.000024700	0.000027700	0.000019900	0.000000000	0.000019300	0.000000000	0.000025400	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000028500	0.000027700	0.000033600	0.000020300	0.000000000	0.000025000
C14H10O	194.073166	0.714	0.071	0.00	0.0000	0.0000	0.70	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000024700	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000020100	0.000000000	0.000032700	0.000000000	0.000021000	0.000022900	0.000029400	0.000022100
C11H14OS	194.076579	1.273	0.091	0.00	0.0909	0.0000	0.37	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020600	0.000033900	0.000021100	0.000024800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029400	0.000032500	0.000038100	0.000028800	0.000000000	0.000018200	0.000000000	0.000000000	0.000036100	0.000041900	0.000020500	0.000022300	0.000018300	0.000000000	0.000035800	0.000031700	0.000000000	0.000000000	0.000032600	0.000030400	0.000000000	0.000000000
C11H14O3	194.094322	1.273	0.273	0.00	0.0000	0.0000	0.37	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000312400	0.000359100	0.000301000	0.000319200	0.000329700	0.000333200	0.000330700	0.000375600	0.000365500	0.000347200	0.000325800	0.000382000	0.000343800	0.000337000	0.000360100	0.000356300	0.000345200	0.000367300	0.000382900	0.000286000	0.000309500	0.000325400	0.000293400	0.000354600	0.000367700	0.000345300	0.000347200	0.000328300	0.000313300	0.000456700	0.000446000	0.000371600	0.000317800	0.000384800	0.000391600
C10H14N2O2	194.105514	1.400	0.200	0.20	0.0000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024700	0.000000000	0.000028700	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000021200	0.000018200	0.000021800	0.000000000	0.000000000	0.000031000	0.000019000	0.000000000	0.000000000	0.000021000	0.000021500	0.000030500	0.000029400	0.000024700	0.000022300	0.000000000	0.000024300	0.000000000	0.000000000
C12H18O2	194.130676	1.500	0.167	0.00	0.0000	0.0000	0.27	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000165600	0.000212900	0.000184800	0.000197300	0.000212500	0.000224300	0.000208800	0.000253700	0.000228400	0.000231900	0.000210800	0.000237300	0.000193600	0.000237400	0.000269500	0.000256800	0.000221100	0.000237100	0.000267300	0.000187800	0.000187500	0.000197500	0.000192000	0.000203900	0.000221100	0.000210800	0.000200200	0.000214400	0.000224700	0.000268100	0.000241300	0.000237000	0.000200600	0.000200000	0.000220300
C13H22O	194.167057	1.692	0.077	0.00	0.0000	0.0000	0.20	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018700	0.000021600	0.000018400	0.000019500	0.000000000	0.000023200	0.000000000	0.000000000	0.000021000	0.000000000	0.000029300	0.000032700	0.000021800	0.000020800	0.000028100	0.000031300	0.000020100	0.000023000	0.000022900	0.000032500	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000027200	0.000023700	0.000025700	0.000018500	0.000000000	0.000000000	0.000018600
C9H9NO2S	195.035405	1.000	0.222	0.11	0.1111	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019700	0.000000000	0.000019100	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000018500	0.000000000	0.000000000	0.000021000	0.000000000	0.000018700	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000027100	0.000000000	0.000000000	0.000024600	0.000024600	0.000000000	0.000000000
C9H9NO4	195.053153	1.000	0.444	0.11	0.0000	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044700	0.000033400	0.000033700	0.000036800	0.000031100	0.000030100	0.000031700	0.000030800	0.000033000	0.000026400	0.000025900	0.000033200	0.000035000	0.000018700	0.000018900	0.000028000	0.000030300	0.000032700	0.000018900	0.000030600	0.000025300	0.000026700	0.000029700	0.000045600	0.000039100	0.000035300	0.000029100	0.000040100	0.000034600	0.000058600	0.000063600	0.000049500	0.000047400	0.000058900	0.000061900
C10H13NOS	195.071770	1.300	0.100	0.10	0.1000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H13NO3	195.089537	1.300	0.300	0.10	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000071900	0.000054000	0.000076000	0.000071100	0.000074100	0.000063400	0.000069200	0.000054200	0.000060200	0.000052200	0.000041600	0.000057100	0.000055400	0.000064100	0.000069500	0.000082100	0.000084400	0.000074000	0.000072700	0.000072600	0.000069800	0.000096200	0.000079500	0.000068500	0.000076500	0.000081300	0.000080300	0.000085400	0.000085000	0.000103900	0.000093200	0.000083200	0.000083200	0.000067300	0.000068000
C11H17NO2	195.125952	1.545	0.182	0.09	0.0000	0.0000	0.22	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000019500	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000024400	0.000025900	0.000000000	0.000028500	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000023800	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H8O3S	196.019441	0.889	0.333	0.00	0.1111	0.0000	0.54	6	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025600	0.000023000	0.000023900	0.000024900	0.000028400	0.000027900	0.000019800	0.000000000	0.000000000	0.000000000	0.000021800	0.000018700	0.000022500	0.000021800	0.000000000	0.000025800	0.000024200	0.000024700	0.000000000	0.000023200	0.000022000	0.000029300	0.000028000	0.000022500	0.000028400	0.000019800	0.000023800	0.000037400	0.000035500	0.000000000	0.000000000	0.000044800	0.000038800	0.000000000	0.000021400
C9H8O5	196.037199	0.889	0.556	0.00	0.0000	0.0000	0.54	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000092400	0.000073400	0.000056900	0.000068100	0.000055900	0.000058600	0.000061800	0.000078100	0.000084200	0.000076600	0.000067300	0.000092000	0.000076400	0.000041500	0.000032700	0.000034000	0.000044800	0.000055500	0.000051900	0.000068000	0.000074500	0.000040000	0.000028800	0.000069200	0.000084100	0.000052000	0.000042200	0.000073100	0.000061700	0.000124300	0.000114300	0.000093500	0.000085200	0.000193700	0.000204900
C13H8O2	196.052423	0.615	0.154	0.00	0.0000	0.0000	0.75	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000033700	0.000033400	0.000025100	0.000037200	0.000022700	0.000028300	0.000037400	0.000041300	0.000052200	0.000043000	0.000033200	0.000053200	0.000034800	0.000024600	0.000034400	0.000028200	0.000030900	0.000031600	0.000029500	0.000035200	0.000031700	0.000040100	0.000029500	0.000035700	0.000034800	0.000032700	0.000028200	0.000030100	0.000022000	0.000094500	0.000056000	0.000045500	0.000041300	0.000075700	0.000074200
C10H12O2S	196.055846	1.200	0.200	0.00	0.1000	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000035500	0.000000000	0.000043400	0.000043700	0.000041800	0.000034000	0.000036400	0.000024000	0.000026300	0.000018300	0.000030500	0.000020900	0.000024600	0.000034800	0.000039000	0.000046500	0.000052900	0.000028600	0.000029500	0.000000000	0.000035000	0.000057800	0.000044300	0.000029800	0.000038200	0.000039200	0.000038600	0.000050200	0.000047100	0.000000000	0.000000000	0.000047000	0.000042400	0.000000000	0.000000000
C10H12O4	196.073598	1.200	0.400	0.00	0.0000	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000237100	0.000241700	0.000179300	0.000200800	0.000196500	0.000188600	0.000194700	0.000243600	0.000249300	0.000226400	0.000213100	0.000254500	0.000222300	0.000183600	0.000199200	0.000205100	0.000180100	0.000234600	0.000232400	0.000197600	0.000188500	0.000167800	0.000156000	0.000244200	0.000245000	0.000224800	0.000209700	0.000207400	0.000214300	0.000379700	0.000354100	0.000274300	0.000229000	0.000324400	0.000328400
C9H12N2O3	196.084800	1.333	0.333	0.22	0.0000	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000019400	0.000020300	0.000024100	0.000033200	0.000000000	0.000023200	0.000019600	0.000025300
C14H12O	196.088829	0.857	0.071	0.00	0.0000	0.0000	0.63	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022600	0.000026000	0.000020100	0.000000000	0.000025200	0.000026100	0.000033800	0.000027000	0.000023000	0.000027900	0.000018200	0.000027200	0.000024200	0.000018300	0.000021900	0.000000000	0.000023600	0.000023400	0.000022200	0.000018400	0.000028200	0.000018700	0.000000000	0.000028000	0.000026900	0.000019500	0.000018600	0.000019700	0.000023800	0.000030400	0.000024600	0.000034200	0.000031300	0.000029100	0.000036700
C11H16OS	196.092208	1.455	0.091	0.00	0.0909	0.0000	0.26	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019600	0.000000000	0.000000000	0.000018300	0.000020100	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000019700	0.000023100	0.000025500	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000024000	0.000018600	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H16O3	196.109966	1.455	0.273	0.00	0.0000	0.0000	0.26	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000243600	0.000287800	0.000265900	0.000295700	0.000317700	0.000319400	0.000285400	0.000316500	0.000333800	0.000305400	0.000265100	0.000317000	0.000267400	0.000338800	0.000367000	0.000365100	0.000337400	0.000377100	0.000399400	0.000273700	0.000279300	0.000298800	0.000289300	0.000302600	0.000333600	0.000326200	0.000311000	0.000314500	0.000316000	0.000448600	0.000398300	0.000335900	0.000261400	0.000309000	0.000324000
C10H16N2O2	196.121166	1.600	0.200	0.20	0.0000	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	1	0	0	1	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H20O2	196.146330	1.667	0.167	0.00	0.0000	0.0000	0.18	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000041200	0.000059000	0.000059700	0.000057500	0.000076600	0.000080200	0.000072800	0.000067200	0.000069100	0.000063700	0.000049400	0.000072100	0.000056300	0.000090100	0.000100300	0.000084800	0.000074600	0.000095400	0.000102000	0.000083200	0.000077100	0.000087700	0.000076600	0.000056000	0.000071600	0.000075800	0.000075400	0.000071900	0.000069100	0.000083600	0.000075900	0.000082200	0.000061800	0.000055400	0.000066200
C8H7NO5	197.032459	0.875	0.625	0.13	0.0000	0.0000	0.56	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025500	0.000026300	0.000000000	0.000000000	0.000032200	0.000020300
C12H7NO2	197.047678	0.583	0.167	0.08	0.0000	0.0000	0.80	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000021600	0.000018600	0.000000000	0.000000000	0.000023200	0.000000000
C9H11NO2S	197.051083	1.222	0.222	0.11	0.1111	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000021400	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H11NO4	197.068848	1.222	0.444	0.11	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000059300	0.000046800	0.000035800	0.000041000	0.000040000	0.000036900	0.000040100	0.000033700	0.000033500	0.000033900	0.000036100	0.000043200	0.000049000	0.000036600	0.000030800	0.000043500	0.000035300	0.000044800	0.000038000	0.000039100	0.000034500	0.000042800	0.000043900	0.000054600	0.000046700	0.000041700	0.000047800	0.000045700	0.000054200	0.000074900	0.000078300	0.000066400	0.000054200	0.000066900	0.000069300
C13H11NO	197.084066	0.846	0.077	0.08	0.0000	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000019300	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000019300	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000
C10H15NO3	197.105235	1.500	0.300	0.10	0.0000	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000030100	0.000000000	0.000035500	0.000038100	0.000036700	0.000031300	0.000028300	0.000000000	0.000027400	0.000000000	0.000000000	0.000000000	0.000023400	0.000033500	0.000037300	0.000051800	0.000049200	0.000037800	0.000042500	0.000029500	0.000035200	0.000049600	0.000042600	0.000032700	0.000033500	0.000033400	0.000038800	0.000035100	0.000030500	0.000049300	0.000039900	0.000041300	0.000037400	0.000026500	0.000021800
C8H6O6	198.016481	0.750	0.750	0.00	0.0000	0.0000	0.60	6	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000037400	0.000039300	0.000019800	0.000019600	0.000000000	0.000021600	0.000028100	0.000029200	0.000040900	0.000028300	0.000040200	0.000028000	0.000035800	0.000000000	0.000018800	0.000000000	0.000000000	0.000020700	0.000000000	0.000033000	0.000028600	0.000000000	0.000000000	0.000037000	0.000034800	0.000000000	0.000018600	0.000020200	0.000000000	0.000040800	0.000039700	0.000039400	0.000032900	0.000086600	0.000081800
C12H6O3	198.031697	0.500	0.250	0.00	0.0000	0.0000	0.81	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000018500	0.000028400	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027400	0.000000000	0.000020000	0.000038900	0.000028100
C9H10O3S	198.035106	1.111	0.333	0.00	0.1111	0.0000	0.38	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047300	0.000000000	0.000045300	0.000061900	0.000037700	0.000029300	0.000034100	0.000024500	0.000023700	0.000000000	0.000000000	0.000027100	0.000026200	0.000028400	0.000030400	0.000053100	0.000052800	0.000026500	0.000026200	0.000028500	0.000040600	0.000046300	0.000049500	0.000041700	0.000041400	0.000043200	0.000035700	0.000055300	0.000068700	0.000000000	0.000020700	0.000059800	0.000054500	0.000000000	0.000018300
C9H10O5	198.052864	1.111	0.556	0.00	0.0000	0.0000	0.38	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000118500	0.000110100	0.000078600	0.000084800	0.000069400	0.000085400	0.000078500	0.000092600	0.000110400	0.000099400	0.000091000	0.000116200	0.000097000	0.000062100	0.000054900	0.000068000	0.000068400	0.000094200	0.000080900	0.000086200	0.000081500	0.000060000	0.000056900	0.000107700	0.000101400	0.000082400	0.000075200	0.000082800	0.000082500	0.000189700	0.000183900	0.000121600	0.000107400	0.000195700	0.000199600
C8H10N2O4	198.064070	1.250	0.500	0.25	0.0000	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000021800	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000
C13H10O2	198.068091	0.769	0.154	0.00	0.0000	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000084200	0.000065400	0.000061500	0.000080100	0.000071400	0.000061100	0.000068100	0.000084000	0.000094200	0.000074500	0.000069000	0.000090100	0.000076600	0.000056600	0.000070000	0.000066900	0.000064100	0.000065600	0.000060200	0.000069100	0.000070100	0.000074400	0.000047400	0.000078200	0.000082800	0.000066000	0.000072700	0.000071000	0.000070600	0.000125700	0.000096500	0.000108200	0.000089500	0.000117800	0.000119200
C10H14O2S	198.071498	1.400	0.200	0.00	0.1000	0.0000	0.25	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027400	0.000000000	0.000034800	0.000033900	0.000024300	0.000033700	0.000024200	0.000019600	0.000018900	0.000018400	0.000000000	0.000022700	0.000000000	0.000032000	0.000030200	0.000045200	0.000031400	0.000028300	0.000026700	0.000029300	0.000033500	0.000041700	0.000041000	0.000018000	0.000022800	0.000029000	0.000026600	0.000038700	0.000043500	0.000000000	0.000000000	0.000033500	0.000028900	0.000000000	0.000000000
C10H14O4	198.089247	1.400	0.400	0.00	0.0000	0.0000	0.25	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000207300	0.000224600	0.000201300	0.000227800	0.000231500	0.000246300	0.000228100	0.000233600	0.000252700	0.000247100	0.000202000	0.000234900	0.000206700	0.000238700	0.000249900	0.000265900	0.000243300	0.000301000	0.000325100	0.000217800	0.000216900	0.000215100	0.000219700	0.000245700	0.000273000	0.000239800	0.000245900	0.000231900	0.000227700	0.000429600	0.000396800	0.000263900	0.000223400	0.000283600	0.000296700
C14H14O	198.104480	1.000	0.071	0.00	0.0000	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000031600	0.000028500	0.000024500	0.000031800	0.000033400	0.000028700	0.000031700	0.000039400	0.000039900	0.000036000	0.000038600	0.000041900	0.000032700	0.000034500	0.000040600	0.000032300	0.000025900	0.000043200	0.000038200	0.000033400	0.000033800	0.000033000	0.000035800	0.000032300	0.000038600	0.000036200	0.000030700	0.000038800	0.000031800	0.000035400	0.000034500	0.000050000	0.000034400	0.000039000	0.000032600
C11H18O3	198.125627	1.636	0.273	0.00	0.0000	0.0000	0.16	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000074000	0.000083400	0.000102100	0.000094200	0.000108100	0.000121100	0.000115200	0.000113300	0.000100000	0.000090900	0.000090500	0.000101100	0.000073800	0.000120400	0.000149100	0.000133700	0.000125300	0.000143500	0.000166200	0.000093000	0.000103800	0.000125100	0.000121500	0.000092800	0.000097500	0.000106400	0.000110300	0.000102200	0.000102600	0.000146000	0.000113900	0.000097300	0.000092000	0.000090900	0.000092500
C8H9NO3S	199.030313	1.125	0.375	0.13	0.1250	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000025000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H9NO5	199.048075	1.125	0.625	0.13	0.0000	0.0000	0.33	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026100	0.000020600	0.000000000	0.000018700	0.000000000	0.000022100	0.000025900	0.000020700	0.000000000	0.000018300	0.000000000	0.000030000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028300	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000020900	0.000000000	0.000000000	0.000024600	0.000026700	0.000034600	0.000037000	0.000023800	0.000033800	0.000032300	0.000029300
C12H9NO2	199.063333	0.750	0.167	0.08	0.0000	0.0000	0.70	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034500	0.000024000	0.000028000	0.000036400	0.000027300	0.000026500	0.000031000	0.000029300	0.000033800	0.000023300	0.000018700	0.000037200	0.000021600	0.000019400	0.000020200	0.000031700	0.000038700	0.000022800	0.000023000	0.000023900	0.000027600	0.000025100	0.000026100	0.000037700	0.000024400	0.000037400	0.000032700	0.000035000	0.000036800	0.000035400	0.000032600	0.000041200	0.000045800	0.000025800	0.000028700
C9H13NO4	199.084456	1.444	0.444	0.11	0.0000	0.0000	0.17	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000040200	0.000028300	0.000038500	0.000039000	0.000028500	0.000037100	0.000025800	0.000041200	0.000026000	0.000023700	0.000026300	0.000027900	0.000034000	0.000028200	0.000031100	0.000047900	0.000040300	0.000035800	0.000037500	0.000038800	0.000032100	0.000038500	0.000039800	0.000033800	0.000038000	0.000040500	0.000047800	0.000040300	0.000034500	0.000059100	0.000064800	0.000039300	0.000052800	0.000042900	0.000047800
C13H13NO	199.099716	1.000	0.077	0.08	0.0000	0.0000	0.57	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022600	0.000000000	0.000000000	0.000029200	0.000000000	0.000018700	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000025900	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000020800	0.000029100	0.000020800	0.000019900	0.000000000	0.000000000	0.000000000	0.000019000	0.000024700	0.000023800	0.000018300	0.000026800	0.000021700	0.000000000	0.000000000
C10H17NO3	199.120838	1.700	0.300	0.10	0.0000	0.0000	0.07	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000019100	0.000023500	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H8O4S	200.014318	1.000	0.500	0.00	0.1250	0.0000	0.40	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000030000	0.000000000	0.000020700	0.000027400	0.000028000	0.000018800	0.000000000	0.000000000	0.000021800	0.000023500	0.000018600	0.000000000	0.000023200	0.000022800	0.000018100	0.000026700	0.000019500	0.000019000	0.000018100	0.000020300	0.000000000	0.000019000	0.000022500	0.000036200	0.000029100	0.000019900	0.000000000	0.000031100	0.000027800	0.000023600	0.000021800	0.000032800	0.000031900	0.000023400	0.000027500
C8H8O6	200.032077	1.000	0.750	0.00	0.0000	0.0000	0.40	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000032500	0.000029300	0.000022500	0.000000000	0.000000000	0.000022700	0.000031400	0.000031100	0.000033000	0.000031600	0.000029200	0.000027300	0.000028000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000020900	0.000021900	0.000020100	0.000000000	0.000000000	0.000021900	0.000028300	0.000000000	0.000020000	0.000022900	0.000024600	0.000055900	0.000053000	0.000034700	0.000036700	0.000074400	0.000075600
C12H8O3	200.047381	0.667	0.250	0.00	0.0000	0.0000	0.71	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000079800	0.000063700	0.000051000	0.000055200	0.000048400	0.000043800	0.000059100	0.000070900	0.000079800	0.000069400	0.000067000	0.000065100	0.000072000	0.000042200	0.000046300	0.000038200	0.000041300	0.000045900	0.000042200	0.000054800	0.000069500	0.000040600	0.000027500	0.000067100	0.000072500	0.000048300	0.000048100	0.000063000	0.000058500	0.000096500	0.000087000	0.000092800	0.000086900	0.000128800	0.000120900
C9H12O3S	200.050708	1.333	0.333	0.00	0.1111	0.0000	0.23	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044400	0.000022200	0.000047800	0.000048500	0.000036700	0.000032900	0.000040800	0.000027700	0.000028200	0.000000000	0.000019100	0.000024100	0.000024900	0.000053600	0.000062000	0.000054500	0.000046400	0.000040800	0.000035700	0.000043100	0.000035000	0.000063600	0.000054400	0.000038300	0.000038900	0.000044000	0.000046700	0.000056300	0.000053900	0.000026500	0.000025600	0.000053700	0.000049000	0.000018600	0.000000000
C11H8N2O2	200.058605	0.727	0.182	0.18	0.0000	0.0000	0.75	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000024100	0.000022300	0.000000000	0.000000000
C9H12O5	200.068474	1.333	0.556	0.00	0.0000	0.0000	0.23	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000128400	0.000131800	0.000110000	0.000121300	0.000120600	0.000125300	0.000124200	0.000146000	0.000132600	0.000136500	0.000127300	0.000142700	0.000123200	0.000114600	0.000119800	0.000130300	0.000130700	0.000160000	0.000169800	0.000128300	0.000116400	0.000099600	0.000108700	0.000162900	0.000150500	0.000145400	0.000138200	0.000139700	0.000133600	0.000305700	0.000287600	0.000163500	0.000157800	0.000235200	0.000243600
C13H12O2	200.083769	0.923	0.154	0.00	0.0000	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000103800	0.000104000	0.000093500	0.000108100	0.000094400	0.000098600	0.000100600	0.000121000	0.000122300	0.000111700	0.000095300	0.000117700	0.000098500	0.000093800	0.000109000	0.000099200	0.000101500	0.000100700	0.000097800	0.000099800	0.000103900	0.000092700	0.000082000	0.000118800	0.000118000	0.000096800	0.000102100	0.000110500	0.000106100	0.000122800	0.000123400	0.000146800	0.000110200	0.000116200	0.000126500
C10H16O2S	200.087109	1.600	0.200	0.00	0.1000	0.0000	0.12	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000000000	0.000000000	0.000023800	0.000029800	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000028200	0.000028100	0.000000000	0.000000000	0.000023900	0.000025900	0.000038700	0.000037200	0.000000000	0.000000000	0.000029000	0.000000000	0.000026900	0.000026900	0.000000000	0.000000000	0.000025600	0.000029600	0.000000000	0.000000000
C12H12N2O	200.094986	1.000	0.083	0.17	0.0000	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000021100	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H16O4	200.104873	1.600	0.400	0.00	0.0000	0.0000	0.12	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000091400	0.000111800	0.000127900	0.000122900	0.000143800	0.000143400	0.000131400	0.000137600	0.000124500	0.000118800	0.000094400	0.000127000	0.000112200	0.000144700	0.000161500	0.000177200	0.000172600	0.000189000	0.000217700	0.000127600	0.000125300	0.000142400	0.000144000	0.000139200	0.000141400	0.000149800	0.000135300	0.000137400	0.000135000	0.000254200	0.000214100	0.000137100	0.000111700	0.000158800	0.000173800
C14H16O	200.120151	1.143	0.071	0.00	0.0000	0.0000	0.48	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000033700	0.000041200	0.000034200	0.000045300	0.000054700	0.000042300	0.000039100	0.000057000	0.000050300	0.000052000	0.000039700	0.000055200	0.000045900	0.000038200	0.000060000	0.000044100	0.000041700	0.000043500	0.000062900	0.000037900	0.000041800	0.000037900	0.000031600	0.000043500	0.000039600	0.000042700	0.000038800	0.000041600	0.000039100	0.000036600	0.000044800	0.000044200	0.000045900	0.000040100	0.000034700
C11H20O3	200.141273	1.818	0.273	0.00	0.0000	0.0000	0.05	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000023400	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000023100	0.000018200	0.000024500	0.000020800	0.000000000	0.000000000	0.000023200	0.000019000	0.000019400	0.000000000	0.000022900	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H7NO3	201.042581	0.636	0.273	0.09	0.0000	0.0000	0.76	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000025000	0.000000000	0.000018600	0.000023700	0.000020300	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000021100	0.000000000	0.000024900	0.000023400	0.000021600	0.000000000	0.000023600	0.000018700	0.000028600	0.000024100	0.000034000	0.000027600	0.000025200	0.000035400
C8H11NO3S	201.045993	1.375	0.375	0.13	0.1250	0.0000	0.11	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000018200	0.000000000	0.000018200	0.000031000	0.000024300	0.000021100	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000020700	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000
C8H11NO5	201.063724	1.375	0.625	0.13	0.0000	0.0000	0.11	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000020400	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000031400	0.000026900	0.000018300	0.000000000	0.000022900	0.000020800
C12H11NO2	201.078989	0.917	0.167	0.08	0.0000	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000058400	0.000036700	0.000043900	0.000058900	0.000052600	0.000048100	0.000050900	0.000036300	0.000037500	0.000029400	0.000035700	0.000035600	0.000033200	0.000046900	0.000041500	0.000060600	0.000059200	0.000048700	0.000036400	0.000049500	0.000056500	0.000063600	0.000057500	0.000043300	0.000053800	0.000044900	0.000049800	0.000068100	0.000070000	0.000046100	0.000055100	0.000065600	0.000067800	0.000047400	0.000042900
C9H15NO4	201.100103	1.667	0.444	0.11	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000018700	0.000025400	0.000018400	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H15NO	201.115403	1.154	0.077	0.08	0.0000	0.0000	0.48	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000	0.000021500	0.000025500	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000
C8H10O2S2	202.012156	1.250	0.250	0.00	0.2500	0.0000	0.20	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O4	202.026648	0.545	0.364	0.00	0.0000	0.0000	0.78	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000048900	0.000041000	0.000021400	0.000032900	0.000022100	0.000030100	0.000036500	0.000038900	0.000042300	0.000035400	0.000039200	0.000040400	0.000057600	0.000018900	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000038600	0.000035200	0.000000000	0.000000000	0.000043300	0.000047300	0.000022000	0.000021900	0.000031000	0.000026100	0.000055500	0.000063000	0.000047800	0.000049500	0.000105100	0.000099600
C8H10O4S	202.029971	1.250	0.500	0.00	0.1250	0.0000	0.20	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029800	0.000000000	0.000000000	0.000030100	0.000000000	0.000000000	0.000019400	0.000023000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000022000	0.000023900	0.000000000	0.000026600	0.000020200	0.000020800	0.000018200	0.000027500	0.000020800	0.000031900	0.000031400	0.000000000	0.000000000	0.000029400	0.000024200	0.000000000	0.000000000
C12H10OS	202.045291	0.833	0.083	0.00	0.0833	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026500	0.000000000	0.000018800	0.000021100	0.000018500	0.000000000	0.000000000
C8H10O6	202.047755	1.250	0.750	0.00	0.0000	0.0000	0.20	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000041600	0.000032800	0.000026800	0.000025800	0.000026400	0.000018300	0.000035100	0.000045800	0.000033300	0.000038600	0.000036000	0.000033400	0.000028700	0.000021000	0.000022500	0.000018200	0.000000000	0.000027200	0.000026300	0.000031900	0.000029400	0.000000000	0.000000000	0.000031700	0.000044400	0.000030000	0.000026900	0.000024800	0.000028700	0.000070200	0.000071700	0.000036700	0.000049400	0.000069600	0.000075400
C12H10O3	202.063022	0.833	0.250	0.00	0.0000	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000173200	0.000163100	0.000133400	0.000161700	0.000145500	0.000153600	0.000156000	0.000180300	0.000200500	0.000158400	0.000176100	0.000185200	0.000167500	0.000130300	0.000134800	0.000139100	0.000136500	0.000159900	0.000155400	0.000152500	0.000164000	0.000127900	0.000120700	0.000193600	0.000205100	0.000155700	0.000159100	0.000155900	0.000162400	0.000214900	0.000208100	0.000215500	0.000189300	0.000247400	0.000248400
C9H14O3S	202.066386	1.556	0.333	0.00	0.1111	0.0000	0.08	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025000	0.000019800	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029000	0.000023900	0.000019000	0.000018600	0.000025300	0.000020500	0.000026200	0.000027900	0.000022500	0.000020600	0.000027000	0.000029800	0.000027300	0.000027000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000
C11H10N2O2	202.074273	0.909	0.182	0.18	0.0000	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022400	0.000000000	0.000000000	0.000021300	0.000000000	0.000019000	0.000021800	0.000000000	0.000000000	0.000018800	0.000000000	0.000022000	0.000000000	0.000018200	0.000023900	0.000024700	0.000000000	0.000020400	0.000021400	0.000000000	0.000021100	0.000024000	0.000000000	0.000024600	0.000027700	0.000000000	0.000022000	0.000023900	0.000020500	0.000029000	0.000029900	0.000029100	0.000024100	0.000000000	0.000023300
C9H14O5	202.084165	1.556	0.556	0.00	0.0000	0.0000	0.08	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000041700	0.000057600	0.000051300	0.000053900	0.000064200	0.000070900	0.000051600	0.000057300	0.000058100	0.000060300	0.000048700	0.000053300	0.000057300	0.000062900	0.000056000	0.000077000	0.000070700	0.000088000	0.000101100	0.000057600	0.000057100	0.000055700	0.000052700	0.000063000	0.000061900	0.000065000	0.000065200	0.000057300	0.000058300	0.000126700	0.000110200	0.000064000	0.000045400	0.000081900	0.000089900
C13H14O2	202.099379	1.077	0.154	0.00	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000161900	0.000209800	0.000168700	0.000179100	0.000191700	0.000202500	0.000197200	0.000228000	0.000214700	0.000220100	0.000199500	0.000219600	0.000186500	0.000197800	0.000223400	0.000202000	0.000179500	0.000205500	0.000230700	0.000183200	0.000194000	0.000183800	0.000176300	0.000190900	0.000201900	0.000187200	0.000187600	0.000197000	0.000188100	0.000190100	0.000194600	0.000223800	0.000199700	0.000203600	0.000204900
C10H18O4	202.120535	1.800	0.400	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000027200	0.000021100	0.000021300	0.000048000	0.000022600	0.000024000	0.000031300	0.000000000	0.000000000	0.000028000	0.000000000	0.000050100	0.000036600	0.000031100	0.000039400	0.000063100	0.000076800	0.000027400	0.000031100	0.000048800	0.000024900	0.000027700	0.000025500	0.000040700	0.000028700	0.000021300	0.000027900	0.000032600	0.000040100	0.000018200	0.000000000	0.000026100	0.000032000
C14H18O	202.135756	1.286	0.071	0.00	0.0000	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000051100	0.000061000	0.000052900	0.000067200	0.000066600	0.000064000	0.000065400	0.000089200	0.000080200	0.000084100	0.000076100	0.000082100	0.000064100	0.000067400	0.000097900	0.000073800	0.000065600	0.000075100	0.000104000	0.000070000	0.000065400	0.000061700	0.000065400	0.000065500	0.000076200	0.000055400	0.000061900	0.000067200	0.000067600	0.000054200	0.000069400	0.000068500	0.000061500	0.000061400	0.000069600
C11H9NO3	203.058283	0.818	0.273	0.09	0.0000	0.0000	0.65	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000062800	0.000039300	0.000039900	0.000041000	0.000040800	0.000045500	0.000042100	0.000030400	0.000040900	0.000030500	0.000030900	0.000044200	0.000039900	0.000041500	0.000035500	0.000043500	0.000051300	0.000042500	0.000036300	0.000036400	0.000044100	0.000046300	0.000047900	0.000050000	0.000047100	0.000047600	0.000047500	0.000051400	0.000053500	0.000048800	0.000046700	0.000056200	0.000058300	0.000050700	0.000042400
C12H13NO2	203.094648	1.083	0.167	0.08	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000049500	0.000038000	0.000051900	0.000054900	0.000057900	0.000056200	0.000055000	0.000038800	0.000042100	0.000034300	0.000036600	0.000036800	0.000028700	0.000061300	0.000069600	0.000073900	0.000058400	0.000053300	0.000055600	0.000046500	0.000050700	0.000067600	0.000067900	0.000059300	0.000058500	0.000048100	0.000055100	0.000067700	0.000066800	0.000049700	0.000052400	0.000078200	0.000053200	0.000047800	0.000038100
C13H17NO	203.131002	1.308	0.077	0.08	0.0000	0.0000	0.39	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000020700	0.000000000	0.000018400	0.000000000	0.000019500	0.000020800	0.000000000	0.000000000	0.000000000	0.000022100	0.000019000	0.000019800	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000
C10H4O5	204.005913	0.400	0.500	0.00	0.0000	0.0000	0.87	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000054100	0.000050100
C11H8O2S	204.024527	0.727	0.182	0.00	0.0909	0.0000	0.67	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031100	0.000000000	0.000000000	0.000024400	0.000019500	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000019800	0.000000000	0.000021300	0.000000000	0.000020600	0.000024700	0.000026600	0.000000000	0.000020500	0.000000000	0.000023700	0.000032700	0.000025200	0.000022800	0.000027700	0.000021500	0.000000000	0.000038800	0.000034700	0.000000000	0.000000000	0.000037200	0.000034800	0.000000000	0.000000000
C11H8O4	204.042255	0.727	0.364	0.00	0.0000	0.0000	0.67	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000203700	0.000156000	0.000117000	0.000127000	0.000135000	0.000136800	0.000140100	0.000199100	0.000201200	0.000166800	0.000181200	0.000167700	0.000162900	0.000098800	0.000092900	0.000109400	0.000097800	0.000140100	0.000115500	0.000166400	0.000164600	0.000093400	0.000094500	0.000179000	0.000196700	0.000128300	0.000132300	0.000158800	0.000160100	0.000231300	0.000224800	0.000233200	0.000224600	0.000385800	0.000384600
C8H12O4S	204.045676	1.500	0.500	0.00	0.1250	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000022300	0.000027700	0.000025800	0.000018500	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000018100	0.000020300	0.000020100	0.000032500	0.000019900	0.000022200	0.000022900	0.000024000	0.000019600	0.000000000	0.000000000	0.000023200	0.000022800	0.000023500	0.000000000	0.000000000	0.000019400	0.000018400	0.000000000	0.000000000
C10H8N2O3	204.053504	0.800	0.300	0.20	0.0000	0.0000	0.69	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018900	0.000018100	0.000000000	0.000018200	0.000020800	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000000000	0.000019600	0.000000000	0.000000000	0.000021000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000021600	0.000027600	0.000000000	0.000000000	0.000022200	0.000018800	0.000028700	0.000022800	0.000000000	0.000025700	0.000027300	0.000030700
C12H12OS	204.060874	1.000	0.083	0.00	0.0833	0.0000	0.52	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025200	0.000000000	0.000022800	0.000040400	0.000022500	0.000029200	0.000025000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027700	0.000027800	0.000042800	0.000034100	0.000000000	0.000028100	0.000026700	0.000025200	0.000041800	0.000031700	0.000021700	0.000020100	0.000026200	0.000022600	0.000047500	0.000048800	0.000000000	0.000000000	0.000033500	0.000031900	0.000000000	0.000000000
C8H12O6	204.063406	1.500	0.750	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000024000	0.000000000	0.000021600	0.000000000	0.000000000	0.000023700	0.000020200	0.000021700	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000021200	0.000000000	0.000000000	0.000025200	0.000040800	0.000032700	0.000021800	0.000024900	0.000026900	0.000033100
C12H12O3	204.078652	1.000	0.250	0.00	0.0000	0.0000	0.52	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000309800	0.000309400	0.000271500	0.000304000	0.000294000	0.000288300	0.000287700	0.000329200	0.000340900	0.000319500	0.000296500	0.000321600	0.000297500	0.000268200	0.000285000	0.000281800	0.000292600	0.000334100	0.000320600	0.000294500	0.000290300	0.000282100	0.000249800	0.000319700	0.000338100	0.000308400	0.000297100	0.000304700	0.000305600	0.000347000	0.000349100	0.000360200	0.000342600	0.000375600	0.000378500
C9H16O3S	204.082034	1.778	0.333	0.00	0.1111	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000021500	0.000000000	0.000000000	0.000000000	0.000018800	0.000022100	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H12N2O2	204.089868	1.091	0.182	0.18	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000039100	0.000024800	0.000032400	0.000035600	0.000029900	0.000029800	0.000026100	0.000030800	0.000027300	0.000018400	0.000025800	0.000034900	0.000030200	0.000025600	0.000039900	0.000034100	0.000040300	0.000032700	0.000029400	0.000025600	0.000029100	0.000041800	0.000034600	0.000035000	0.000040400	0.000041700	0.000029900	0.000037900	0.000060700	0.000047900	0.000047800	0.000048600	0.000044300	0.000040700	0.000038900
C9H16O5	204.099764	1.778	0.556	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000026800	0.000000000	0.000000000	0.000019000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000022500	0.000000000	0.000023400	0.000029600	0.000000000	0.000000000	0.000000000	0.000018300	0.000018400	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000025900	0.000020800	0.000000000	0.000000000	0.000021700	0.000022400
C13H16O2	204.115070	1.231	0.154	0.00	0.0000	0.0000	0.42	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000185500	0.000252200	0.000193300	0.000200600	0.000234500	0.000241800	0.000229700	0.000275200	0.000259400	0.000287700	0.000259900	0.000272100	0.000241800	0.000249400	0.000279200	0.000250500	0.000239100	0.000248900	0.000290800	0.000200100	0.000213100	0.000216500	0.000206500	0.000227800	0.000221500	0.000240300	0.000223000	0.000205800	0.000220700	0.000223900	0.000212700	0.000236800	0.000192500	0.000208900	0.000224200
C14H20O	204.151416	1.429	0.071	0.00	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000043500	0.000060100	0.000047000	0.000051800	0.000049200	0.000051100	0.000058400	0.000064300	0.000070800	0.000072100	0.000063600	0.000067300	0.000055800	0.000063300	0.000082500	0.000061600	0.000061600	0.000052100	0.000083100	0.000047000	0.000048000	0.000048900	0.000050400	0.000060900	0.000055000	0.000052500	0.000055800	0.000055400	0.000054100	0.000048200	0.000049100	0.000058200	0.000053700	0.000046600	0.000053600
C10H7NO4	205.037546	0.700	0.400	0.10	0.0000	0.0000	0.71	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000034100	0.000000000	0.000026200	0.000023100	0.000019600	0.000000000	0.000000000	0.000021700	0.000028600	0.000018500	0.000024600	0.000033300	0.000026500	0.000018900	0.000000000	0.000000000	0.000000000	0.000024900	0.000023700	0.000000000	0.000024600	0.000000000	0.000000000	0.000031500	0.000033900	0.000027800	0.000020400	0.000026900	0.000023000	0.000040900	0.000037200	0.000038700	0.000027500	0.000053500	0.000041600
C11H11NOS	205.056152	1.000	0.091	0.09	0.0909	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000020900	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000024100	0.000000000	0.000000000	0.000000000
C11H11NO3	205.073884	1.000	0.273	0.09	0.0000	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000111200	0.000061600	0.000091500	0.000100300	0.000099800	0.000085500	0.000086600	0.000074000	0.000068600	0.000063800	0.000056600	0.000071200	0.000065300	0.000079800	0.000076500	0.000101500	0.000096800	0.000092700	0.000088000	0.000092600	0.000084100	0.000116800	0.000106500	0.000087100	0.000100300	0.000101000	0.000096400	0.000118700	0.000117600	0.000109600	0.000105900	0.000121100	0.000128700	0.000093200	0.000095700
C12H15NO2	205.110318	1.250	0.167	0.08	0.0000	0.0000	0.40	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000046000	0.000032900	0.000047100	0.000058900	0.000055200	0.000053400	0.000049500	0.000043600	0.000041600	0.000039800	0.000038100	0.000035700	0.000037200	0.000055200	0.000061000	0.000064200	0.000064600	0.000054600	0.000051400	0.000050700	0.000048900	0.000064300	0.000065500	0.000044800	0.000053900	0.000055700	0.000063700	0.000055600	0.000060900	0.000059800	0.000054900	0.000067400	0.000052600	0.000040000	0.000035400
C10H6O3S	206.003786	0.600	0.300	0.00	0.1000	0.0000	0.73	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022200	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024500	0.000000000	0.000000000	0.000019900	0.000021400	0.000000000	0.000000000	0.000020300	0.000018800	0.000000000	0.000000000
C10H6O5	206.021512	0.600	0.500	0.00	0.0000	0.0000	0.73	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000119000	0.000083000	0.000069000	0.000053600	0.000065800	0.000068500	0.000072700	0.000104100	0.000110100	0.000087900	0.000094000	0.000081300	0.000095800	0.000039600	0.000032700	0.000029800	0.000045100	0.000050800	0.000041900	0.000096200	0.000101500	0.000040500	0.000036500	0.000091500	0.000105100	0.000055400	0.000039800	0.000074900	0.000082400	0.000139400	0.000134600	0.000127100	0.000143300	0.000311300	0.000297800
C9H6N2O4	206.032747	0.667	0.444	0.22	0.0000	0.0000	0.80	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000021700	0.000000000	0.000000000	0.000000000	0.000023400
C11H10O2S	206.040153	0.909	0.182	0.00	0.0909	0.0000	0.56	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000055100	0.000025000	0.000051100	0.000057800	0.000051300	0.000042700	0.000043600	0.000028900	0.000034100	0.000026700	0.000025900	0.000025100	0.000025000	0.000044500	0.000043300	0.000062200	0.000064300	0.000043600	0.000038500	0.000044900	0.000051700	0.000066500	0.000058200	0.000046300	0.000049700	0.000049200	0.000043300	0.000072100	0.000069600	0.000022800	0.000000000	0.000067300	0.000067000	0.000019400	0.000000000
C11H10O4	206.057947	0.909	0.364	0.00	0.0000	0.0000	0.56	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000253800	0.000228900	0.000183900	0.000198600	0.000184600	0.000181300	0.000185000	0.000228300	0.000237100	0.000231300	0.000224200	0.000242800	0.000228200	0.000151400	0.000154100	0.000172000	0.000172200	0.000213400	0.000199300	0.000210700	0.000210500	0.000168700	0.000154000	0.000242100	0.000260300	0.000212700	0.000205300	0.000205800	0.000214000	0.000314500	0.000312900	0.000285900	0.000242900	0.000381900	0.000388800
C8H14O4S	206.061276	1.750	0.500	0.00	0.1250	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000019600	0.000020200	0.000000000	0.000018800	0.000000000	0.000021900	0.000021900	0.000019100	0.000000000	0.000018500	0.000000000	0.000021800	0.000000000	0.000022500	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H10N2O3	206.069177	1.000	0.300	0.20	0.0000	0.0000	0.54	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028800	0.000018600	0.000021200	0.000030300	0.000028400	0.000020800	0.000021300	0.000020500	0.000024400	0.000000000	0.000024000	0.000018500	0.000020400	0.000000000	0.000026300	0.000031200	0.000029500	0.000000000	0.000024300	0.000023000	0.000026400	0.000027900	0.000026700	0.000027700	0.000028300	0.000035300	0.000021800	0.000028000	0.000028200	0.000036100	0.000042400	0.000039100	0.000031200	0.000027400	0.000038200
C12H14OS	206.076576	1.167	0.083	0.00	0.0833	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020700	0.000000000	0.000023500	0.000027700	0.000000000	0.000023600	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000027700	0.000028900	0.000026800	0.000022400	0.000024700	0.000022400	0.000000000	0.000032900	0.000028600	0.000024000	0.000000000	0.000020800	0.000000000	0.000024800	0.000042100	0.000000000	0.000000000	0.000027800	0.000021100	0.000000000	0.000000000
C12H14O3	206.094296	1.167	0.250	0.00	0.0000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000432000	0.000501500	0.000430900	0.000433000	0.000477600	0.000462700	0.000447200	0.000541800	0.000519800	0.000513300	0.000471400	0.000545300	0.000486800	0.000456900	0.000490300	0.000474500	0.000447700	0.000504500	0.000535700	0.000438800	0.000438400	0.000425000	0.000408700	0.000467500	0.000489600	0.000485600	0.000476300	0.000455400	0.000452000	0.000518600	0.000493200	0.000498700	0.000455300	0.000512100	0.000536200
C11H14N2O2	206.105549	1.273	0.182	0.18	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000026500	0.000021700	0.000020500	0.000036700	0.000019700	0.000028700	0.000032000	0.000023900	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000032400	0.000023000	0.000035700	0.000037800	0.000034900	0.000030800	0.000028300	0.000028000	0.000045200	0.000033700	0.000028900	0.000028700	0.000032300	0.000033400	0.000037900	0.000029600	0.000043500	0.000042000	0.000034000	0.000028300	0.000022400	0.000020200
C13H18O2	206.130697	1.385	0.154	0.00	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000215600	0.000304300	0.000229800	0.000259400	0.000270000	0.000271500	0.000261600	0.000349100	0.000324100	0.000327100	0.000302400	0.000326900	0.000273500	0.000308100	0.000364000	0.000307000	0.000281800	0.000305900	0.000366600	0.000239100	0.000249800	0.000240700	0.000241200	0.000266800	0.000274200	0.000269700	0.000272300	0.000267500	0.000258900	0.000269900	0.000269500	0.000277800	0.000259500	0.000250100	0.000273300
C14H22O	206.167088	1.571	0.071	0.00	0.0000	0.0000	0.26	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000029500	0.000023200	0.000028900	0.000037400	0.000040400	0.000035800	0.000037800	0.000030300	0.000027900	0.000032000	0.000035700	0.000026700	0.000042500	0.000060000	0.000034300	0.000028500	0.000041500	0.000060900	0.000035800	0.000039300	0.000044100	0.000032100	0.000037800	0.000035500	0.000026000	0.000039500	0.000030300	0.000027100	0.000040500	0.000041800	0.000038500	0.000027000	0.000027500	0.000032100
C9H5NO5	207.016809	0.556	0.556	0.11	0.0000	0.0000	0.82	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000023000	0.000000000	0.000000000	0.000022600	0.000000000
C10H9NO2S	207.035392	0.900	0.200	0.10	0.1000	0.0000	0.57	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020700	0.000000000	0.000021700	0.000038800	0.000024100	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000031700	0.000030100	0.000021300	0.000025200	0.000018800	0.000000000	0.000025700	0.000025200	0.000025000	0.000021900	0.000019200	0.000018200	0.000030300	0.000032700	0.000000000	0.000000000	0.000028200	0.000025700	0.000000000	0.000000000
C10H9NO4	207.053151	0.900	0.400	0.10	0.0000	0.0000	0.57	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000066400	0.000044300	0.000045900	0.000057900	0.000047200	0.000047400	0.000046400	0.000040200	0.000045600	0.000043600	0.000039600	0.000043800	0.000033000	0.000040100	0.000039700	0.000049500	0.000040500	0.000047900	0.000049700	0.000042500	0.000045700	0.000047700	0.000046700	0.000056800	0.000055700	0.000053500	0.000056700	0.000063100	0.000064700	0.000088900	0.000097100	0.000068600	0.000074800	0.000081700	0.000082800
C11H13NOS	207.071814	1.182	0.091	0.09	0.0909	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H13NO3	207.089582	1.182	0.273	0.09	0.0000	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000079600	0.000054900	0.000086700	0.000089900	0.000082300	0.000082000	0.000075100	0.000070800	0.000064000	0.000046000	0.000051400	0.000067000	0.000059900	0.000078900	0.000078300	0.000095600	0.000091700	0.000077200	0.000078700	0.000072000	0.000080400	0.000104300	0.000102600	0.000083500	0.000087100	0.000081200	0.000086200	0.000088600	0.000087800	0.000112600	0.000105100	0.000093200	0.000089600	0.000066300	0.000069500
C12H17NO2	207.125922	1.417	0.167	0.08	0.0000	0.0000	0.30	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034200	0.000030000	0.000042600	0.000032200	0.000041400	0.000037500	0.000037800	0.000037800	0.000027100	0.000023100	0.000023800	0.000030100	0.000030900	0.000042800	0.000050300	0.000049100	0.000045600	0.000047400	0.000052600	0.000038500	0.000038000	0.000051700	0.000055100	0.000037000	0.000031100	0.000033900	0.000027300	0.000041200	0.000049000	0.000053400	0.000033800	0.000047300	0.000038900	0.000028000	0.000026900
C9H4O6	208.000800	0.444	0.667	0.00	0.0000	0.0000	0.83	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025800	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026700	0.000031700	0.000020700	0.000031800	0.000022000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028000	0.000028500	0.000000000	0.000000000	0.000018100	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000026800	0.000032500	0.000021700	0.000028600	0.000086100	0.000093000
C10H8O3S	208.019407	0.800	0.300	0.00	0.1000	0.0000	0.60	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000069500	0.000029100	0.000045500	0.000069000	0.000051800	0.000043600	0.000044200	0.000025100	0.000034300	0.000031500	0.000029800	0.000035500	0.000034100	0.000041400	0.000041100	0.000053200	0.000052800	0.000033500	0.000038100	0.000050300	0.000047300	0.000060200	0.000067100	0.000051700	0.000056300	0.000041100	0.000049500	0.000070600	0.000073700	0.000032700	0.000022700	0.000068300	0.000076800	0.000021200	0.000029800
C10H8O5	208.037197	0.800	0.500	0.00	0.0000	0.0000	0.60	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000127900	0.000094500	0.000082300	0.000081200	0.000081000	0.000080000	0.000089600	0.000109500	0.000121600	0.000104700	0.000097100	0.000096500	0.000113000	0.000051800	0.000058200	0.000058900	0.000068000	0.000090900	0.000075100	0.000104600	0.000106600	0.000058800	0.000051700	0.000108500	0.000118100	0.000070500	0.000081000	0.000085100	0.000094800	0.000156700	0.000143200	0.000149300	0.000139000	0.000276600	0.000285600
C9H8N2O4	208.048409	0.889	0.444	0.22	0.0000	0.0000	0.60	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000027100	0.000019700	0.000000000	0.000000000	0.000019500	0.000023900
C14H8O2	208.052439	0.571	0.143	0.00	0.0000	0.0000	0.77	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000023500	0.000000000	0.000029800	0.000020100
C11H12O2S	208.055838	1.091	0.182	0.00	0.0909	0.0000	0.44	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000047000	0.000024200	0.000062000	0.000067900	0.000045200	0.000045600	0.000040400	0.000025100	0.000033200	0.000026800	0.000019500	0.000032900	0.000018300	0.000045800	0.000044000	0.000065700	0.000065100	0.000048700	0.000041800	0.000044800	0.000051300	0.000072200	0.000069200	0.000040400	0.000036400	0.000043900	0.000051400	0.000057600	0.000064900	0.000000000	0.000000000	0.000060500	0.000049900	0.000000000	0.000000000
C11H12O4	208.073563	1.091	0.364	0.00	0.0000	0.0000	0.44	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000384200	0.000365000	0.000311700	0.000325800	0.000328500	0.000331900	0.000323600	0.000369900	0.000379600	0.000371800	0.000348700	0.000400500	0.000366800	0.000295500	0.000290700	0.000322500	0.000301500	0.000369100	0.000360000	0.000316400	0.000328100	0.000288400	0.000266800	0.000394200	0.000384800	0.000354200	0.000352000	0.000328700	0.000346300	0.000517500	0.000525900	0.000413500	0.000384900	0.000525300	0.000527100
C10H12N2O3	208.084803	1.200	0.300	0.20	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034000	0.000024200	0.000000000	0.000028200	0.000019100	0.000018500	0.000025300	0.000027400	0.000033300	0.000000000	0.000000000	0.000024200	0.000030800	0.000032000	0.000000000	0.000029800	0.000025600	0.000019100	0.000023500	0.000000000	0.000020300	0.000036200	0.000030000	0.000030400	0.000026700	0.000024300	0.000028300	0.000028600	0.000041100	0.000049100	0.000050100	0.000033100	0.000040000	0.000023700	0.000035700
C15H12O	208.088846	0.800	0.067	0.00	0.0000	0.0000	0.66	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000021700	0.000000000	0.000020800	0.000024500	0.000000000	0.000024900	0.000000000	0.000024200	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000024900	0.000021900	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000022200	0.000022100	0.000000000	0.000000000	0.000021600	0.000022000	0.000018900	0.000035600	0.000020400	0.000032800	0.000027500
C12H16OS	208.092173	1.333	0.083	0.00	0.0833	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000033400	0.000000000	0.000020800	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000029500	0.000027800	0.000028800	0.000021600	0.000020300	0.000000000	0.000023700	0.000027700	0.000033900	0.000000000	0.000000000	0.000000000	0.000000000	0.000031200	0.000024100	0.000000000	0.000000000	0.000024900	0.000021700	0.000000000	0.000000000
C12H16O3	208.109971	1.333	0.250	0.00	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000406700	0.000486400	0.000435900	0.000456300	0.000493100	0.000490200	0.000466400	0.000547700	0.000522100	0.000514700	0.000465500	0.000554300	0.000456700	0.000493700	0.000553300	0.000518000	0.000495800	0.000528900	0.000583600	0.000416400	0.000431300	0.000442600	0.000423300	0.000493000	0.000500800	0.000490600	0.000475300	0.000455800	0.000460100	0.000570200	0.000543800	0.000496500	0.000441200	0.000462000	0.000504700
C11H16N2O2	208.121197	1.455	0.182	0.18	0.0000	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000020700	0.000000000	0.000018100	0.000019100	0.000024600	0.000022300	0.000025900	0.000028400	0.000000000	0.000000000	0.000026400	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000022700	0.000021300	0.000000000	0.000000000	0.000000000	0.000023000
C13H20O2	208.146328	1.538	0.154	0.00	0.0000	0.0000	0.25	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000116000	0.000151500	0.000130600	0.000150900	0.000164600	0.000165300	0.000155100	0.000197800	0.000177900	0.000180600	0.000172100	0.000196500	0.000146800	0.000173400	0.000226500	0.000196100	0.000179800	0.000201600	0.000226400	0.000152500	0.000144900	0.000144200	0.000139800	0.000158100	0.000160500	0.000162200	0.000142900	0.000170800	0.000161100	0.000179800	0.000160200	0.000176000	0.000145500	0.000148200	0.000149600
C9H7NO3S	209.014688	0.778	0.333	0.11	0.1111	0.0000	0.64	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000
C9H7NO5	209.032435	0.778	0.556	0.11	0.0000	0.0000	0.64	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025100	0.000000000	0.000020000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000020100	0.000000000	0.000023800	0.000018800	0.000018200	0.000021200	0.000000000	0.000021100	0.000037900	0.000031000	0.000019300	0.000000000	0.000042600	0.000036100
C10H11NO2S	209.051039	1.100	0.200	0.10	0.1000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028600	0.000000000	0.000028000	0.000031800	0.000022900	0.000030100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000031200	0.000029000	0.000028800	0.000018300	0.000000000	0.000032800	0.000032800	0.000039600	0.000036800	0.000000000	0.000018800	0.000027800	0.000025200	0.000035600	0.000034900	0.000000000	0.000000000	0.000031300	0.000038200	0.000000000	0.000000000
C10H11NO4	209.068834	1.100	0.400	0.10	0.0000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000063400	0.000058400	0.000043700	0.000064400	0.000041900	0.000046600	0.000047600	0.000047100	0.000046100	0.000038100	0.000047700	0.000055200	0.000044100	0.000050200	0.000039700	0.000053600	0.000049700	0.000053800	0.000046900	0.000046300	0.000038200	0.000051300	0.000047500	0.000060200	0.000065200	0.000050000	0.000058300	0.000067300	0.000055800	0.000087100	0.000082100	0.000078500	0.000058300	0.000067700	0.000077200
C14H11NO	209.084055	0.786	0.071	0.07	0.0000	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000018700	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000022800	0.000000000	0.000018900	0.000000000	0.000000000
C11H15NO3	209.105187	1.364	0.273	0.09	0.0000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000076500	0.000050800	0.000085000	0.000081600	0.000079400	0.000072400	0.000080300	0.000063900	0.000056600	0.000046900	0.000036400	0.000061100	0.000054900	0.000081800	0.000080700	0.000093700	0.000101400	0.000074700	0.000081200	0.000080100	0.000081400	0.000104400	0.000110000	0.000075800	0.000076300	0.000084900	0.000088100	0.000098800	0.000091700	0.000098300	0.000093900	0.000095600	0.000082500	0.000060700	0.000064900
C12H19NO2	209.141629	1.583	0.167	0.08	0.0000	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H6O4S	209.998696	0.667	0.444	0.00	0.1111	0.0000	0.67	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000020100	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000018300	0.000022500	0.000000000	0.000000000
C9H6O6	210.016481	0.667	0.667	0.00	0.0000	0.0000	0.67	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000051300	0.000081700	0.000055500	0.000063800	0.000045300	0.000036500	0.000072400	0.000073900	0.000164200	0.000079300	0.000076100	0.000093200	0.000060700	0.000051700	0.000064200	0.000062700	0.000046600	0.000070400	0.000031900	0.000084000	0.000046600	0.000121000	0.000047600	0.000057400	0.000057100	0.000092700	0.000074800	0.000040900	0.000032700	0.000171600	0.000082000	0.000063200	0.000047800	0.000134300	0.000130400
C10H10OS2	210.017346	1.000	0.100	0.00	0.2000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000019100	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028200	0.000023400	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000018500	0.000000000	0.000000000	0.000018400	0.000022300	0.000000000	0.000000000
C13H6O3	210.031686	0.462	0.231	0.00	0.0000	0.0000	0.83	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000019500	0.000000000	0.000021200	0.000022200
C10H10O3S	210.035062	1.000	0.300	0.00	0.1000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000063100	0.000024000	0.000059900	0.000075700	0.000053700	0.000065500	0.000048400	0.000045700	0.000047400	0.000033700	0.000026300	0.000036100	0.000029100	0.000044100	0.000049800	0.000082400	0.000082900	0.000044600	0.000043900	0.000059200	0.000058800	0.000086600	0.000074300	0.000058600	0.000057900	0.000068200	0.000049400	0.000088700	0.000092000	0.000035900	0.000021500	0.000079500	0.000071700	0.000030200	0.000030600
C10H10O5	210.052830	1.000	0.500	0.00	0.0000	0.0000	0.47	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000181300	0.000157800	0.000134300	0.000131100	0.000120900	0.000125300	0.000129300	0.000146600	0.000171000	0.000147400	0.000150400	0.000166500	0.000157000	0.000102600	0.000093900	0.000105500	0.000110300	0.000134100	0.000129600	0.000138400	0.000144400	0.000098800	0.000094000	0.000175100	0.000184300	0.000132600	0.000122600	0.000141300	0.000148900	0.000280500	0.000270600	0.000192400	0.000192600	0.000325500	0.000336500
C9H10N2O4	210.064062	1.111	0.444	0.22	0.0000	0.0000	0.40	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000021500	0.000000000	0.000000000	0.000019600	0.000022200	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000000000	0.000019900	0.000000000	0.000020100	0.000033200	0.000039600	0.000020400	0.000019600	0.000025100	0.000027800
C14H10O2	210.068087	0.714	0.143	0.00	0.0000	0.0000	0.69	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000059300	0.000039000	0.000031000	0.000042600	0.000035300	0.000043900	0.000041400	0.000055700	0.000063600	0.000042400	0.000051500	0.000045800	0.000047500	0.000028700	0.000045100	0.000037100	0.000033400	0.000046800	0.000033000	0.000041800	0.000043400	0.000034400	0.000037700	0.000059700	0.000063200	0.000040600	0.000045600	0.000048200	0.000044900	0.000072500	0.000065900	0.000075400	0.000065200	0.000086600	0.000085500
C11H14O2S	210.071493	1.273	0.182	0.00	0.0909	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000031100	0.000022800	0.000050300	0.000045000	0.000034800	0.000036900	0.000041800	0.000022800	0.000020900	0.000019800	0.000000000	0.000022500	0.000000000	0.000039300	0.000040600	0.000049600	0.000047100	0.000032000	0.000029300	0.000049700	0.000041500	0.000064200	0.000062100	0.000036700	0.000038500	0.000043100	0.000041100	0.000054400	0.000052200	0.000020700	0.000000000	0.000047400	0.000036900	0.000000000	0.000000000
C11H14O4	210.089210	1.273	0.364	0.00	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000449300	0.000474600	0.000423500	0.000465300	0.000472600	0.000457900	0.000447200	0.000509100	0.000501800	0.000469100	0.000436300	0.000514400	0.000475500	0.000480500	0.000485700	0.000509900	0.000494000	0.000531300	0.000554000	0.000434600	0.000426400	0.000434200	0.000419500	0.000519000	0.000534600	0.000512800	0.000484500	0.000470200	0.000459700	0.000701800	0.000688800	0.000544700	0.000488900	0.000538300	0.000584900
C10H14N2O3	210.100450	1.400	0.300	0.20	0.0000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018500	0.000000000	0.000022300	0.000028700	0.000022300	0.000018700	0.000025500	0.000000000	0.000021200	0.000000000	0.000018100	0.000000000	0.000000000	0.000028200	0.000019500	0.000020200	0.000030100	0.000022400	0.000021400	0.000019200	0.000020000	0.000030700	0.000023000	0.000019400	0.000025500	0.000000000	0.000018000	0.000025600	0.000000000	0.000029700	0.000028700	0.000024300	0.000019300	0.000000000	0.000020100
C15H14O	210.104500	0.933	0.067	0.00	0.0000	0.0000	0.59	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000018400	0.000000000	0.000019200	0.000021100	0.000000000	0.000018800	0.000025000	0.000028700	0.000018200	0.000022300	0.000000000	0.000018000	0.000023300	0.000019000	0.000000000	0.000026100	0.000000000	0.000022800	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000025800	0.000000000	0.000000000	0.000020100	0.000022900	0.000018200	0.000027200	0.000027600	0.000027600	0.000028600	0.000026100
C12H18OS	210.107820	1.500	0.083	0.00	0.0833	0.0000	0.24	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000018500	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H18O3	210.125636	1.500	0.250	0.00	0.0000	0.0000	0.24	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000223500	0.000273300	0.000255800	0.000280000	0.000311200	0.000326200	0.000294500	0.000325000	0.000314500	0.000291300	0.000255600	0.000305400	0.000249800	0.000354600	0.000399000	0.000373100	0.000333600	0.000359400	0.000414300	0.000278200	0.000276400	0.000307900	0.000293000	0.000292800	0.000298100	0.000302900	0.000302400	0.000300000	0.000294100	0.000365500	0.000327100	0.000304700	0.000236200	0.000250700	0.000262200
C13H22O2	210.161969	1.692	0.154	0.00	0.0000	0.0000	0.17	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000020200	0.000032900	0.000027700	0.000036400	0.000037600	0.000044300	0.000046700	0.000042800	0.000037900	0.000041500	0.000035900	0.000044000	0.000035100	0.000043000	0.000064600	0.000045700	0.000055100	0.000053100	0.000066000	0.000041200	0.000035800	0.000041200	0.000051000	0.000034100	0.000040000	0.000044100	0.000044400	0.000049700	0.000046700	0.000041400	0.000038800	0.000033100	0.000033600	0.000032100	0.000032700
C9H9NO3S	211.030297	1.000	0.333	0.11	0.1111	0.0000	0.45	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000031900	0.000000000	0.000022100	0.000019000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000027500	0.000024600	0.000021800	0.000000000	0.000019500	0.000027100	0.000027100	0.000031300	0.000020900	0.000000000	0.000000000	0.000000000	0.000028700	0.000039200	0.000000000	0.000000000	0.000034000	0.000030000	0.000000000	0.000000000
C9H9NO5	211.048100	1.000	0.556	0.11	0.0000	0.0000	0.45	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000023200	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000018900	0.000020400	0.000019800	0.000021100	0.000000000	0.000022200	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000021200	0.000000000	0.000019600	0.000039300	0.000047400	0.000031500	0.000024300	0.000040100	0.000043200
C13H9NO2	211.063319	0.692	0.154	0.08	0.0000	0.0000	0.73	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000028500	0.000020700	0.000018600	0.000027200	0.000020800	0.000020900	0.000023200	0.000022600	0.000034700	0.000000000	0.000000000	0.000017900	0.000019200	0.000000000	0.000020500	0.000023500	0.000023800	0.000018400	0.000024100	0.000029600	0.000018400	0.000022100	0.000023300	0.000030500	0.000027100	0.000000000	0.000000000	0.000028500	0.000033600	0.000029300	0.000028600	0.000045500	0.000035600	0.000030500	0.000029300
C10H13NO2S	211.066735	1.300	0.200	0.10	0.1000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020600	0.000028600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000019000	0.000000000	0.000000000	0.000020800	0.000019100	0.000026500	0.000029100	0.000019100	0.000000000	0.000000000	0.000019200	0.000000000	0.000024200	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000000000
C10H13NO4	211.084448	1.300	0.400	0.10	0.0000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000086900	0.000051000	0.000072500	0.000086400	0.000071600	0.000072000	0.000064200	0.000057000	0.000056500	0.000045700	0.000046100	0.000067300	0.000053500	0.000066800	0.000072100	0.000090200	0.000083400	0.000075300	0.000079100	0.000064300	0.000074100	0.000095100	0.000089500	0.000077700	0.000072500	0.000084800	0.000074700	0.000096600	0.000092600	0.000117100	0.000109100	0.000101400	0.000094000	0.000080100	0.000088900
C14H13NO	211.099763	0.929	0.071	0.07	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000
C11H17NO3	211.120873	1.545	0.273	0.09	0.0000	0.0000	0.18	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000035400	0.000031500	0.000026900	0.000035400	0.000020500	0.000023800	0.000030600	0.000022000	0.000019600	0.000000000	0.000023400	0.000037200	0.000037300	0.000050400	0.000038300	0.000039300	0.000043100	0.000032900	0.000032800	0.000046900	0.000042300	0.000025500	0.000023800	0.000032900	0.000027800	0.000033000	0.000033200	0.000042500	0.000031600	0.000033400	0.000028800	0.000025400	0.000021000
C9H8O4S	212.014377	0.889	0.444	0.00	0.1111	0.0000	0.50	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026800	0.000000000	0.000000000	0.000027500	0.000021300	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000031900	0.000029400	0.000000000	0.000018600	0.000024300	0.000027600	0.000026300	0.000022400	0.000024900	0.000022200	0.000018700	0.000000000
C9H8O6	212.032090	0.889	0.667	0.00	0.0000	0.0000	0.50	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000060400	0.000055400	0.000035100	0.000028100	0.000042200	0.000037900	0.000032500	0.000046400	0.000055800	0.000050200	0.000056900	0.000051600	0.000048500	0.000026600	0.000023800	0.000000000	0.000024600	0.000029600	0.000026200	0.000042600	0.000050000	0.000000000	0.000000000	0.000052300	0.000058400	0.000023800	0.000028400	0.000036500	0.000041400	0.000083300	0.000066600	0.000069300	0.000057600	0.000153200	0.000147100
C10H12OS2	212.032961	1.200	0.100	0.00	0.2000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000
C8H8N2O5	212.043311	1.000	0.625	0.25	0.0000	0.0000	0.43	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000019700	0.000000000	0.000000000	0.000000000	0.000020000
C13H8O3	212.047385	0.615	0.231	0.00	0.0000	0.0000	0.74	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000065400	0.000063200	0.000040600	0.000037300	0.000039500	0.000048200	0.000036600	0.000062700	0.000071700	0.000055500	0.000059600	0.000063500	0.000061800	0.000032900	0.000051100	0.000046600	0.000028200	0.000045900	0.000027900	0.000055200	0.000052300	0.000044500	0.000027800	0.000064200	0.000058300	0.000050700	0.000045400	0.000048800	0.000040800	0.000098300	0.000077700	0.000084700	0.000065600	0.000126800	0.000123200
C10H12O3S	212.050715	1.200	0.300	0.00	0.1000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000062900	0.000031500	0.000079200	0.000074600	0.000056600	0.000060500	0.000044300	0.000037300	0.000028900	0.000025500	0.000028600	0.000036900	0.000024100	0.000047800	0.000052700	0.000078000	0.000076200	0.000054700	0.000049400	0.000072300	0.000072200	0.000100000	0.000092300	0.000061700	0.000060100	0.000065900	0.000065600	0.000084100	0.000089900	0.000000000	0.000027400	0.000077300	0.000070900	0.000021100	0.000020700
C10H12O5	212.068517	1.200	0.500	0.00	0.0000	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000195600	0.000193900	0.000168500	0.000176300	0.000176500	0.000175400	0.000174900	0.000195800	0.000212700	0.000194800	0.000177900	0.000214300	0.000191700	0.000175200	0.000162500	0.000193000	0.000194400	0.000226600	0.000234300	0.000162900	0.000175500	0.000161800	0.000151800	0.000209600	0.000221500	0.000199300	0.000192600	0.000188000	0.000200600	0.000410900	0.000385100	0.000229100	0.000189900	0.000329800	0.000333200
C9H12N2O4	212.079744	1.333	0.444	0.22	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025300	0.000000000	0.000000000	0.000020400	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000022400	0.000021600	0.000031400	0.000019700	0.000000000	0.000020000	0.000000000
C14H12O2	212.083729	0.857	0.143	0.00	0.0000	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000093400	0.000080700	0.000068000	0.000083600	0.000083600	0.000082900	0.000088000	0.000103700	0.000091900	0.000088900	0.000090400	0.000093100	0.000085000	0.000081900	0.000091000	0.000082000	0.000077300	0.000080000	0.000089300	0.000083500	0.000085700	0.000087900	0.000077900	0.000099400	0.000101600	0.000073400	0.000074000	0.000093700	0.000094400	0.000102500	0.000096800	0.000126700	0.000115600	0.000107500	0.000124200
C11H16O2S	212.087101	1.455	0.182	0.00	0.0909	0.0000	0.22	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025800	0.000000000	0.000041800	0.000033300	0.000035400	0.000025400	0.000020300	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033100	0.000029700	0.000035200	0.000044300	0.000033300	0.000024100	0.000037700	0.000036400	0.000056300	0.000046800	0.000000000	0.000023000	0.000034100	0.000036400	0.000029000	0.000039300	0.000000000	0.000000000	0.000038500	0.000029400	0.000000000	0.000000000
C11H16O4	212.104875	1.455	0.364	0.00	0.0000	0.0000	0.22	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000307300	0.000357700	0.000400600	0.000370700	0.000449400	0.000449300	0.000423000	0.000389300	0.000386900	0.000355200	0.000321400	0.000390100	0.000327600	0.000456500	0.000491500	0.000510900	0.000460900	0.000512600	0.000571700	0.000375300	0.000400500	0.000464800	0.000425900	0.000387400	0.000408700	0.000426500	0.000422700	0.000408100	0.000397800	0.000590400	0.000537700	0.000429200	0.000358400	0.000382100	0.000404100
C15H16O	212.120108	1.067	0.067	0.00	0.0000	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023200	0.000029100	0.000028900	0.000025800	0.000033500	0.000032800	0.000035000	0.000045000	0.000033500	0.000042800	0.000029200	0.000030900	0.000024500	0.000038100	0.000039900	0.000035200	0.000028100	0.000036400	0.000038700	0.000025500	0.000028800	0.000026400	0.000029900	0.000026200	0.000041500	0.000026800	0.000023800	0.000035000	0.000034700	0.000033800	0.000024900	0.000046400	0.000029700	0.000028500	0.000031400
C12H20O3	212.141232	1.667	0.250	0.00	0.0000	0.0000	0.14	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000059100	0.000078700	0.000099700	0.000086000	0.000110500	0.000115400	0.000099600	0.000098500	0.000099400	0.000079700	0.000059500	0.000093300	0.000077300	0.000115000	0.000148700	0.000131500	0.000122700	0.000135700	0.000166600	0.000103800	0.000099500	0.000121700	0.000123300	0.000086500	0.000098600	0.000092800	0.000096000	0.000101000	0.000101900	0.000123500	0.000099700	0.000099500	0.000075500	0.000075300	0.000077100
C12H7NO3	213.042598	0.583	0.250	0.08	0.0000	0.0000	0.79	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000026200	0.000018900	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000019900	0.000035900	0.000021400	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000020700	0.000000000	0.000020400	0.000000000	0.000000000	0.000023600	0.000000000	0.000027200	0.000028000	0.000000000	0.000000000	0.000000000	0.000028700	0.000026300	0.000030900	0.000029100	0.000023700	0.000031200	0.000033400
C9H11NO3S	213.045962	1.222	0.333	0.11	0.1111	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000027100	0.000000000	0.000032600	0.000036200	0.000022200	0.000022500	0.000025500	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000030600	0.000035600	0.000022100	0.000019400	0.000032600	0.000028600	0.000039300	0.000041200	0.000023400	0.000026700	0.000023000	0.000030800	0.000042000	0.000043500	0.000000000	0.000000000	0.000030500	0.000029700	0.000000000	0.000000000
C9H11NO5	213.063749	1.222	0.556	0.11	0.0000	0.0000	0.27	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000030200	0.000018900	0.000024900	0.000025300	0.000027400	0.000029900	0.000027000	0.000027400	0.000020800	0.000024200	0.000022300	0.000030300	0.000021400	0.000024300	0.000000000	0.000034800	0.000042400	0.000037800	0.000031200	0.000021900	0.000028900	0.000000000	0.000028200	0.000025800	0.000039800	0.000026100	0.000034700	0.000035100	0.000035500	0.000053800	0.000056200	0.000039500	0.000035200	0.000040100	0.000045300
C13H11NO2	213.078967	0.846	0.154	0.08	0.0000	0.0000	0.64	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000050700	0.000026000	0.000035600	0.000060300	0.000045200	0.000050400	0.000041800	0.000041600	0.000036800	0.000028600	0.000029900	0.000040100	0.000024300	0.000031700	0.000045000	0.000053300	0.000058100	0.000043500	0.000037400	0.000039400	0.000047700	0.000051900	0.000049600	0.000041000	0.000047200	0.000041700	0.000048100	0.000068300	0.000056400	0.000041900	0.000038600	0.000066000	0.000064100	0.000036900	0.000040800
C10H15NO4	213.100098	1.500	0.400	0.10	0.0000	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000041500	0.000028600	0.000060600	0.000048800	0.000052500	0.000044900	0.000051500	0.000029300	0.000046700	0.000025700	0.000019700	0.000021000	0.000025200	0.000049200	0.000047100	0.000058000	0.000057600	0.000051200	0.000060200	0.000053700	0.000052900	0.000066700	0.000080200	0.000040600	0.000038000	0.000047900	0.000037100	0.000052700	0.000044800	0.000063400	0.000046600	0.000043600	0.000045500	0.000032000	0.000040300
C14H15NO	213.115376	1.071	0.071	0.07	0.0000	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H10O2S2	214.012280	1.111	0.222	0.00	0.2222	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H6O4	214.026605	0.500	0.333	0.00	0.0000	0.0000	0.80	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000046500	0.000035400	0.000022100	0.000000000	0.000028900	0.000021800	0.000032200	0.000035400	0.000047000	0.000033700	0.000039900	0.000044400	0.000038100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000040000	0.000036400	0.000000000	0.000000000	0.000042700	0.000046600	0.000018100	0.000018300	0.000032500	0.000031900	0.000059000	0.000059000	0.000049000	0.000056700	0.000109300	0.000116900
C9H10O4S	214.029978	1.111	0.444	0.00	0.1111	0.0000	0.33	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000050300	0.000000000	0.000037600	0.000051900	0.000025200	0.000027600	0.000034900	0.000019900	0.000023600	0.000027800	0.000000000	0.000000000	0.000024500	0.000031300	0.000027000	0.000033900	0.000043900	0.000026400	0.000024400	0.000031400	0.000029400	0.000034000	0.000033000	0.000038800	0.000039900	0.000028900	0.000031900	0.000050600	0.000042600	0.000032300	0.000025300	0.000045200	0.000035500	0.000000000	0.000023400
C13H10OS	214.045290	0.769	0.077	0.00	0.0769	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H10O6	214.047760	1.111	0.667	0.00	0.0000	0.0000	0.33	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000073400	0.000057500	0.000041800	0.000047300	0.000047000	0.000043000	0.000054600	0.000061700	0.000070300	0.000069300	0.000066200	0.000056100	0.000064200	0.000045800	0.000024300	0.000039600	0.000036400	0.000052900	0.000050100	0.000053900	0.000043100	0.000026800	0.000028400	0.000064000	0.000067300	0.000045100	0.000043300	0.000045200	0.000050300	0.000146300	0.000127300	0.000068700	0.000074700	0.000143500	0.000142400
C13H10O3	214.062985	0.769	0.231	0.00	0.0000	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000181400	0.000145400	0.000122000	0.000149900	0.000140800	0.000146400	0.000148900	0.000172100	0.000172100	0.000160100	0.000155300	0.000169300	0.000159100	0.000111900	0.000118700	0.000120500	0.000112100	0.000135300	0.000131600	0.000146100	0.000152700	0.000122300	0.000103400	0.000177300	0.000188300	0.000132700	0.000135400	0.000161700	0.000158700	0.000204600	0.000191100	0.000220300	0.000214700	0.000251200	0.000258600
C10H14O3S	214.066394	1.400	0.300	0.00	0.1000	0.0000	0.20	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000036600	0.000024000	0.000055200	0.000050000	0.000043800	0.000036300	0.000040900	0.000027100	0.000027900	0.000025500	0.000000000	0.000027600	0.000020300	0.000046300	0.000046700	0.000067100	0.000060000	0.000049500	0.000044500	0.000046500	0.000056400	0.000083700	0.000065200	0.000033200	0.000033500	0.000052700	0.000054500	0.000053800	0.000056800	0.000021200	0.000021800	0.000049700	0.000040400	0.000000000	0.000000000
C12H10N2O2	214.074218	0.833	0.167	0.17	0.0000	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000036200	0.000019200	0.000021500	0.000028000	0.000027100	0.000000000	0.000021800	0.000027900	0.000000000	0.000000000	0.000020400	0.000022200	0.000025100	0.000019800	0.000022200	0.000027200	0.000023800	0.000019000	0.000022400	0.000021500	0.000024800	0.000036500	0.000022300	0.000032800	0.000027800	0.000026600	0.000020500	0.000028100	0.000038100	0.000025900	0.000025200	0.000034900	0.000034200	0.000026400	0.000023600
C10H14O5	214.084115	1.400	0.500	0.00	0.0000	0.0000	0.20	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000252100	0.000294900	0.000283600	0.000288100	0.000310800	0.000319000	0.000296100	0.000305000	0.000318800	0.000296300	0.000241900	0.000298200	0.000256500	0.000323600	0.000331800	0.000410800	0.000346700	0.000429400	0.000480600	0.000290100	0.000293600	0.000293700	0.000308800	0.000334800	0.000343100	0.000355900	0.000323300	0.000341300	0.000329800	0.000660700	0.000607200	0.000339300	0.000322700	0.000406500	0.000456000
C14H14O2	214.099393	1.000	0.143	0.00	0.0000	0.0000	0.54	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000109900	0.000117300	0.000107000	0.000114300	0.000121100	0.000128900	0.000121200	0.000142400	0.000138800	0.000132400	0.000120200	0.000134800	0.000114400	0.000136400	0.000145200	0.000130800	0.000121200	0.000134000	0.000138500	0.000110900	0.000112000	0.000123400	0.000117400	0.000123300	0.000133800	0.000115000	0.000108400	0.000124600	0.000130900	0.000126900	0.000113500	0.000145200	0.000130100	0.000126400	0.000131200
C11H18O2S	214.102795	1.636	0.182	0.00	0.0909	0.0000	0.11	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000022100	0.000020500	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000021000	0.000000000	0.000000000	0.000000000	0.000023200	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H18O4	214.120505	1.636	0.364	0.00	0.0000	0.0000	0.11	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000115600	0.000130500	0.000177200	0.000147800	0.000191900	0.000190500	0.000179000	0.000153000	0.000148300	0.000138400	0.000104200	0.000143600	0.000109400	0.000188700	0.000208400	0.000230200	0.000202300	0.000222000	0.000268100	0.000179400	0.000172700	0.000226400	0.000213900	0.000147200	0.000150200	0.000189900	0.000174600	0.000159600	0.000161400	0.000243100	0.000208400	0.000160100	0.000143100	0.000158100	0.000161400
C15H18O	214.135808	1.200	0.067	0.00	0.0000	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024000	0.000028300	0.000024200	0.000038300	0.000031900	0.000035500	0.000038100	0.000039500	0.000039700	0.000041600	0.000036600	0.000042000	0.000039500	0.000037200	0.000037000	0.000040100	0.000037700	0.000033500	0.000045800	0.000022500	0.000031000	0.000036300	0.000019100	0.000036100	0.000028200	0.000033100	0.000029400	0.000033600	0.000029400	0.000032800	0.000032600	0.000042200	0.000021800	0.000031500	0.000029800
C12H22O3	214.156911	1.833	0.250	0.00	0.0000	0.0000	0.05	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000025900	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H9NO4S	215.025232	1.125	0.500	0.13	0.1250	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020400	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000020000
C12H9NO3	215.058249	0.750	0.250	0.08	0.0000	0.0000	0.68	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000056100	0.000028800	0.000033000	0.000053200	0.000049500	0.000043500	0.000043400	0.000043100	0.000044100	0.000037600	0.000031700	0.000032500	0.000035700	0.000037600	0.000043500	0.000033600	0.000052100	0.000028200	0.000047600	0.000045000	0.000046500	0.000033200	0.000039700	0.000053000	0.000050200	0.000041900	0.000042200	0.000059500	0.000055900	0.000051200	0.000052000	0.000067400	0.000067200	0.000063500	0.000055100
C9H13NO3S	215.061604	1.444	0.333	0.11	0.1111	0.0000	0.09	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029100	0.000000000	0.000035800	0.000025800	0.000018600	0.000029000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000024500	0.000036200	0.000000000	0.000000000	0.000031900	0.000037400	0.000048000	0.000050600	0.000000000	0.000021000	0.000026500	0.000023800	0.000029400	0.000028200	0.000000000	0.000000000	0.000030100	0.000028700	0.000000000	0.000000000
C9H13NO5	215.079408	1.444	0.556	0.11	0.0000	0.0000	0.09	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000023500	0.000000000	0.000019000	0.000027400	0.000023200	0.000027400	0.000018800	0.000018200	0.000022300	0.000000000	0.000018500	0.000023300	0.000022900	0.000000000	0.000033200	0.000026200	0.000028600	0.000028500	0.000024200	0.000021300	0.000032500	0.000026700	0.000029600	0.000022400	0.000032400	0.000020900	0.000036100	0.000031800	0.000062100	0.000046100	0.000024800	0.000035100	0.000033400	0.000024800
C13H13NO2	215.094618	1.000	0.154	0.08	0.0000	0.0000	0.55	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000054600	0.000035800	0.000061600	0.000067000	0.000062000	0.000048700	0.000054700	0.000045100	0.000045600	0.000037400	0.000037400	0.000043200	0.000034000	0.000058600	0.000066100	0.000074600	0.000066300	0.000054400	0.000055700	0.000054500	0.000061500	0.000076700	0.000076600	0.000050900	0.000063700	0.000046600	0.000054200	0.000082800	0.000074900	0.000054400	0.000053200	0.000078600	0.000077000	0.000037700	0.000037000
C10H17NO4	215.115776	1.700	0.400	0.10	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000027300	0.000020200	0.000018100	0.000019000	0.000000000	0.000026700	0.000021000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H8O5S	216.009270	1.000	0.625	0.00	0.1250	0.0000	0.33	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H8O2S	216.024491	0.667	0.167	0.00	0.0833	0.0000	0.70	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000033100	0.000000000	0.000021900	0.000030300	0.000000000	0.000020700	0.000000000	0.000018300	0.000019100	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000026300	0.000023100	0.000000000	0.000023600	0.000000000	0.000029000	0.000024000	0.000020100	0.000018000	0.000036900	0.000000000	0.000000000	0.000043200	0.000036100	0.000000000	0.000000000	0.000040400	0.000036300	0.000000000	0.000000000
C8H8O7	216.026992	1.000	0.875	0.00	0.0000	0.0000	0.33	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000020300	0.000000000	0.000000000	0.000038500	0.000029100
C9H12O2S2	216.027882	1.333	0.222	0.00	0.2222	0.0000	0.17	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029700	0.000027400	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H8O4	216.042294	0.667	0.333	0.00	0.0000	0.0000	0.70	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000133400	0.000109300	0.000082200	0.000088400	0.000079000	0.000086400	0.000091800	0.000109900	0.000144500	0.000118100	0.000111800	0.000117700	0.000109400	0.000057700	0.000054100	0.000061900	0.000065300	0.000083200	0.000069300	0.000110400	0.000109300	0.000061900	0.000045300	0.000125000	0.000132700	0.000089400	0.000077500	0.000088200	0.000085900	0.000147700	0.000157700	0.000140400	0.000132100	0.000232500	0.000235500
C9H12O4S	216.045659	1.333	0.444	0.00	0.1111	0.0000	0.17	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035200	0.000018800	0.000043000	0.000055700	0.000034700	0.000028000	0.000028200	0.000022400	0.000033400	0.000000000	0.000000000	0.000029800	0.000020400	0.000030400	0.000031800	0.000049300	0.000057300	0.000035400	0.000035700	0.000044200	0.000044500	0.000053900	0.000052700	0.000033100	0.000037300	0.000038500	0.000043600	0.000049400	0.000051500	0.000000000	0.000000000	0.000057800	0.000040600	0.000000000	0.000000000
C11H8N2O3	216.053540	0.727	0.273	0.18	0.0000	0.0000	0.73	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000021600	0.000019600	0.000000000	0.000021300	0.000022100
C13H12OS	216.060873	0.923	0.077	0.00	0.0769	0.0000	0.57	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000023000	0.000000000	0.000000000	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000025000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025400	0.000022000	0.000019900	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000020800	0.000034300	0.000034400	0.000000000	0.000000000	0.000020900	0.000031400	0.000000000	0.000000000
C9H12O6	216.063400	1.333	0.667	0.00	0.0000	0.0000	0.17	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000076700	0.000067500	0.000055400	0.000064600	0.000065200	0.000072000	0.000061600	0.000074500	0.000079900	0.000079300	0.000065100	0.000073000	0.000080300	0.000059800	0.000052400	0.000066300	0.000056800	0.000101300	0.000093200	0.000070400	0.000065700	0.000046600	0.000056200	0.000078800	0.000086000	0.000087500	0.000076200	0.000072000	0.000070000	0.000243500	0.000202800	0.000083800	0.000067600	0.000158700	0.000157000
C13H12O3	216.078685	0.923	0.231	0.00	0.0000	0.0000	0.57	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000228000	0.000221700	0.000195400	0.000229000	0.000215500	0.000221600	0.000226600	0.000251300	0.000253500	0.000233300	0.000234400	0.000244400	0.000212000	0.000203300	0.000205500	0.000206900	0.000199000	0.000237600	0.000219700	0.000209000	0.000217000	0.000219500	0.000196800	0.000238500	0.000262200	0.000221100	0.000221300	0.000232300	0.000230200	0.000241600	0.000241900	0.000281400	0.000270000	0.000276000	0.000275200
C10H16O3S	216.082020	1.600	0.300	0.00	0.1000	0.0000	0.07	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000022500	0.000000000	0.000042500	0.000032600	0.000028600	0.000030100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000031200	0.000036600	0.000046500	0.000027800	0.000024600	0.000033600	0.000039100	0.000057500	0.000043700	0.000020200	0.000019400	0.000028900	0.000029500	0.000041800	0.000034000	0.000000000	0.000000000	0.000038700	0.000030600	0.000000000	0.000000000
C12H12N2O2	216.089920	1.000	0.167	0.17	0.0000	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023100	0.000021400	0.000024800	0.000033800	0.000022600	0.000021300	0.000022500	0.000025200	0.000023700	0.000022300	0.000024100	0.000023000	0.000000000	0.000025100	0.000029600	0.000031600	0.000035900	0.000030500	0.000019900	0.000023000	0.000023000	0.000040100	0.000028400	0.000025900	0.000024000	0.000028000	0.000027800	0.000029600	0.000035000	0.000036900	0.000026200	0.000032700	0.000034900	0.000024300	0.000026100
C10H16O5	216.099804	1.600	0.500	0.00	0.0000	0.0000	0.07	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000077300	0.000097400	0.000127100	0.000114700	0.000140700	0.000139800	0.000126000	0.000106200	0.000109100	0.000098900	0.000090900	0.000111600	0.000090000	0.000131100	0.000137600	0.000161200	0.000151000	0.000183000	0.000224600	0.000118800	0.000117500	0.000146400	0.000137500	0.000124300	0.000121300	0.000143700	0.000128500	0.000117800	0.000124700	0.000215600	0.000199100	0.000120700	0.000085700	0.000130700	0.000138300
C14H16O2	216.115068	1.143	0.143	0.00	0.0000	0.0000	0.46	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000124500	0.000168800	0.000130300	0.000147600	0.000163500	0.000161800	0.000153600	0.000194800	0.000178700	0.000196500	0.000171900	0.000196000	0.000156200	0.000178600	0.000207500	0.000168900	0.000156300	0.000168000	0.000194700	0.000148800	0.000152900	0.000158000	0.000148900	0.000156900	0.000153100	0.000152900	0.000158700	0.000146900	0.000151300	0.000141500	0.000149200	0.000174500	0.000144400	0.000146500	0.000156000
C11H20O4	216.136200	1.818	0.364	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025700	0.000034500	0.000000000	0.000032200	0.000029900	0.000025300	0.000021800	0.000019700	0.000000000	0.000000000	0.000000000	0.000028600	0.000041200	0.000025800	0.000038600	0.000029400	0.000046100	0.000000000	0.000027200	0.000033900	0.000025900	0.000000000	0.000000000	0.000022800	0.000023500	0.000000000	0.000018700	0.000021700	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000
C15H20O	216.151434	1.333	0.067	0.00	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027000	0.000037200	0.000027900	0.000027700	0.000040700	0.000037300	0.000040400	0.000047100	0.000045700	0.000051800	0.000038600	0.000044900	0.000036100	0.000044500	0.000056900	0.000048000	0.000044900	0.000043400	0.000066100	0.000036700	0.000041700	0.000041800	0.000028200	0.000041300	0.000040700	0.000042400	0.000041700	0.000036000	0.000035400	0.000041500	0.000033400	0.000041700	0.000040200	0.000032200	0.000038800
C11H7NO4	217.037512	0.636	0.364	0.09	0.0000	0.0000	0.75	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000034600	0.000028800	0.000000000	0.000019500	0.000000000	0.000000000	0.000025500	0.000025100	0.000021200	0.000018200	0.000022100	0.000025000	0.000025300	0.000000000	0.000021100	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000025600	0.000031600	0.000000000	0.000026000	0.000025400	0.000021200	0.000042400	0.000038100	0.000043900	0.000036300	0.000044600	0.000039800
C8H11NO4S	217.040874	1.375	0.500	0.13	0.1250	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000027200	0.000000000	0.000000000	0.000020800	0.000024500	0.000032100	0.000028200	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000022200	0.000000000	0.000000000	0.000020200	0.000019500	0.000000000	0.000000000
C12H11NO3	217.073886	0.917	0.250	0.08	0.0000	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000113100	0.000060000	0.000101900	0.000117900	0.000089100	0.000082600	0.000094100	0.000071900	0.000077400	0.000059900	0.000057900	0.000070000	0.000063000	0.000085500	0.000084100	0.000111200	0.000099000	0.000084400	0.000084400	0.000087700	0.000096700	0.000116300	0.000102400	0.000096200	0.000094500	0.000087400	0.000097700	0.000114900	0.000122900	0.000082200	0.000088600	0.000134500	0.000127200	0.000082400	0.000090500
C13H15NO2	217.110271	1.154	0.154	0.08	0.0000	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000049600	0.000040200	0.000059500	0.000066200	0.000055800	0.000058600	0.000049800	0.000045500	0.000052300	0.000041000	0.000031700	0.000043900	0.000033600	0.000067300	0.000067900	0.000073500	0.000072500	0.000058500	0.000064800	0.000063300	0.000058600	0.000076500	0.000076800	0.000057600	0.000050300	0.000061600	0.000053800	0.000083600	0.000075000	0.000057000	0.000050300	0.000075500	0.000068000	0.000042200	0.000055100
C14H19NO	217.146662	1.357	0.071	0.07	0.0000	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000024000	0.000000000	0.000000000	0.000019900	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O3S	218.003794	0.545	0.273	0.00	0.0909	0.0000	0.76	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024200	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000019500	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H10O3S2	218.007129	1.250	0.375	0.00	0.2500	0.0000	0.11	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O5	218.021518	0.545	0.455	0.00	0.0000	0.0000	0.76	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000083700	0.000061800	0.000040800	0.000035500	0.000047200	0.000049300	0.000059500	0.000060300	0.000079600	0.000061400	0.000066700	0.000056300	0.000065600	0.000028000	0.000018300	0.000026900	0.000027900	0.000034900	0.000020300	0.000071800	0.000073600	0.000024200	0.000019200	0.000070200	0.000070400	0.000037600	0.000040100	0.000048200	0.000044600	0.000091700	0.000085500	0.000082900	0.000094300	0.000207200	0.000192100
C8H10O5S	218.024943	1.250	0.625	0.00	0.1250	0.0000	0.11	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018400	0.000000000	0.000000000	0.000018100	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027300	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000
C12H10O2S	218.040179	0.833	0.167	0.00	0.0833	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000045900	0.000000000	0.000033800	0.000038200	0.000032300	0.000032900	0.000037700	0.000034500	0.000028900	0.000000000	0.000020700	0.000022000	0.000021700	0.000034700	0.000039300	0.000047100	0.000041600	0.000032300	0.000036300	0.000030000	0.000028500	0.000044000	0.000042400	0.000040900	0.000037000	0.000032800	0.000035300	0.000054600	0.000056900	0.000020200	0.000024700	0.000062600	0.000047600	0.000019700	0.000000000
C8H10O7	218.042641	1.250	0.875	0.00	0.0000	0.0000	0.11	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000032400	0.000026900	0.000023500	0.000000000	0.000032300	0.000040100
C9H14O2S2	218.043514	1.556	0.222	0.00	0.2222	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000018300	0.000000000	0.000000000	0.000000000	0.000024900	0.000032300	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H10O4	218.057908	0.833	0.333	0.00	0.0000	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000305200	0.000263800	0.000219400	0.000223100	0.000235400	0.000245300	0.000238200	0.000290000	0.000297200	0.000279800	0.000278900	0.000285400	0.000293200	0.000177700	0.000183000	0.000198600	0.000197900	0.000245500	0.000232700	0.000260600	0.000265500	0.000201700	0.000179500	0.000296500	0.000309700	0.000249000	0.000246000	0.000254000	0.000267000	0.000338800	0.000333000	0.000337600	0.000338300	0.000441900	0.000453500
C9H14O4S	218.061326	1.556	0.444	0.00	0.1111	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000026600	0.000000000	0.000038600	0.000030300	0.000041400	0.000039300	0.000026200	0.000018800	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000024500	0.000028700	0.000043100	0.000051800	0.000028600	0.000034000	0.000039300	0.000036900	0.000048200	0.000051600	0.000024600	0.000028100	0.000042600	0.000032600	0.000036700	0.000032800	0.000020400	0.000000000	0.000032000	0.000019300	0.000000000	0.000000000
C11H10N2O3	218.069134	0.909	0.273	0.18	0.0000	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000044700	0.000029700	0.000029400	0.000043000	0.000032400	0.000032600	0.000029000	0.000029800	0.000039800	0.000025500	0.000030000	0.000025800	0.000031800	0.000029600	0.000035100	0.000029700	0.000042700	0.000039600	0.000040000	0.000035000	0.000035700	0.000049900	0.000042600	0.000030200	0.000040000	0.000032200	0.000035100	0.000033400	0.000044600	0.000042400	0.000050800	0.000051200	0.000050500	0.000038900	0.000046600
C13H14OS	218.076558	1.077	0.077	0.00	0.0769	0.0000	0.48	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000022400	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000024500	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000026600	0.000031400	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000
C9H14O6	218.079033	1.556	0.667	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000033200	0.000036700	0.000040900	0.000033500	0.000032900	0.000032200	0.000035600	0.000031700	0.000042800	0.000032900	0.000028100	0.000039600	0.000038600	0.000030300	0.000041900	0.000045500	0.000048100	0.000050400	0.000061400	0.000044800	0.000041900	0.000042000	0.000033300	0.000043300	0.000039400	0.000054600	0.000053200	0.000049300	0.000040700	0.000106600	0.000093000	0.000049800	0.000051400	0.000070400	0.000064900
C13H14O3	218.094297	1.077	0.231	0.00	0.0000	0.0000	0.48	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000367500	0.000414000	0.000385900	0.000384600	0.000425600	0.000417800	0.000421000	0.000459200	0.000437500	0.000456400	0.000424800	0.000439900	0.000407300	0.000406700	0.000433300	0.000416600	0.000417200	0.000444700	0.000468400	0.000394100	0.000410900	0.000424900	0.000395000	0.000412800	0.000421900	0.000417300	0.000406300	0.000398000	0.000411500	0.000392600	0.000393400	0.000444200	0.000412500	0.000412000	0.000438200
C10H18O3S	218.097723	1.800	0.300	0.00	0.1000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000028000	0.000000000	0.000024800	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000035300	0.000031100	0.000000000	0.000018800	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000025600	0.000027300	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000
C12H14N2O2	218.105525	1.167	0.167	0.17	0.0000	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000032800	0.000026300	0.000030600	0.000039200	0.000028800	0.000034500	0.000034400	0.000031600	0.000019300	0.000000000	0.000025100	0.000023000	0.000024800	0.000029900	0.000031900	0.000043700	0.000045100	0.000028900	0.000038800	0.000032700	0.000029700	0.000046500	0.000047900	0.000030200	0.000033600	0.000033600	0.000042500	0.000047700	0.000045100	0.000041200	0.000038600	0.000046900	0.000044500	0.000027400	0.000032500
C10H18O5	218.115414	1.800	0.500	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000031000	0.000021100	0.000031300	0.000037000	0.000000000	0.000027900	0.000018600	0.000000000	0.000025400	0.000000000	0.000022200	0.000018800	0.000034100	0.000033000	0.000037400	0.000033700	0.000031100	0.000049200	0.000035900	0.000028600	0.000029100	0.000036800	0.000024600	0.000025300	0.000037700	0.000029500	0.000021500	0.000026200	0.000042200	0.000036700	0.000023700	0.000018500	0.000025600	0.000044500
C14H18O2	218.130685	1.286	0.143	0.00	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000192800	0.000258100	0.000198600	0.000212200	0.000252900	0.000257000	0.000238200	0.000317900	0.000272000	0.000295000	0.000269000	0.000284200	0.000234100	0.000269300	0.000324100	0.000269600	0.000252100	0.000263500	0.000320800	0.000218900	0.000215700	0.000224800	0.000222800	0.000225300	0.000238200	0.000233000	0.000219000	0.000237600	0.000214700	0.000220800	0.000211700	0.000246100	0.000214600	0.000208600	0.000238200
C15H22O	218.167066	1.467	0.067	0.00	0.0000	0.0000	0.31	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000036000	0.000022300	0.000030400	0.000025400	0.000035200	0.000022500	0.000038500	0.000038800	0.000032600	0.000030300	0.000032300	0.000028400	0.000035500	0.000048500	0.000032500	0.000031900	0.000033500	0.000034200	0.000029600	0.000025600	0.000034800	0.000027100	0.000025100	0.000035000	0.000019800	0.000025300	0.000029300	0.000029700	0.000029600	0.000021400	0.000028200	0.000029200	0.000022800	0.000031300
C11H9NO2S	219.035416	0.818	0.182	0.09	0.0909	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000024600	0.000000000	0.000000000	0.000036500	0.000021000	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000025700	0.000027300	0.000000000	0.000000000	0.000000000	0.000019900	0.000028400	0.000000000	0.000030900	0.000020600	0.000000000	0.000033100	0.000036500	0.000028000	0.000021900	0.000000000	0.000036000	0.000029600	0.000000000	0.000000000
C11H9NO4	219.053165	0.818	0.364	0.09	0.0000	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000069300	0.000048000	0.000041400	0.000051000	0.000039300	0.000044400	0.000047200	0.000038500	0.000040700	0.000054800	0.000048500	0.000057600	0.000065000	0.000045500	0.000034700	0.000050900	0.000033900	0.000039900	0.000040700	0.000047900	0.000050500	0.000047100	0.000042300	0.000060500	0.000059100	0.000048100	0.000037400	0.000062500	0.000058500	0.000061700	0.000070500	0.000077500	0.000063100	0.000077300	0.000074000
C12H13NO3	219.089548	1.083	0.250	0.08	0.0000	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000114800	0.000066300	0.000115200	0.000127100	0.000102600	0.000098700	0.000107300	0.000085700	0.000096000	0.000066500	0.000073000	0.000089600	0.000074300	0.000096800	0.000111100	0.000127100	0.000130300	0.000106200	0.000097800	0.000104100	0.000112900	0.000154900	0.000136700	0.000104900	0.000105900	0.000117100	0.000113600	0.000122000	0.000142200	0.000113000	0.000106400	0.000134300	0.000117700	0.000083200	0.000087500
C13H17NO2	219.125933	1.308	0.154	0.08	0.0000	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000040600	0.000032900	0.000042000	0.000045900	0.000040800	0.000042000	0.000044500	0.000036000	0.000039900	0.000030800	0.000027100	0.000032100	0.000026400	0.000051900	0.000061800	0.000056600	0.000062000	0.000041900	0.000044500	0.000040700	0.000042000	0.000056400	0.000063000	0.000038300	0.000050000	0.000043600	0.000048100	0.000052200	0.000052700	0.000044400	0.000040500	0.000048100	0.000043100	0.000035300	0.000029000
C10H4O6	220.000815	0.400	0.600	0.00	0.0000	0.0000	0.86	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000034200	0.000028000
C11H8O3S	220.019412	0.727	0.273	0.00	0.0909	0.0000	0.65	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000058700	0.000025700	0.000040200	0.000048300	0.000034700	0.000036900	0.000038800	0.000024800	0.000028600	0.000020600	0.000026200	0.000026300	0.000025400	0.000024900	0.000024600	0.000042500	0.000040700	0.000026700	0.000000000	0.000031300	0.000030200	0.000032700	0.000037400	0.000043300	0.000038100	0.000033800	0.000023500	0.000054500	0.000055200	0.000000000	0.000020300	0.000055700	0.000057800	0.000027900	0.000026200
C8H12O3S2	220.022773	1.500	0.375	0.00	0.2500	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000031800	0.000025400	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H8O5	220.037192	0.727	0.455	0.00	0.0000	0.0000	0.65	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000164500	0.000122800	0.000108700	0.000097700	0.000107800	0.000112100	0.000116300	0.000147800	0.000156000	0.000135200	0.000137000	0.000135700	0.000148600	0.000075100	0.000066100	0.000074400	0.000069000	0.000103100	0.000089500	0.000131300	0.000138600	0.000075700	0.000060700	0.000150800	0.000162100	0.000103300	0.000094000	0.000123100	0.000117200	0.000212100	0.000191700	0.000192000	0.000177800	0.000358600	0.000334400
C8H12O5S	220.040597	1.500	0.625	0.00	0.1250	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026000	0.000027900	0.000000000	0.000019000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000
C10H8N2O4	220.048409	0.800	0.400	0.20	0.0000	0.0000	0.67	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025000	0.000021200	0.000000000	0.000020100	0.000000000	0.000022600	0.000000000	0.000000000	0.000020000	0.000022200	0.000020000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000020600	0.000019200	0.000020500	0.000019800	0.000032900	0.000037300	0.000021100	0.000026300	0.000027400	0.000034400
C12H12O2S	220.055807	1.000	0.167	0.00	0.0833	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000048400	0.000025300	0.000073800	0.000079300	0.000055900	0.000055700	0.000048500	0.000035900	0.000033900	0.000028400	0.000020800	0.000029300	0.000022300	0.000052400	0.000066700	0.000078800	0.000080900	0.000039900	0.000040500	0.000058400	0.000057200	0.000101400	0.000090000	0.000057900	0.000040500	0.000059000	0.000056900	0.000087300	0.000081200	0.000021600	0.000000000	0.000074400	0.000070700	0.000000000	0.000019900
C12H12O4	220.073568	1.000	0.333	0.00	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000408200	0.000397800	0.000359300	0.000365500	0.000381000	0.000380500	0.000369900	0.000418900	0.000429300	0.000401200	0.000391700	0.000435700	0.000402100	0.000337600	0.000326800	0.000366600	0.000348800	0.000427600	0.000411800	0.000372500	0.000382800	0.000341400	0.000324600	0.000437600	0.000457100	0.000412200	0.000418400	0.000384100	0.000393900	0.000489100	0.000489800	0.000463000	0.000409300	0.000535100	0.000540600
C9H16O4S	220.076993	1.778	0.444	0.00	0.1111	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000041200	0.000023900	0.000032100	0.000028600	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000022900	0.000018200	0.000027500	0.000029200	0.000026900	0.000028300	0.000034600	0.000047500	0.000042700	0.000020100	0.000000000	0.000021600	0.000027600	0.000025200	0.000023800	0.000000000	0.000019400	0.000000000	0.000019900	0.000000000	0.000000000
C11H12N2O3	220.084787	1.091	0.273	0.18	0.0000	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000058900	0.000043700	0.000043200	0.000050600	0.000042300	0.000048800	0.000050400	0.000035400	0.000038000	0.000033700	0.000037500	0.000044700	0.000043600	0.000044900	0.000038500	0.000048700	0.000045400	0.000041800	0.000043900	0.000036800	0.000048000	0.000047100	0.000049200	0.000053000	0.000054700	0.000051700	0.000044600	0.000057600	0.000048800	0.000064300	0.000061200	0.000072800	0.000058000	0.000055000	0.000055000
C13H16OS	220.092202	1.231	0.077	0.00	0.0769	0.0000	0.39	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000020200	0.000000000	0.000018100	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000019500	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H16O3	220.109945	1.231	0.231	0.00	0.0000	0.0000	0.39	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000440500	0.000591900	0.000494200	0.000513000	0.000551100	0.000548800	0.000525500	0.000667700	0.000618700	0.000625300	0.000601600	0.000648100	0.000551300	0.000577000	0.000635400	0.000575300	0.000550800	0.000609700	0.000671100	0.000509900	0.000519200	0.000538900	0.000517900	0.000543800	0.000543500	0.000568600	0.000556100	0.000500400	0.000500900	0.000525000	0.000536000	0.000537500	0.000475500	0.000528200	0.000538400
C12H16N2O2	220.121168	1.333	0.167	0.17	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028200	0.000000000	0.000025800	0.000042500	0.000027600	0.000027300	0.000030100	0.000019700	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000037400	0.000031500	0.000026700	0.000036900	0.000033400	0.000024900	0.000028000	0.000033400	0.000045200	0.000046100	0.000029600	0.000021900	0.000037900	0.000033000	0.000038000	0.000035400	0.000043600	0.000037500	0.000033500	0.000036900	0.000023700	0.000024100
C14H20O2	220.146321	1.429	0.143	0.00	0.0000	0.0000	0.31	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000159900	0.000229800	0.000176800	0.000204300	0.000211200	0.000219000	0.000199300	0.000267300	0.000236700	0.000245900	0.000235100	0.000258300	0.000204200	0.000233400	0.000297000	0.000240100	0.000230400	0.000225400	0.000307200	0.000200100	0.000186700	0.000199100	0.000197200	0.000217800	0.000201400	0.000210000	0.000204600	0.000215400	0.000214800	0.000204800	0.000194300	0.000218300	0.000191100	0.000185000	0.000195900
C15H24O	220.182708	1.600	0.067	0.00	0.0000	0.0000	0.24	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000019100	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000020300	0.000018100	0.000020300	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000025800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400
C10H7NO3S	221.014667	0.700	0.300	0.10	0.1000	0.0000	0.69	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000019300	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H7NO5	221.032415	0.700	0.500	0.10	0.0000	0.0000	0.69	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000033500	0.000019000	0.000020500	0.000020400	0.000000000	0.000000000	0.000000000	0.000020100	0.000021300	0.000019900	0.000000000	0.000019800	0.000019500	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000020900	0.000027100	0.000000000	0.000000000	0.000000000	0.000029700	0.000018200	0.000000000	0.000025100	0.000021400	0.000021800	0.000047200	0.000042700	0.000026200	0.000030900	0.000045800	0.000046400
C11H11NO2S	221.051093	1.000	0.182	0.09	0.0909	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022700	0.000020000	0.000032100	0.000036000	0.000027600	0.000019800	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000018700	0.000023700	0.000032100	0.000034500	0.000000000	0.000000000	0.000026200	0.000022000	0.000032400	0.000032900	0.000000000	0.000023300	0.000023700	0.000020000	0.000035600	0.000036500	0.000000000	0.000000000	0.000037500	0.000027300	0.000000000	0.000000000
C11H11NO4	221.068800	1.000	0.364	0.09	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000106500	0.000079600	0.000085600	0.000101600	0.000078100	0.000080200	0.000092300	0.000075800	0.000084200	0.000073800	0.000069400	0.000076000	0.000077200	0.000076400	0.000074800	0.000090800	0.000090400	0.000090300	0.000082500	0.000083900	0.000076600	0.000094900	0.000101700	0.000091100	0.000091200	0.000086300	0.000089000	0.000113700	0.000107800	0.000124600	0.000125600	0.000119900	0.000113700	0.000103400	0.000108900
C12H15NO3	221.105185	1.250	0.250	0.08	0.0000	0.0000	0.37	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000102900	0.000067300	0.000116000	0.000122600	0.000110600	0.000106900	0.000100200	0.000101300	0.000079300	0.000070500	0.000062700	0.000076200	0.000072400	0.000105100	0.000111300	0.000124000	0.000126300	0.000107000	0.000101600	0.000111200	0.000104300	0.000142100	0.000141500	0.000097200	0.000103700	0.000109700	0.000115500	0.000133200	0.000128800	0.000115900	0.000114400	0.000121200	0.000111900	0.000085200	0.000086400
C13H19NO2	221.141582	1.462	0.154	0.08	0.0000	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018400	0.000024000	0.000000000	0.000022700	0.000026200	0.000027200	0.000025200	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000033900	0.000039700	0.000021700	0.000022900	0.000026900	0.000019600	0.000023400	0.000033800	0.000030300	0.000020800	0.000018600	0.000019400	0.000024100	0.000025500	0.000034400	0.000023300	0.000019300	0.000032100	0.000023600	0.000000000	0.000000000
C10H6O4S	221.998707	0.600	0.400	0.00	0.1000	0.0000	0.71	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022400	0.000000000	0.000000000	0.000019300	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000021700	0.000024400	0.000000000	0.000020100	0.000024100	0.000022200	0.000000000	0.000000000
C10H6O6	222.016427	0.600	0.600	0.00	0.0000	0.0000	0.71	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000088200	0.000055200	0.000047700	0.000036800	0.000042500	0.000048700	0.000051700	0.000057200	0.000072400	0.000060400	0.000065000	0.000053500	0.000061100	0.000021800	0.000022800	0.000022200	0.000027600	0.000028200	0.000029300	0.000073400	0.000064900	0.000025800	0.000018700	0.000070700	0.000070300	0.000039500	0.000030000	0.000061900	0.000059900	0.000084800	0.000077600	0.000089200	0.000093700	0.000227600	0.000205600
C11H10OS2	222.017294	0.909	0.091	0.00	0.1818	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020500	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000023400	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000
C11H10O3S	222.035112	0.909	0.273	0.00	0.0909	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000079100	0.000030400	0.000061600	0.000089800	0.000051000	0.000054600	0.000049800	0.000037800	0.000041100	0.000030100	0.000034400	0.000020700	0.000030800	0.000047200	0.000037200	0.000077600	0.000076500	0.000056300	0.000050600	0.000047000	0.000059600	0.000081900	0.000070200	0.000052800	0.000057700	0.000066400	0.000056800	0.000076300	0.000078600	0.000022200	0.000023900	0.000083300	0.000073600	0.000000000	0.000000000
C11H10O5	222.052817	0.909	0.455	0.00	0.0000	0.0000	0.53	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000248500	0.000220000	0.000176100	0.000174300	0.000186400	0.000194600	0.000181900	0.000224200	0.000245300	0.000226900	0.000212900	0.000220300	0.000227200	0.000132200	0.000134000	0.000154700	0.000146300	0.000210200	0.000192600	0.000223600	0.000205700	0.000143500	0.000126300	0.000226000	0.000246900	0.000199500	0.000195400	0.000203600	0.000197500	0.000327800	0.000316800	0.000269900	0.000265500	0.000462100	0.000466600
C8H14O5S	222.056211	1.750	0.625	0.00	0.1250	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000018700	0.000000000	0.000000000	0.000021800	0.000018900	0.000000000	0.000000000	0.000022900	0.000023000	0.000018400	0.000021600	0.000000000	0.000000000	0.000024100	0.000023200	0.000000000	0.000023400	0.000025700	0.000000000	0.000000000	0.000020300	0.000023500	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000
C10H10N2O4	222.064067	1.000	0.400	0.20	0.0000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028100	0.000000000	0.000023300	0.000026600	0.000024900	0.000025600	0.000020000	0.000000000	0.000000000	0.000024500	0.000000000	0.000018100	0.000026000	0.000027300	0.000030000	0.000018900	0.000033400	0.000022100	0.000023600	0.000000000	0.000022100	0.000028500	0.000022800	0.000028700	0.000022600	0.000031300	0.000027800	0.000031900	0.000029900	0.000038600	0.000054900	0.000031400	0.000031200	0.000034100	0.000042000
C15H10O2	222.068074	0.667	0.133	0.00	0.0000	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000041700	0.000027500	0.000019200	0.000026000	0.000019100	0.000020500	0.000023100	0.000040800	0.000036300	0.000033200	0.000024100	0.000036200	0.000031900	0.000000000	0.000026400	0.000000000	0.000000000	0.000000000	0.000020400	0.000019500	0.000026500	0.000024300	0.000021800	0.000033500	0.000036400	0.000020300	0.000024900	0.000024300	0.000029800	0.000053100	0.000042900	0.000045600	0.000043900	0.000062300	0.000051100
C12H14O2S	222.071491	1.167	0.167	0.00	0.0833	0.0000	0.40	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036500	0.000027200	0.000046100	0.000066400	0.000040500	0.000050500	0.000047000	0.000030100	0.000000000	0.000000000	0.000000000	0.000018200	0.000020400	0.000041200	0.000037900	0.000064600	0.000059600	0.000030800	0.000031300	0.000045100	0.000054100	0.000069000	0.000063000	0.000026700	0.000031900	0.000045800	0.000035300	0.000043000	0.000054300	0.000000000	0.000000000	0.000064500	0.000044100	0.000000000	0.000000000
C12H14O4	222.089221	1.167	0.333	0.00	0.0000	0.0000	0.40	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000548600	0.000574300	0.000513900	0.000520600	0.000556000	0.000541200	0.000511900	0.000614900	0.000566400	0.000585700	0.000545700	0.000613200	0.000548100	0.000535400	0.000536000	0.000564300	0.000535000	0.000591300	0.000604400	0.000511700	0.000506500	0.000513000	0.000479500	0.000588700	0.000585500	0.000579900	0.000545400	0.000523400	0.000526300	0.000693200	0.000688200	0.000603200	0.000527400	0.000643800	0.000664900
C9H18O4S	222.092567	2.000	0.444	0.00	0.1111	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000019200	0.000018300	0.000020300	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H14N2O3	222.100474	1.273	0.273	0.18	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041500	0.000024100	0.000037200	0.000041900	0.000031500	0.000025600	0.000031700	0.000026700	0.000030700	0.000024800	0.000000000	0.000024200	0.000022700	0.000026400	0.000024800	0.000037700	0.000039200	0.000029600	0.000031100	0.000030100	0.000024800	0.000044600	0.000039500	0.000030500	0.000035900	0.000032700	0.000033900	0.000036800	0.000042900	0.000057100	0.000047100	0.000040600	0.000024900	0.000033900	0.000035000
C16H14O	222.104461	0.875	0.062	0.00	0.0000	0.0000	0.61	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000018800	0.000023100	0.000000000	0.000019800	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000020300	0.000022800	0.000000000	0.000022300	0.000027300	0.000022300	0.000027600	0.000022100	0.000027800
C13H18OS	222.107849	1.385	0.077	0.00	0.0769	0.0000	0.30	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000020600	0.000017900	0.000000000	0.000020600	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000
C13H18O3	222.125626	1.385	0.231	0.00	0.0000	0.0000	0.30	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000344400	0.000477200	0.000407000	0.000427100	0.000470200	0.000486800	0.000440400	0.000528300	0.000511400	0.000509400	0.000460500	0.000547300	0.000419200	0.000512800	0.000586000	0.000522000	0.000499300	0.000514300	0.000585400	0.000400900	0.000407700	0.000446800	0.000408600	0.000456500	0.000444800	0.000461900	0.000450600	0.000432800	0.000432900	0.000488000	0.000458100	0.000444800	0.000362600	0.000396400	0.000438200
C14H22O2	222.162024	1.571	0.143	0.00	0.0000	0.0000	0.23	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000049500	0.000065900	0.000052700	0.000070000	0.000079400	0.000076400	0.000076700	0.000080200	0.000075700	0.000074200	0.000066400	0.000077500	0.000062400	0.000087600	0.000107400	0.000091600	0.000084500	0.000091300	0.000106700	0.000064800	0.000069600	0.000079500	0.000073900	0.000063200	0.000079200	0.000067400	0.000078000	0.000072200	0.000070100	0.000078100	0.000068900	0.000064900	0.000054000	0.000054800	0.000055000
C10H9NO3S	223.030335	0.900	0.300	0.10	0.1000	0.0000	0.54	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035700	0.000020200	0.000029100	0.000032700	0.000000000	0.000021400	0.000023400	0.000000000	0.000000000	0.000018600	0.000000000	0.000020800	0.000000000	0.000020100	0.000000000	0.000028200	0.000023300	0.000000000	0.000020400	0.000022500	0.000000000	0.000023300	0.000024000	0.000000000	0.000025700	0.000025700	0.000023700	0.000032600	0.000035300	0.000000000	0.000000000	0.000036200	0.000024400	0.000000000	0.000000000
C10H9NO5	223.048106	0.900	0.500	0.10	0.0000	0.0000	0.54	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000038200	0.000031200	0.000027500	0.000023100	0.000020700	0.000030800	0.000025200	0.000022300	0.000026800	0.000000000	0.000019200	0.000019500	0.000033700	0.000022200	0.000000000	0.000022200	0.000027400	0.000021100	0.000027500	0.000031800	0.000022700	0.000019100	0.000022800	0.000033400	0.000036000	0.000023200	0.000027700	0.000033600	0.000036100	0.000055100	0.000049600	0.000040700	0.000036300	0.000050400	0.000048400
C14H9NO2	223.063344	0.643	0.143	0.07	0.0000	0.0000	0.75	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000024000	0.000000000	0.000020800	0.000000000	0.000019400	0.000025200
C11H13NO2S	223.066685	1.182	0.182	0.09	0.0909	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000033600	0.000000000	0.000031300	0.000042500	0.000020600	0.000029900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000033900	0.000037800	0.000024800	0.000020900	0.000024600	0.000026700	0.000046400	0.000042200	0.000000000	0.000020800	0.000028100	0.000029000	0.000034500	0.000035000	0.000000000	0.000000000	0.000031600	0.000030600	0.000000000	0.000000000
C11H13NO4	223.084500	1.182	0.364	0.09	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000098000	0.000065600	0.000089900	0.000080400	0.000074200	0.000079000	0.000067100	0.000064100	0.000069600	0.000061900	0.000069600	0.000071500	0.000065300	0.000083600	0.000074400	0.000090400	0.000085500	0.000079000	0.000074800	0.000071600	0.000076400	0.000092400	0.000096500	0.000088900	0.000086000	0.000087300	0.000080700	0.000094600	0.000088400	0.000113900	0.000108600	0.000093000	0.000080900	0.000087200	0.000085800
C12H17NO3	223.120863	1.417	0.250	0.08	0.0000	0.0000	0.26	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000050800	0.000041000	0.000067800	0.000061000	0.000068500	0.000063400	0.000053800	0.000043100	0.000041100	0.000032100	0.000029500	0.000036800	0.000030200	0.000067000	0.000074200	0.000080300	0.000074900	0.000061900	0.000060200	0.000069100	0.000067400	0.000086400	0.000083700	0.000054600	0.000049800	0.000059900	0.000069400	0.000057100	0.000051700	0.000066000	0.000056500	0.000065000	0.000054000	0.000050000	0.000038700
C10H8O4S	224.014322	0.800	0.400	0.00	0.1000	0.0000	0.57	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044400	0.000019200	0.000029700	0.000042500	0.000034000	0.000031800	0.000028700	0.000023700	0.000026300	0.000024800	0.000025100	0.000000000	0.000022100	0.000029800	0.000021300	0.000025600	0.000035100	0.000022900	0.000024200	0.000026600	0.000024700	0.000029700	0.000030600	0.000033900	0.000041300	0.000034900	0.000023300	0.000046800	0.000041700	0.000024200	0.000019700	0.000051700	0.000055900	0.000024100	0.000023400
C10H8O6	224.032134	0.800	0.600	0.00	0.0000	0.0000	0.57	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000066400	0.000061100	0.000045900	0.000032300	0.000040600	0.000046000	0.000049000	0.000057200	0.000069500	0.000058800	0.000064900	0.000070900	0.000057500	0.000032800	0.000019900	0.000028400	0.000000000	0.000043000	0.000046900	0.000068200	0.000071100	0.000025100	0.000021600	0.000064800	0.000075600	0.000038100	0.000049700	0.000043600	0.000049200	0.000103900	0.000097300	0.000081600	0.000065700	0.000191500	0.000173600
C11H12OS2	224.033009	1.091	0.091	0.00	0.1818	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000021200	0.000023800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000024800	0.000024800	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000
C9H8N2O5	224.043321	0.889	0.556	0.22	0.0000	0.0000	0.56	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024200	0.000019900	0.000000000	0.000000000	0.000000000	0.000018400
C14H8O3	224.047382	0.571	0.214	0.00	0.0000	0.0000	0.76	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000042700	0.000052100	0.000037200	0.000035800	0.000031400	0.000033500	0.000040400	0.000050200	0.000068000	0.000057900	0.000045100	0.000069500	0.000041200	0.000028200	0.000045700	0.000046000	0.000018100	0.000046400	0.000031800	0.000038300	0.000021700	0.000065600	0.000021100	0.000048600	0.000036900	0.000045200	0.000040600	0.000038800	0.000026100	0.000128100	0.000073500	0.000055300	0.000044300	0.000090200	0.000085700
C11H12O3S	224.050712	1.091	0.273	0.00	0.0909	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000105000	0.000039000	0.000126300	0.000131900	0.000097800	0.000089300	0.000079400	0.000058300	0.000063700	0.000039200	0.000040600	0.000049400	0.000041600	0.000070100	0.000077800	0.000132700	0.000134300	0.000079100	0.000085000	0.000102100	0.000093500	0.000151700	0.000132300	0.000082200	0.000074400	0.000092400	0.000083000	0.000126600	0.000136600	0.000032800	0.000027900	0.000111300	0.000108000	0.000019800	0.000022300
C11H12O5	224.068487	1.091	0.455	0.00	0.0000	0.0000	0.41	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000347500	0.000339500	0.000270800	0.000294500	0.000279500	0.000297000	0.000283500	0.000314300	0.000345000	0.000316400	0.000295800	0.000357200	0.000321200	0.000268500	0.000254600	0.000295000	0.000285200	0.000322500	0.000327300	0.000295500	0.000291400	0.000239500	0.000241500	0.000363300	0.000389900	0.000324100	0.000301100	0.000310400	0.000311000	0.000545200	0.000528100	0.000393300	0.000329600	0.000511200	0.000505700
C10H12N2O4	224.079703	1.200	0.400	0.20	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000041200	0.000027300	0.000036800	0.000038100	0.000030500	0.000028900	0.000022700	0.000023600	0.000030200	0.000000000	0.000000000	0.000000000	0.000025200	0.000028800	0.000032900	0.000035600	0.000037000	0.000024200	0.000032500	0.000034400	0.000032800	0.000041900	0.000031900	0.000024600	0.000026800	0.000031800	0.000035100	0.000038300	0.000034400	0.000052000	0.000065100	0.000043100	0.000040600	0.000035900	0.000030100
C15H12O2	224.083771	0.800	0.133	0.00	0.0000	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000054500	0.000045500	0.000038500	0.000049800	0.000037100	0.000048200	0.000052700	0.000063100	0.000052400	0.000053500	0.000044200	0.000054300	0.000038800	0.000044000	0.000039600	0.000042200	0.000043000	0.000038700	0.000040000	0.000052400	0.000044900	0.000040800	0.000036400	0.000062000	0.000065600	0.000035200	0.000048600	0.000054900	0.000048700	0.000062100	0.000044500	0.000074100	0.000057300	0.000067200	0.000071500
C12H16O2S	224.087139	1.333	0.167	0.00	0.0833	0.0000	0.30	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023400	0.000000000	0.000036800	0.000048100	0.000031900	0.000027900	0.000025500	0.000023200	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000030700	0.000031600	0.000050800	0.000042400	0.000026700	0.000027500	0.000022200	0.000037300	0.000047000	0.000043600	0.000000000	0.000024600	0.000028100	0.000031900	0.000037400	0.000041900	0.000000000	0.000000000	0.000038200	0.000028800	0.000000000	0.000000000
C14H12N2O	224.094993	0.857	0.071	0.14	0.0000	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H16O4	224.104847	1.333	0.333	0.00	0.0000	0.0000	0.30	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000700400	0.000768300	0.000764000	0.000726700	0.000862600	0.000817600	0.000768600	0.000860800	0.000781100	0.000797300	0.000675500	0.000820700	0.000723900	0.000854500	0.000885800	0.000922400	0.000831200	0.000901100	0.000966600	0.000749600	0.000722700	0.000818300	0.000762800	0.000757000	0.000786000	0.000816400	0.000756000	0.000766000	0.000774400	0.000987800	0.000924400	0.000822300	0.000763700	0.000800600	0.000805100
C11H16N2O3	224.116088	1.455	0.273	0.18	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023100	0.000022300	0.000024800	0.000027700	0.000000000	0.000028200	0.000000000	0.000021700	0.000023800	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000035700	0.000030800	0.000021300	0.000020600	0.000000000	0.000024300	0.000032400	0.000022800	0.000023600	0.000020400	0.000031800	0.000029800	0.000030000	0.000000000	0.000037500	0.000027600	0.000022800	0.000032600	0.000000000	0.000018400
C16H16O	224.120116	1.000	0.062	0.00	0.0000	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000023400	0.000021600	0.000025700	0.000022700	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000019400	0.000000000	0.000026700	0.000000000	0.000019900	0.000000000	0.000000000	0.000024000	0.000025400	0.000000000	0.000018700	0.000019500	0.000021800	0.000021300	0.000018500	0.000019300	0.000019300	0.000022400	0.000000000
C13H20O3	224.141251	1.538	0.231	0.00	0.0000	0.0000	0.22	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000186700	0.000251100	0.000263400	0.000245300	0.000308800	0.000316300	0.000278000	0.000318100	0.000289200	0.000275800	0.000243600	0.000284800	0.000222300	0.000325600	0.000398600	0.000344200	0.000320100	0.000335600	0.000413300	0.000263000	0.000257600	0.000313400	0.000309400	0.000252600	0.000261300	0.000272100	0.000269300	0.000272800	0.000269000	0.000304600	0.000266200	0.000275100	0.000239000	0.000225000	0.000233700
C14H24O2	224.177656	1.714	0.143	0.00	0.0000	0.0000	0.15	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000018400	0.000023400	0.000000000	0.000029400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H7NO6	225.027330	0.778	0.667	0.11	0.0000	0.0000	0.60	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025700	0.000024300	0.000000000	0.000000000	0.000024500	0.000025000
C13H7NO3	225.042635	0.538	0.231	0.08	0.0000	0.0000	0.81	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000
C10H11NO3S	225.046008	1.100	0.300	0.10	0.1000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035900	0.000000000	0.000029100	0.000036900	0.000000000	0.000027500	0.000020800	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028600	0.000027500	0.000038600	0.000032900	0.000022800	0.000024200	0.000027300	0.000028400	0.000054100	0.000042700	0.000018700	0.000021500	0.000023500	0.000026500	0.000044800	0.000036800	0.000000000	0.000000000	0.000042500	0.000026300	0.000000000	0.000000000
C10H11NO5	225.063721	1.100	0.500	0.10	0.0000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000075800	0.000054300	0.000048000	0.000057800	0.000043900	0.000039500	0.000053300	0.000041100	0.000048300	0.000045600	0.000037200	0.000044700	0.000058900	0.000046200	0.000046100	0.000046900	0.000053100	0.000050900	0.000058000	0.000043900	0.000051000	0.000053300	0.000054200	0.000060400	0.000065600	0.000054200	0.000062500	0.000065300	0.000057500	0.000109400	0.000118700	0.000076700	0.000068800	0.000075600	0.000090600
C14H11NO2	225.078968	0.786	0.143	0.07	0.0000	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037700	0.000035400	0.000021800	0.000036500	0.000034700	0.000037600	0.000032800	0.000029600	0.000034700	0.000024200	0.000029700	0.000026500	0.000022300	0.000041700	0.000025800	0.000037600	0.000036400	0.000022400	0.000023600	0.000032100	0.000029300	0.000050100	0.000031300	0.000043300	0.000039900	0.000041600	0.000028600	0.000050300	0.000053900	0.000039300	0.000031600	0.000051800	0.000048900	0.000032700	0.000028300
C11H15NO2S	225.082358	1.364	0.182	0.09	0.0909	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000025400	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000026600	0.000024300	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H15NO4	225.100148	1.364	0.364	0.09	0.0000	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000085000	0.000050300	0.000091800	0.000090700	0.000077800	0.000077400	0.000074200	0.000054800	0.000058000	0.000050100	0.000044700	0.000060000	0.000052500	0.000081500	0.000086100	0.000113500	0.000086100	0.000084900	0.000084200	0.000078300	0.000086700	0.000120600	0.000104000	0.000073700	0.000071400	0.000088300	0.000078600	0.000089600	0.000086100	0.000097200	0.000095400	0.000088700	0.000069800	0.000057900	0.000066900
C12H19NO3	225.136528	1.583	0.250	0.08	0.0000	0.0000	0.16	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000019300	0.000000000	0.000022200	0.000031500	0.000029000	0.000021500	0.000000000	0.000019700	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000000000	0.000027300	0.000025300	0.000020500	0.000027400	0.000022400	0.000023900	0.000028600	0.000032800	0.000019800	0.000020400	0.000029100	0.000021500	0.000021100	0.000021000	0.000000000	0.000024700	0.000020700	0.000000000	0.000000000	0.000000000
C9H6O7	226.011343	0.667	0.778	0.00	0.0000	0.0000	0.64	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000019500	0.000025400	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000025400	0.000026000	0.000027100	0.000000000	0.000035800	0.000026800	0.000000000	0.000028900	0.000000000	0.000018100	0.000000000	0.000000000	0.000030700	0.000018200	0.000000000	0.000000000	0.000000000	0.000026000	0.000000000	0.000000000	0.000000000	0.000000000	0.000060700	0.000024400	0.000024500	0.000018400	0.000071600	0.000064600
C10H10O2S2	226.012208	1.000	0.200	0.00	0.2000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028800	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000027900	0.000000000	0.000000000	0.000000000	0.000000000	0.000027700	0.000020300	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000
C13H6O4	226.026592	0.462	0.308	0.00	0.0000	0.0000	0.82	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000026600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027500	0.000000000	0.000021800	0.000050000	0.000037600
C10H10O4S	226.030011	1.000	0.400	0.00	0.1000	0.0000	0.43	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000054200	0.000032300	0.000046600	0.000059300	0.000051100	0.000048300	0.000044600	0.000032500	0.000036800	0.000029200	0.000032600	0.000031700	0.000033800	0.000043300	0.000036800	0.000053000	0.000063800	0.000038400	0.000035000	0.000042400	0.000041400	0.000050200	0.000045800	0.000049500	0.000058600	0.000043800	0.000049100	0.000063800	0.000066700	0.000036900	0.000032500	0.000060800	0.000055900	0.000025600	0.000022700
C10H10O6	226.047767	1.000	0.600	0.00	0.0000	0.0000	0.43	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000117200	0.000092200	0.000063500	0.000064200	0.000072000	0.000083300	0.000068800	0.000089500	0.000105200	0.000088600	0.000084600	0.000105600	0.000088300	0.000049100	0.000046000	0.000058300	0.000054100	0.000067000	0.000064400	0.000085600	0.000074400	0.000050600	0.000040900	0.000101800	0.000115700	0.000070900	0.000066600	0.000077500	0.000075600	0.000204400	0.000199500	0.000120100	0.000110600	0.000227500	0.000222000
C11H14OS2	226.048623	1.273	0.091	0.00	0.1818	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020700	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H10N2O5	226.059032	1.111	0.556	0.22	0.0000	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000024900	0.000000000	0.000000000	0.000000000	0.000018400
C14H10O3	226.063002	0.714	0.214	0.00	0.0000	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000129100	0.000104200	0.000079500	0.000100500	0.000095400	0.000088300	0.000094900	0.000124000	0.000137100	0.000115900	0.000111400	0.000119800	0.000121800	0.000070200	0.000084800	0.000089400	0.000073900	0.000095900	0.000088500	0.000108500	0.000097600	0.000088400	0.000071400	0.000121800	0.000134200	0.000084700	0.000093100	0.000106800	0.000100800	0.000154700	0.000137300	0.000148200	0.000152200	0.000194400	0.000198100
C11H14O3S	226.066353	1.273	0.273	0.00	0.0909	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000099900	0.000039000	0.000122800	0.000127900	0.000084500	0.000089800	0.000086300	0.000051500	0.000051000	0.000036500	0.000035200	0.000043000	0.000040400	0.000068600	0.000077000	0.000129800	0.000113300	0.000074900	0.000080000	0.000106200	0.000102800	0.000147600	0.000144200	0.000070500	0.000071400	0.000096500	0.000092500	0.000125300	0.000122400	0.000041200	0.000026200	0.000105100	0.000094300	0.000021800	0.000028800
C13H10N2O2	226.074274	0.769	0.154	0.15	0.0000	0.0000	0.70	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022500	0.000000000	0.000000000	0.000020200	0.000024900	0.000023300	0.000000000	0.000018300	0.000000000	0.000000000	0.000020500	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000025500	0.000000000	0.000021200	0.000020600	0.000021500	0.000022100	0.000023100	0.000019500	0.000025300	0.000021800	0.000021300
C11H14O5	226.084161	1.273	0.455	0.00	0.0000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000425600	0.000467700	0.000456400	0.000464200	0.000499800	0.000501300	0.000460100	0.000473400	0.000488500	0.000462500	0.000403600	0.000482700	0.000431200	0.000510900	0.000501500	0.000582400	0.000543500	0.000607300	0.000617000	0.000451600	0.000444600	0.000471400	0.000440400	0.000524500	0.000539300	0.000522800	0.000500000	0.000488300	0.000490000	0.000845000	0.000757400	0.000533900	0.000431500	0.000571400	0.000587200
C10H14N2O4	226.095365	1.400	0.400	0.20	0.0000	0.0000	0.17	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034000	0.000022300	0.000026600	0.000029400	0.000027200	0.000027600	0.000022400	0.000024400	0.000022300	0.000000000	0.000000000	0.000000000	0.000021700	0.000023800	0.000023500	0.000038100	0.000033700	0.000032500	0.000025800	0.000027400	0.000030600	0.000041300	0.000040300	0.000022300	0.000000000	0.000025900	0.000032400	0.000032300	0.000035400	0.000039700	0.000036000	0.000037500	0.000028500	0.000030000	0.000025100
C15H14O2	226.099431	0.933	0.133	0.00	0.0000	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000063200	0.000060400	0.000053100	0.000073000	0.000068800	0.000062800	0.000069400	0.000081400	0.000079300	0.000075800	0.000074600	0.000076500	0.000065400	0.000073300	0.000081800	0.000068100	0.000074400	0.000064800	0.000082400	0.000068700	0.000067600	0.000058600	0.000057900	0.000076500	0.000083400	0.000061300	0.000060400	0.000067400	0.000071500	0.000080600	0.000063200	0.000085900	0.000075900	0.000075500	0.000077800
C12H18O2S	226.102770	1.500	0.167	0.00	0.0833	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000027700	0.000026600	0.000033900	0.000022700	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000000000	0.000000000	0.000024300	0.000026600	0.000027300	0.000020200	0.000000000	0.000029700	0.000000000	0.000034600	0.000031400	0.000000000	0.000018800	0.000018700	0.000000000	0.000027100	0.000030100	0.000000000	0.000000000	0.000031700	0.000024600	0.000000000	0.000000000
C12H18O4	226.120503	1.500	0.333	0.00	0.0000	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000444700	0.000503900	0.000625800	0.000539000	0.000689300	0.000691300	0.000630400	0.000595700	0.000558400	0.000515800	0.000451000	0.000560600	0.000461800	0.000674000	0.000782800	0.000752200	0.000686600	0.000739300	0.000854400	0.000610100	0.000583400	0.000722700	0.000699500	0.000562400	0.000543900	0.000612600	0.000578200	0.000589500	0.000584500	0.000728000	0.000633800	0.000585200	0.000509700	0.000492000	0.000527500
C16H18O	226.135775	1.125	0.062	0.00	0.0000	0.0000	0.48	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000027300	0.000018700	0.000020200	0.000018300	0.000027800	0.000022100	0.000030700	0.000030000	0.000029500	0.000033300	0.000026400	0.000000000	0.000027000	0.000032700	0.000022300	0.000000000	0.000029200	0.000023900	0.000026900	0.000019300	0.000000000	0.000024800	0.000000000	0.000037100	0.000000000	0.000026200	0.000022100	0.000023200	0.000021900	0.000000000	0.000024900	0.000023800	0.000027100	0.000031700
C13H22O3	226.156899	1.692	0.231	0.00	0.0000	0.0000	0.13	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000034600	0.000045200	0.000060600	0.000053200	0.000072700	0.000073000	0.000066500	0.000062400	0.000049800	0.000045800	0.000041800	0.000046200	0.000035900	0.000085500	0.000097400	0.000082000	0.000068900	0.000080300	0.000106600	0.000067200	0.000071300	0.000082600	0.000074200	0.000044300	0.000050700	0.000058500	0.000061300	0.000054300	0.000066000	0.000066300	0.000042100	0.000050500	0.000049000	0.000048400	0.000046400
C9H9NO4S	227.025213	1.000	0.444	0.11	0.1111	0.0000	0.40	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026900	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000021200	0.000021600	0.000000000	0.000019900	0.000022600	0.000021400	0.000019100	0.000000000	0.000019400	0.000000000	0.000000000	0.000026600	0.000028800	0.000000000	0.000021500	0.000020500	0.000030500	0.000000000	0.000000000
C9H9NO6	227.043016	1.000	0.667	0.11	0.0000	0.0000	0.40	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029000	0.000028100	0.000000000	0.000026300	0.000030400	0.000026600
C13H9NO3	227.058295	0.692	0.231	0.08	0.0000	0.0000	0.71	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000041800	0.000023200	0.000022900	0.000033300	0.000028500	0.000042200	0.000030200	0.000025200	0.000040400	0.000031100	0.000028700	0.000026600	0.000026600	0.000033900	0.000028400	0.000027900	0.000032700	0.000033000	0.000025300	0.000028700	0.000034600	0.000035300	0.000028200	0.000039500	0.000041300	0.000031600	0.000039200	0.000038900	0.000041100	0.000032300	0.000033900	0.000050100	0.000049700	0.000040000	0.000037600
C10H13NO3S	227.061638	1.300	0.300	0.10	0.1000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000032600	0.000000000	0.000043800	0.000043500	0.000029100	0.000030000	0.000024900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028400	0.000025300	0.000035900	0.000037600	0.000000000	0.000018200	0.000039100	0.000031800	0.000052500	0.000049500	0.000026100	0.000020100	0.000026100	0.000029100	0.000037000	0.000042100	0.000000000	0.000000000	0.000048100	0.000035700	0.000000000	0.000000000
C10H13NO5	227.079364	1.300	0.500	0.10	0.0000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000086100	0.000052100	0.000072600	0.000089000	0.000074100	0.000075400	0.000079200	0.000065000	0.000062300	0.000049700	0.000049600	0.000056500	0.000056000	0.000069600	0.000073000	0.000088500	0.000086300	0.000086600	0.000099200	0.000081100	0.000076400	0.000098100	0.000106600	0.000072300	0.000080700	0.000094900	0.000082200	0.000095500	0.000095900	0.000134300	0.000127600	0.000097800	0.000091300	0.000084100	0.000085300
C14H13NO2	227.094623	0.929	0.143	0.07	0.0000	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000049400	0.000026000	0.000048500	0.000061200	0.000047800	0.000046700	0.000049800	0.000042500	0.000031400	0.000019900	0.000030400	0.000033900	0.000028900	0.000042200	0.000047700	0.000058200	0.000055400	0.000040300	0.000041600	0.000042900	0.000042900	0.000061400	0.000059400	0.000044400	0.000042400	0.000039400	0.000037800	0.000051900	0.000061500	0.000037200	0.000031100	0.000071200	0.000062100	0.000034700	0.000026500
C11H17NO4	227.115789	1.545	0.364	0.09	0.0000	0.0000	0.12	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000028300	0.000030600	0.000057300	0.000042000	0.000047900	0.000045900	0.000051800	0.000034600	0.000041200	0.000020800	0.000021100	0.000033000	0.000019600	0.000040700	0.000059900	0.000058300	0.000054800	0.000052300	0.000052300	0.000042600	0.000051500	0.000079800	0.000076700	0.000026800	0.000030800	0.000052000	0.000049100	0.000048300	0.000049300	0.000047100	0.000048900	0.000038500	0.000033600	0.000027500	0.000000000
C9H8O5S	228.009228	0.889	0.556	0.00	0.1111	0.0000	0.45	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033000	0.000000000	0.000000000	0.000022600	0.000022400	0.000023000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000018200	0.000024400	0.000023600	0.000023300	0.000018300	0.000026100	0.000019300	0.000019300	0.000018900	0.000033400	0.000019300	0.000000000	0.000000000	0.000030400	0.000031100	0.000033500	0.000025100	0.000028900	0.000027500	0.000019700	0.000020300
C13H8O2S	228.024497	0.615	0.154	0.00	0.0769	0.0000	0.73	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000
C9H8O7	228.027007	0.889	0.778	0.00	0.0000	0.0000	0.45	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000025600	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000019600	0.000026700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000030000	0.000023300	0.000021200	0.000019500	0.000052300	0.000047800
C10H12O2S2	228.027890	1.200	0.200	0.00	0.2000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023600	0.000000000	0.000032300	0.000027600	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000023000	0.000028500	0.000036400	0.000036500	0.000000000	0.000000000	0.000019300	0.000000000	0.000025500	0.000026600	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000
C13H8O4	228.042286	0.615	0.308	0.00	0.0000	0.0000	0.73	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000121500	0.000085300	0.000070900	0.000072900	0.000080000	0.000074100	0.000082000	0.000098100	0.000107700	0.000100100	0.000087200	0.000105000	0.000097100	0.000039800	0.000058300	0.000047800	0.000052000	0.000060000	0.000061200	0.000089100	0.000090700	0.000044100	0.000045400	0.000099500	0.000110300	0.000064400	0.000065500	0.000081800	0.000074200	0.000135700	0.000123000	0.000122600	0.000126100	0.000198000	0.000195100
C10H12O4S	228.045681	1.200	0.400	0.00	0.1000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000057600	0.000032700	0.000061500	0.000073100	0.000044200	0.000055600	0.000045500	0.000029900	0.000032500	0.000026500	0.000023900	0.000023500	0.000029800	0.000043500	0.000041200	0.000066000	0.000069600	0.000041100	0.000045700	0.000049000	0.000055300	0.000073300	0.000066400	0.000048400	0.000042900	0.000063300	0.000043800	0.000069500	0.000071200	0.000028400	0.000024500	0.000071100	0.000055900	0.000023200	0.000020800
C12H8N2O3	228.053489	0.667	0.250	0.17	0.0000	0.0000	0.76	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000025200	0.000018600	0.000000000	0.000021400	0.000000000	0.000022300	0.000026300	0.000023100	0.000026300	0.000029900	0.000024000	0.000023700
C14H12OS	228.060924	0.857	0.071	0.00	0.0714	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000
C10H12O6	228.063390	1.200	0.600	0.00	0.0000	0.0000	0.29	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000196400	0.000191900	0.000141700	0.000163800	0.000158000	0.000171500	0.000159900	0.000185000	0.000196400	0.000188400	0.000166300	0.000175000	0.000191700	0.000165500	0.000140800	0.000165900	0.000168200	0.000217600	0.000213400	0.000180300	0.000166600	0.000131900	0.000139500	0.000215300	0.000228600	0.000196500	0.000175200	0.000199600	0.000207300	0.000514600	0.000458200	0.000226400	0.000218000	0.000359900	0.000370200
C14H12O3	228.078634	0.857	0.214	0.00	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000220600	0.000194300	0.000180900	0.000201300	0.000183300	0.000191400	0.000182100	0.000216000	0.000217000	0.000208400	0.000199000	0.000204300	0.000195300	0.000181400	0.000191300	0.000188200	0.000165000	0.000180700	0.000181100	0.000196800	0.000208200	0.000183000	0.000173500	0.000204300	0.000239100	0.000181600	0.000166000	0.000228300	0.000217300	0.000214800	0.000205500	0.000266000	0.000262200	0.000252400	0.000274600
C11H16O3S	228.082018	1.455	0.273	0.00	0.0909	0.0000	0.18	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041700	0.000028400	0.000078300	0.000079700	0.000048000	0.000049700	0.000045800	0.000036000	0.000026200	0.000021300	0.000020400	0.000031800	0.000031800	0.000052000	0.000054000	0.000079400	0.000066000	0.000044700	0.000054800	0.000060200	0.000056900	0.000094600	0.000085200	0.000033300	0.000037000	0.000057400	0.000067400	0.000066200	0.000079700	0.000019400	0.000018300	0.000062500	0.000052100	0.000019900	0.000000000
C13H12N2O2	228.089894	0.923	0.154	0.15	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029800	0.000000000	0.000022200	0.000031400	0.000025300	0.000031100	0.000024200	0.000000000	0.000020400	0.000020500	0.000000000	0.000018800	0.000000000	0.000017900	0.000021400	0.000029400	0.000022400	0.000030500	0.000028100	0.000023800	0.000029700	0.000026300	0.000024100	0.000022200	0.000029900	0.000026300	0.000028100	0.000036800	0.000033600	0.000031700	0.000020700	0.000044500	0.000038400	0.000026800	0.000028100
C11H16O5	228.099818	1.455	0.455	0.00	0.0000	0.0000	0.18	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000337300	0.000418100	0.000503900	0.000459200	0.000524400	0.000531600	0.000507200	0.000438400	0.000457800	0.000406000	0.000326700	0.000448200	0.000357000	0.000569100	0.000574000	0.000652400	0.000604100	0.000654300	0.000749600	0.000454800	0.000464000	0.000544800	0.000528000	0.000455800	0.000467400	0.000535900	0.000510200	0.000460000	0.000471500	0.000759400	0.000676500	0.000457200	0.000366800	0.000420500	0.000478200
C10H16N2O4	228.111024	1.600	0.400	0.20	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000020300	0.000029400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000023800	0.000000000	0.000000000	0.000000000	0.000000000
C15H16O2	228.115072	1.067	0.133	0.00	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000084200	0.000095000	0.000083100	0.000118600	0.000111000	0.000107800	0.000100200	0.000135800	0.000124400	0.000111700	0.000109900	0.000123900	0.000103200	0.000124300	0.000129500	0.000102700	0.000100600	0.000101400	0.000119900	0.000104700	0.000103500	0.000108900	0.000093200	0.000098900	0.000102300	0.000095800	0.000098700	0.000094500	0.000100900	0.000091400	0.000082500	0.000108300	0.000085500	0.000092300	0.000105800
C12H20O2S	228.118409	1.667	0.167	0.00	0.0833	0.0000	0.10	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H20O4	228.136150	1.667	0.333	0.00	0.0000	0.0000	0.10	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000105700	0.000112800	0.000178700	0.000140400	0.000199000	0.000184200	0.000179900	0.000146300	0.000137300	0.000118400	0.000109300	0.000128400	0.000094100	0.000181000	0.000217600	0.000217400	0.000199700	0.000205500	0.000246200	0.000181200	0.000176900	0.000225900	0.000217800	0.000135700	0.000127500	0.000171500	0.000167700	0.000152800	0.000141000	0.000198200	0.000169600	0.000155300	0.000121700	0.000127400	0.000133300
C16H20O	228.151426	1.250	0.062	0.00	0.0000	0.0000	0.42	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027900	0.000027200	0.000000000	0.000023100	0.000025900	0.000033900	0.000026800	0.000033600	0.000032600	0.000036300	0.000032300	0.000031200	0.000022400	0.000036800	0.000045600	0.000036100	0.000028000	0.000022700	0.000043200	0.000030100	0.000023500	0.000032100	0.000028600	0.000028900	0.000022600	0.000025500	0.000021800	0.000027600	0.000028000	0.000025300	0.000027600	0.000035400	0.000026500	0.000025500	0.000034100
C14H28O2	228.208976	2.000	0.143	0.00	0.0000	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000019300	0.000000000	0.000026500	0.000000000	0.000000000	0.000035700	0.000000000	0.000000000	0.000027200	0.000020300	0.000021200	0.000034000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000044500	0.000026400	0.000000000	0.000000000	0.000000000	0.000000000	0.000029100	0.000000000	0.000023500	0.000037900	0.000022100	0.000020100	0.000000000	0.000000000	0.000020600
C12H7NO4	229.037492	0.583	0.333	0.08	0.0000	0.0000	0.78	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000033000	0.000018200	0.000000000	0.000028400	0.000000000	0.000021100	0.000029400	0.000020200	0.000027500	0.000022900	0.000018000	0.000020400	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000020600	0.000024800	0.000024100	0.000000000	0.000028600	0.000031500	0.000024100	0.000000000	0.000028300	0.000029600	0.000028800	0.000023800	0.000037800	0.000039800	0.000048000	0.000050900
C9H11NO4S	229.040898	1.222	0.444	0.11	0.1111	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000029000	0.000030300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000027900	0.000033600	0.000000000	0.000000000	0.000000000	0.000018800	0.000031900	0.000033000	0.000000000	0.000000000	0.000026400	0.000021900	0.000024500	0.000035900	0.000020900	0.000027100	0.000027200	0.000029700	0.000000000	0.000000000
C9H11NO6	229.058704	1.222	0.667	0.11	0.0000	0.0000	0.20	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000023500	0.000021000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000034600	0.000032500	0.000033000	0.000019100	0.000029700	0.000024500
C13H11NO3	229.073929	0.846	0.231	0.08	0.0000	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000077400	0.000041000	0.000063300	0.000067200	0.000058400	0.000056800	0.000058000	0.000053100	0.000053200	0.000041000	0.000038300	0.000051000	0.000047000	0.000052800	0.000062100	0.000061800	0.000065500	0.000058900	0.000056400	0.000054900	0.000062100	0.000070900	0.000075300	0.000064200	0.000078700	0.000062300	0.000054700	0.000082900	0.000082300	0.000058800	0.000063900	0.000082000	0.000072100	0.000057300	0.000053600
C10H15NO3S	229.077256	1.500	0.300	0.10	0.1000	0.0000	0.08	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000018300	0.000000000	0.000042300	0.000038000	0.000023000	0.000027000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000022500	0.000029300	0.000028400	0.000000000	0.000020200	0.000026700	0.000036400	0.000045300	0.000054200	0.000000000	0.000000000	0.000018000	0.000024500	0.000027300	0.000028000	0.000000000	0.000000000	0.000025600	0.000022900	0.000000000	0.000000000
C10H15NO5	229.095019	1.500	0.500	0.10	0.0000	0.0000	0.08	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000051200	0.000037300	0.000068700	0.000050800	0.000055600	0.000055800	0.000058400	0.000039800	0.000031800	0.000032300	0.000020800	0.000040500	0.000027400	0.000055400	0.000056200	0.000072400	0.000072600	0.000070200	0.000068600	0.000074300	0.000080800	0.000090900	0.000099300	0.000050300	0.000047900	0.000073500	0.000065900	0.000055900	0.000069700	0.000080800	0.000080100	0.000058600	0.000058700	0.000044700	0.000053000
C14H15NO2	229.110295	1.071	0.143	0.07	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000040400	0.000028000	0.000042300	0.000049500	0.000046300	0.000038500	0.000044100	0.000038400	0.000035900	0.000027100	0.000029100	0.000028700	0.000028100	0.000053400	0.000061400	0.000053900	0.000050300	0.000031900	0.000038600	0.000038600	0.000039500	0.000056000	0.000053800	0.000032200	0.000034400	0.000031000	0.000038100	0.000052500	0.000050200	0.000034700	0.000040700	0.000050000	0.000047800	0.000031200	0.000028900
C11H19NO4	229.131430	1.727	0.364	0.09	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000020300	0.000019000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000032000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H10O3S2	230.007128	1.111	0.333	0.00	0.2222	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000027600	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000020100	0.000020300	0.000022200	0.000000000	0.000000000	0.000021700	0.000025500	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000
C12H6O5	230.021512	0.500	0.417	0.00	0.0000	0.0000	0.79	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000077000	0.000047000	0.000030300	0.000034700	0.000027500	0.000040000	0.000040200	0.000060000	0.000066500	0.000052300	0.000053700	0.000047400	0.000051700	0.000000000	0.000000000	0.000018800	0.000019800	0.000029000	0.000000000	0.000058000	0.000054800	0.000000000	0.000000000	0.000055200	0.000062100	0.000027900	0.000023000	0.000038900	0.000040600	0.000064300	0.000068900	0.000071100	0.000080100	0.000178200	0.000166700
C9H10O5S	230.024919	1.111	0.556	0.00	0.1111	0.0000	0.27	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029700	0.000021000	0.000025100	0.000040200	0.000029700	0.000030200	0.000023900	0.000024600	0.000022800	0.000023900	0.000018900	0.000022800	0.000021300	0.000022300	0.000000000	0.000035400	0.000035600	0.000027100	0.000032100	0.000027200	0.000025800	0.000030200	0.000038700	0.000033200	0.000026100	0.000033100	0.000034400	0.000034600	0.000036900	0.000029600	0.000025300	0.000038100	0.000026600	0.000019100	0.000019900
C11H6N2O4	230.032755	0.545	0.364	0.18	0.0000	0.0000	0.86	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H10O2S	230.040193	0.769	0.154	0.00	0.0769	0.0000	0.64	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000032000	0.000000000	0.000040400	0.000043900	0.000035600	0.000039500	0.000000000	0.000019900	0.000022200	0.000000000	0.000000000	0.000021600	0.000000000	0.000025000	0.000026400	0.000039400	0.000034400	0.000022200	0.000000000	0.000021800	0.000030300	0.000033100	0.000028200	0.000028400	0.000031400	0.000030600	0.000019300	0.000044600	0.000044300	0.000000000	0.000000000	0.000041500	0.000036500	0.000000000	0.000000000
C9H10O7	230.042709	1.111	0.778	0.00	0.0000	0.0000	0.27	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000034100	0.000027200	0.000000000	0.000018200	0.000024600	0.000000000	0.000018000	0.000034300	0.000027900	0.000030000	0.000018200	0.000025400	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028200	0.000018600	0.000000000	0.000000000	0.000029400	0.000026800	0.000000000	0.000023300	0.000021700	0.000000000	0.000072000	0.000058400	0.000029900	0.000035000	0.000063200	0.000062200
C10H14O2S2	230.043571	1.400	0.200	0.00	0.2000	0.0000	0.14	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000019600	0.000018900	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000
C13H10O4	230.057949	0.769	0.308	0.00	0.0000	0.0000	0.64	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000217600	0.000177400	0.000151700	0.000171400	0.000171800	0.000151300	0.000170600	0.000199100	0.000219300	0.000201700	0.000190100	0.000204000	0.000193700	0.000130000	0.000126000	0.000139400	0.000136900	0.000157600	0.000153100	0.000166400	0.000186100	0.000133600	0.000124900	0.000196700	0.000234900	0.000162300	0.000159200	0.000171200	0.000181800	0.000241800	0.000235900	0.000242500	0.000224000	0.000298200	0.000303000
C10H14O4S	230.061282	1.400	0.400	0.00	0.1000	0.0000	0.14	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000070600	0.000032300	0.000094800	0.000094600	0.000068600	0.000061900	0.000064000	0.000047400	0.000043100	0.000035600	0.000000000	0.000039200	0.000034500	0.000065100	0.000069600	0.000098000	0.000100200	0.000069800	0.000071700	0.000084700	0.000076300	0.000118700	0.000119100	0.000049500	0.000054300	0.000072200	0.000079800	0.000087700	0.000095000	0.000029500	0.000031700	0.000084800	0.000071600	0.000000000	0.000021500
C12H10N2O3	230.069185	0.833	0.250	0.17	0.0000	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031800	0.000020800	0.000000000	0.000040900	0.000022100	0.000025900	0.000030000	0.000026800	0.000030100	0.000021500	0.000000000	0.000023600	0.000023200	0.000000000	0.000023900	0.000032700	0.000027300	0.000025600	0.000000000	0.000024600	0.000027000	0.000034000	0.000020000	0.000031300	0.000031700	0.000033300	0.000018800	0.000027400	0.000029800	0.000033300	0.000033900	0.000044100	0.000035900	0.000019900	0.000025300
C14H14OS	230.076498	1.000	0.071	0.00	0.0714	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000
C10H14O6	230.079031	1.400	0.600	0.00	0.0000	0.0000	0.14	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000215200	0.000218000	0.000204500	0.000237700	0.000223800	0.000242800	0.000211200	0.000225100	0.000248200	0.000224400	0.000183600	0.000225600	0.000193500	0.000240300	0.000214400	0.000286000	0.000256700	0.000340600	0.000355300	0.000236500	0.000223200	0.000205400	0.000220000	0.000259000	0.000292100	0.000285800	0.000252700	0.000272700	0.000258300	0.000662200	0.000608700	0.000274500	0.000242800	0.000367000	0.000386700
C14H14O3	230.094298	1.000	0.214	0.00	0.0000	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000275400	0.000290700	0.000279700	0.000293400	0.000309900	0.000310600	0.000288300	0.000339100	0.000323200	0.000318900	0.000295100	0.000309500	0.000279500	0.000305800	0.000326000	0.000302700	0.000286000	0.000296300	0.000322700	0.000288100	0.000302600	0.000317000	0.000284400	0.000304700	0.000315200	0.000286200	0.000272200	0.000292600	0.000293500	0.000264500	0.000275100	0.000329500	0.000318300	0.000297400	0.000320500
C11H18O3S	230.097707	1.636	0.273	0.00	0.0909	0.0000	0.06	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000027300	0.000022500	0.000019200	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000024300	0.000000000	0.000000000	0.000000000	0.000028500	0.000029100	0.000033600	0.000026100	0.000000000	0.000022700	0.000022700	0.000039600	0.000041100	0.000000000	0.000000000	0.000022700	0.000024900	0.000024400	0.000000000	0.000000000	0.000000000	0.000027700	0.000000000	0.000000000	0.000000000
C13H14N2O2	230.105514	1.077	0.154	0.15	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034500	0.000028100	0.000035100	0.000044300	0.000035700	0.000034900	0.000041700	0.000037100	0.000032100	0.000022800	0.000021800	0.000023000	0.000036900	0.000046400	0.000046500	0.000042800	0.000045400	0.000037400	0.000036700	0.000040300	0.000034700	0.000045200	0.000050700	0.000039200	0.000043300	0.000034000	0.000043000	0.000052800	0.000045700	0.000045600	0.000044500	0.000060000	0.000053100	0.000036300	0.000038500
C11H18O5	230.115452	1.636	0.455	0.00	0.0000	0.0000	0.06	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000101200	0.000126000	0.000190700	0.000150000	0.000198500	0.000201300	0.000187000	0.000137500	0.000142400	0.000116000	0.000100000	0.000146100	0.000106400	0.000185300	0.000205200	0.000234300	0.000216500	0.000232900	0.000280400	0.000179300	0.000187600	0.000216500	0.000208500	0.000145600	0.000148200	0.000186700	0.000198500	0.000160200	0.000152400	0.000236800	0.000201200	0.000150000	0.000125000	0.000138200	0.000139600
C15H18O2	230.130692	1.200	0.133	0.00	0.0000	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000121000	0.000159200	0.000135000	0.000131800	0.000156500	0.000157400	0.000154000	0.000193500	0.000178400	0.000191400	0.000171900	0.000182600	0.000146200	0.000156500	0.000201500	0.000158800	0.000148700	0.000154100	0.000182300	0.000131700	0.000141900	0.000136700	0.000134300	0.000143500	0.000139200	0.000147200	0.000142700	0.000141300	0.000132500	0.000126300	0.000129500	0.000148400	0.000134400	0.000133000	0.000137700
C12H22O4	230.151815	1.833	0.333	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000022000	0.000000000	0.000023700	0.000028700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030100	0.000026900	0.000029800	0.000029400	0.000000000	0.000032100	0.000018400	0.000000000	0.000033600	0.000020900	0.000000000	0.000000000	0.000021900	0.000018300	0.000000000	0.000000000	0.000022400	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000
C16H22O	230.167098	1.375	0.062	0.00	0.0000	0.0000	0.35	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000025500	0.000000000	0.000020300	0.000019200	0.000022700	0.000027500	0.000038100	0.000028000	0.000040100	0.000021600	0.000035100	0.000023200	0.000034600	0.000032100	0.000029900	0.000025400	0.000024400	0.000039600	0.000000000	0.000000000	0.000020200	0.000019700	0.000021700	0.000028100	0.000021900	0.000018200	0.000020900	0.000026700	0.000024400	0.000000000	0.000024800	0.000020300	0.000025700	0.000025500
C12H9NO2S	231.035422	0.750	0.167	0.08	0.0833	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025100	0.000000000	0.000000000	0.000034100	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000022500	0.000018500	0.000000000	0.000031300	0.000032800	0.000000000	0.000000000	0.000026400	0.000019200	0.000000000	0.000000000
C12H9NO4	231.053204	0.750	0.333	0.08	0.0000	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061000	0.000040400	0.000031000	0.000048300	0.000042300	0.000048100	0.000041200	0.000038400	0.000050400	0.000042200	0.000035700	0.000039000	0.000038800	0.000038500	0.000034400	0.000034600	0.000043800	0.000038700	0.000028500	0.000037400	0.000038900	0.000043900	0.000037000	0.000058000	0.000061900	0.000048700	0.000051600	0.000048900	0.000057400	0.000070700	0.000071500	0.000063500	0.000057400	0.000064700	0.000062600
C9H13NO4S	231.056567	1.444	0.444	0.11	0.1111	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019400	0.000000000	0.000030100	0.000028800	0.000018700	0.000019500	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000019900	0.000025500	0.000000000	0.000000000	0.000000000	0.000027900	0.000044800	0.000044100	0.000000000	0.000020000	0.000030600	0.000022200	0.000024600	0.000024500	0.000000000	0.000000000	0.000028500	0.000021400	0.000000000	0.000000000
C9H13NO6	231.074290	1.444	0.667	0.11	0.0000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000021100	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000018100	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000027100	0.000031200	0.000000000	0.000000000	0.000000000	0.000000000
C13H13NO3	231.089532	1.000	0.231	0.08	0.0000	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000120100	0.000081000	0.000107900	0.000128800	0.000109000	0.000116100	0.000111500	0.000083100	0.000092600	0.000072500	0.000065300	0.000084000	0.000080600	0.000110700	0.000117400	0.000137400	0.000126100	0.000094800	0.000103700	0.000107200	0.000109900	0.000151300	0.000144500	0.000100600	0.000109500	0.000108000	0.000103700	0.000140000	0.000136300	0.000092100	0.000093700	0.000138800	0.000137100	0.000082300	0.000082500
C10H17NO5	231.110729	1.700	0.500	0.10	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H17NO2	231.125974	1.214	0.143	0.07	0.0000	0.0000	0.42	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000032600	0.000024800	0.000039800	0.000030400	0.000033900	0.000034300	0.000031200	0.000033400	0.000026700	0.000022500	0.000026900	0.000026300	0.000018600	0.000038000	0.000039700	0.000053000	0.000035600	0.000030300	0.000042000	0.000028200	0.000038700	0.000047800	0.000040200	0.000033600	0.000028600	0.000030900	0.000025700	0.000033900	0.000037500	0.000035700	0.000027800	0.000040500	0.000031600	0.000000000	0.000018500
C11H4O6	232.000783	0.364	0.545	0.00	0.0000	0.0000	0.88	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026700	0.000000000	0.000000000	0.000000000	0.000052400	0.000041300
C12H8O3S	232.019469	0.667	0.250	0.00	0.0833	0.0000	0.68	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000034700	0.000023700	0.000026800	0.000044300	0.000024300	0.000027100	0.000020500	0.000000000	0.000024900	0.000021000	0.000025100	0.000028300	0.000020000	0.000021300	0.000019400	0.000031500	0.000029000	0.000000000	0.000019100	0.000020700	0.000000000	0.000031900	0.000024200	0.000033300	0.000034700	0.000030700	0.000000000	0.000034500	0.000039000	0.000000000	0.000000000	0.000044100	0.000037300	0.000000000	0.000021700
C9H12O3S2	232.022815	1.333	0.333	0.00	0.2222	0.0000	0.09	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000022700	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000026800	0.000000000	0.000034300	0.000035900	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000
C12H8O5	232.037208	0.667	0.417	0.00	0.0000	0.0000	0.68	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000152500	0.000117400	0.000094900	0.000080800	0.000090700	0.000107000	0.000096500	0.000125300	0.000140500	0.000132300	0.000116600	0.000124300	0.000123500	0.000057600	0.000061100	0.000067400	0.000060200	0.000096400	0.000073100	0.000122200	0.000130900	0.000062600	0.000056800	0.000144800	0.000150200	0.000090200	0.000090100	0.000108200	0.000100400	0.000179200	0.000161300	0.000161900	0.000155900	0.000296200	0.000287300
C9H12O5S	232.040537	1.333	0.556	0.00	0.1111	0.0000	0.09	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000043700	0.000024900	0.000043900	0.000065800	0.000045300	0.000044300	0.000038800	0.000032600	0.000037100	0.000030600	0.000025200	0.000026200	0.000036900	0.000028600	0.000038100	0.000056900	0.000065600	0.000060000	0.000050700	0.000049400	0.000052900	0.000063600	0.000073100	0.000041200	0.000042400	0.000042700	0.000044600	0.000071800	0.000064500	0.000036900	0.000035200	0.000053400	0.000047000	0.000021200	0.000025000
C11H8N2O4	232.048469	0.727	0.364	0.18	0.0000	0.0000	0.71	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000019100	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026200	0.000033100	0.000030800	0.000000000	0.000023100	0.000020300
C13H12O2S	232.055789	0.923	0.154	0.00	0.0769	0.0000	0.55	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000050600	0.000026500	0.000051700	0.000073700	0.000048800	0.000046300	0.000044900	0.000032600	0.000037600	0.000027400	0.000024000	0.000000000	0.000027400	0.000038500	0.000048400	0.000061600	0.000058200	0.000042000	0.000037100	0.000047100	0.000052800	0.000059900	0.000062600	0.000043000	0.000047500	0.000044100	0.000041300	0.000073200	0.000075800	0.000000000	0.000000000	0.000069200	0.000063500	0.000000000	0.000000000
C9H12O7	232.058299	1.333	0.778	0.00	0.0000	0.0000	0.09	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000029500	0.000026600	0.000000000	0.000025400	0.000020600	0.000028300	0.000022700	0.000029000	0.000034300	0.000021400	0.000023200	0.000026300	0.000024800	0.000019800	0.000000000	0.000019600	0.000000000	0.000032200	0.000000000	0.000028300	0.000028600	0.000000000	0.000024000	0.000027900	0.000036700	0.000023400	0.000000000	0.000024000	0.000022100	0.000077700	0.000058400	0.000033700	0.000029200	0.000065200	0.000060800
C10H16O2S2	232.059184	1.600	0.200	0.00	0.2000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000
C13H12O4	232.073560	0.923	0.308	0.00	0.0000	0.0000	0.55	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000424400	0.000381500	0.000370000	0.000380000	0.000374800	0.000372100	0.000355200	0.000414600	0.000413700	0.000409900	0.000396400	0.000398400	0.000395000	0.000327900	0.000324000	0.000343500	0.000339500	0.000387000	0.000365200	0.000373100	0.000374300	0.000359000	0.000335600	0.000418100	0.000457500	0.000379500	0.000375900	0.000386800	0.000386200	0.000433600	0.000420000	0.000469700	0.000432700	0.000486100	0.000500700
C10H16O4S	232.076973	1.600	0.400	0.00	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000037500	0.000023100	0.000064000	0.000052600	0.000053700	0.000056700	0.000054900	0.000026100	0.000037300	0.000021400	0.000020100	0.000029300	0.000021800	0.000050600	0.000051500	0.000064300	0.000070600	0.000045800	0.000044400	0.000060200	0.000056800	0.000080800	0.000086700	0.000029500	0.000039400	0.000062000	0.000047800	0.000057800	0.000055700	0.000023800	0.000027000	0.000051200	0.000032200	0.000019800	0.000020100
C12H12N2O3	232.084782	1.000	0.250	0.17	0.0000	0.0000	0.53	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000069000	0.000033300	0.000048800	0.000062400	0.000042100	0.000046000	0.000039100	0.000044700	0.000041100	0.000046700	0.000032700	0.000036400	0.000034100	0.000044400	0.000039800	0.000058300	0.000053900	0.000052600	0.000044000	0.000048700	0.000049800	0.000056800	0.000053300	0.000053000	0.000069500	0.000053400	0.000047900	0.000068100	0.000069400	0.000064800	0.000061100	0.000072700	0.000078100	0.000058000	0.000055000
C10H16O6	232.094729	1.600	0.600	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000056100	0.000067000	0.000079000	0.000070600	0.000084700	0.000077700	0.000073000	0.000069400	0.000072900	0.000065200	0.000052600	0.000075000	0.000060300	0.000072200	0.000070700	0.000107500	0.000097500	0.000114500	0.000128900	0.000082600	0.000064500	0.000083200	0.000079700	0.000065800	0.000075500	0.000094800	0.000087300	0.000084200	0.000082800	0.000200800	0.000166200	0.000068600	0.000065800	0.000099600	0.000106300
C14H16O3	232.109974	1.143	0.214	0.00	0.0000	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000315400	0.000414300	0.000370900	0.000365900	0.000418000	0.000406500	0.000367200	0.000481400	0.000421200	0.000459000	0.000411400	0.000468100	0.000388700	0.000403700	0.000466100	0.000409100	0.000394700	0.000419900	0.000446700	0.000365400	0.000357100	0.000394200	0.000373500	0.000371300	0.000381400	0.000381100	0.000383200	0.000349900	0.000348800	0.000324300	0.000316800	0.000387100	0.000329000	0.000348800	0.000368500
C11H20O3S	232.113287	1.818	0.273	0.00	0.0909	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H16N2O2	232.121226	1.231	0.154	0.15	0.0000	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028900	0.000027600	0.000025400	0.000036300	0.000028900	0.000018800	0.000022300	0.000024800	0.000000000	0.000000000	0.000018800	0.000000000	0.000021700	0.000033400	0.000031700	0.000030100	0.000028700	0.000029200	0.000023800	0.000026800	0.000026100	0.000036000	0.000038600	0.000031600	0.000029300	0.000025400	0.000026500	0.000032100	0.000027700	0.000025600	0.000031200	0.000037400	0.000034200	0.000000000	0.000000000
C11H20O5	232.131064	1.818	0.455	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000022800	0.000023800	0.000000000	0.000023600	0.000020900	0.000000000	0.000020800	0.000000000	0.000000000	0.000019200	0.000025600	0.000000000	0.000027700	0.000028600	0.000026100	0.000028100	0.000030900	0.000032300	0.000024600	0.000000000	0.000027500	0.000024300	0.000026000	0.000000000	0.000029600	0.000022700	0.000018900	0.000000000	0.000023300	0.000025900	0.000023700	0.000000000	0.000023000	0.000000000
C15H20O2	232.146334	1.333	0.133	0.00	0.0000	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000121100	0.000179100	0.000136600	0.000160700	0.000184200	0.000165700	0.000162700	0.000224200	0.000203600	0.000203900	0.000199700	0.000213600	0.000169100	0.000189900	0.000243600	0.000188500	0.000171900	0.000189500	0.000215200	0.000150800	0.000145400	0.000168200	0.000149800	0.000154700	0.000163900	0.000157600	0.000154400	0.000151700	0.000158400	0.000150000	0.000140700	0.000161600	0.000137000	0.000156500	0.000152700
C16H24O	232.182730	1.500	0.062	0.00	0.0000	0.0000	0.29	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000018600	0.000000000	0.000022400	0.000019100	0.000020100	0.000018000	0.000000000	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H7NO3S	233.014741	0.636	0.273	0.09	0.0909	0.0000	0.73	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019200	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000
C11H7NO5	233.032440	0.636	0.455	0.09	0.0000	0.0000	0.73	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028100	0.000020100	0.000000000	0.000000000	0.000019100	0.000029700	0.000000000	0.000031800	0.000020700	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000018900	0.000029800	0.000029800	0.000022800	0.000018600	0.000020600	0.000026400	0.000031400	0.000035700	0.000024600	0.000032000	0.000054900	0.000050500
C8H11NO5S	233.035748	1.375	0.625	0.13	0.1250	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H11NO2S	233.051041	0.917	0.167	0.08	0.0833	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000027300	0.000000000	0.000031300	0.000039200	0.000032300	0.000024500	0.000021700	0.000000000	0.000024400	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000030700	0.000034300	0.000034000	0.000021100	0.000000000	0.000027100	0.000025000	0.000037800	0.000040800	0.000020400	0.000027100	0.000024000	0.000018700	0.000038000	0.000045700	0.000000000	0.000000000	0.000047500	0.000041500	0.000000000	0.000000000
C12H11NO4	233.068819	0.917	0.333	0.08	0.0000	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000113200	0.000067200	0.000081200	0.000105700	0.000081200	0.000086200	0.000081200	0.000073600	0.000075400	0.000058500	0.000064600	0.000070500	0.000080800	0.000076600	0.000079300	0.000092200	0.000089200	0.000083800	0.000077500	0.000088900	0.000087000	0.000097900	0.000100900	0.000092900	0.000100600	0.000093200	0.000088800	0.000104000	0.000109200	0.000109200	0.000095400	0.000126000	0.000109200	0.000092500	0.000084600
C9H15NO4S	233.072268	1.667	0.444	0.11	0.1111	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H11N3O3	233.080087	1.000	0.273	0.27	0.0000	0.0000	0.54	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000
C13H15NO3	233.105220	1.154	0.231	0.08	0.0000	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000088200	0.000061800	0.000100200	0.000107600	0.000102100	0.000089900	0.000091800	0.000078300	0.000076200	0.000055200	0.000058200	0.000072400	0.000059000	0.000100800	0.000105600	0.000114000	0.000109800	0.000095600	0.000096700	0.000093200	0.000096800	0.000137300	0.000128700	0.000086900	0.000090600	0.000099300	0.000092200	0.000109600	0.000103100	0.000084200	0.000099500	0.000112500	0.000104800	0.000076100	0.000068100
C14H19NO2	233.141583	1.357	0.143	0.07	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020100	0.000021200	0.000032000	0.000025400	0.000030300	0.000028900	0.000030400	0.000024600	0.000021500	0.000026800	0.000000000	0.000019800	0.000000000	0.000026100	0.000036700	0.000039100	0.000038300	0.000041700	0.000030300	0.000027100	0.000030000	0.000038000	0.000031800	0.000022400	0.000021700	0.000031800	0.000039600	0.000035600	0.000031300	0.000019700	0.000028000	0.000033000	0.000027200	0.000000000	0.000019600
C11H6O4S	233.998662	0.545	0.364	0.00	0.0909	0.0000	0.75	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000024400	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000024500	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000020300	0.000000000	0.000026100	0.000020300	0.000000000	0.000000000	0.000032500	0.000027500	0.000000000	0.000000000
C8H10O4S2	234.002069	1.250	0.500	0.00	0.2500	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000018800	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000018700	0.000000000	0.000000000	0.000025200	0.000018900	0.000025100	0.000033100	0.000000000	0.000000000	0.000020100	0.000026800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O6	234.016446	0.545	0.545	0.00	0.0000	0.0000	0.75	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000051800	0.000041400	0.000034800	0.000026500	0.000032000	0.000033800	0.000044100	0.000053000	0.000067500	0.000054200	0.000053800	0.000043200	0.000055000	0.000020300	0.000000000	0.000019500	0.000018400	0.000040000	0.000018700	0.000053300	0.000047600	0.000021000	0.000000000	0.000052700	0.000046800	0.000027100	0.000033700	0.000034000	0.000037400	0.000081000	0.000063300	0.000061900	0.000067300	0.000176000	0.000154500
C12H10OS2	234.017332	0.833	0.083	0.00	0.1667	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026900	0.000000000	0.000000000	0.000027900	0.000021200	0.000028000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000027000	0.000000000	0.000000000	0.000000000	0.000027300	0.000020800	0.000000000	0.000000000
C12H10O3S	234.035111	0.833	0.250	0.00	0.0833	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000067000	0.000034900	0.000053400	0.000078300	0.000054100	0.000057800	0.000047900	0.000041800	0.000035500	0.000033800	0.000021600	0.000027800	0.000022800	0.000050100	0.000038800	0.000077200	0.000067100	0.000039500	0.000044400	0.000048600	0.000044700	0.000075500	0.000067600	0.000054000	0.000056200	0.000051600	0.000058500	0.000083500	0.000081500	0.000000000	0.000023700	0.000084900	0.000064500	0.000000000	0.000000000
C9H14O3S2	234.038466	1.556	0.333	0.00	0.2222	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000034100	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H10O5	234.052858	0.833	0.417	0.00	0.0000	0.0000	0.58	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000270400	0.000224400	0.000190100	0.000173900	0.000189100	0.000191500	0.000184400	0.000228100	0.000247600	0.000235400	0.000231700	0.000230800	0.000240800	0.000145900	0.000129900	0.000160000	0.000164800	0.000207700	0.000177300	0.000224000	0.000221500	0.000148200	0.000132500	0.000249600	0.000259100	0.000195500	0.000199800	0.000210100	0.000208100	0.000313300	0.000299300	0.000275400	0.000251700	0.000442000	0.000421400
C9H14O5S	234.056190	1.556	0.556	0.00	0.1111	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000043900	0.000034000	0.000053300	0.000057800	0.000056800	0.000052600	0.000047900	0.000036300	0.000037600	0.000029600	0.000025300	0.000034300	0.000025200	0.000048200	0.000049300	0.000074500	0.000069000	0.000055200	0.000054400	0.000055500	0.000051000	0.000070500	0.000081000	0.000038700	0.000054800	0.000055800	0.000041700	0.000060800	0.000061600	0.000101500	0.000101100	0.000055600	0.000045600	0.000042700	0.000046500
C11H10N2O4	234.064096	0.909	0.364	0.18	0.0000	0.0000	0.57	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035900	0.000024100	0.000026500	0.000028500	0.000025700	0.000022700	0.000022400	0.000019000	0.000025300	0.000023600	0.000000000	0.000023800	0.000000000	0.000022600	0.000027000	0.000024700	0.000030300	0.000029700	0.000035600	0.000019700	0.000021800	0.000026200	0.000036400	0.000032900	0.000036300	0.000024800	0.000043200	0.000032600	0.000043700	0.000039400	0.000046500	0.000042500	0.000038700	0.000035300	0.000035900
C16H10O2	234.068109	0.625	0.125	0.00	0.0000	0.0000	0.73	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000029000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000020000	0.000019500	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025500	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000028000	0.000026700	0.000023400	0.000025000	0.000038400	0.000039300
C13H14O2S	234.071444	1.077	0.154	0.00	0.0769	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000048000	0.000026800	0.000048700	0.000071000	0.000054600	0.000053600	0.000052800	0.000037800	0.000034700	0.000020300	0.000020900	0.000029700	0.000023200	0.000056100	0.000047600	0.000059800	0.000065400	0.000049400	0.000041700	0.000053900	0.000057500	0.000071200	0.000060500	0.000034300	0.000035700	0.000051000	0.000033600	0.000065600	0.000070200	0.000018200	0.000000000	0.000065000	0.000059000	0.000019600	0.000000000
C9H14O7	234.073928	1.556	0.778	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000023900	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000019200	0.000019800	0.000000000	0.000019400	0.000018500	0.000000000	0.000036400	0.000027600	0.000000000	0.000000000	0.000025200	0.000026100
C13H14O4	234.089204	1.077	0.308	0.00	0.0000	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000622600	0.000648000	0.000627800	0.000587800	0.000672000	0.000652800	0.000606600	0.000684000	0.000657400	0.000678700	0.000625100	0.000682700	0.000617600	0.000604600	0.000619800	0.000651400	0.000598900	0.000659900	0.000659900	0.000614800	0.000595100	0.000629500	0.000609700	0.000623900	0.000651300	0.000645300	0.000615100	0.000618400	0.000611900	0.000659300	0.000642800	0.000662800	0.000622600	0.000688900	0.000695500
C10H18O4S	234.092612	1.800	0.400	0.00	0.1000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000020700	0.000025600	0.000038300	0.000050900	0.000036000	0.000037500	0.000035000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000036800	0.000035700	0.000062400	0.000050200	0.000037700	0.000035500	0.000030200	0.000032800	0.000047800	0.000048000	0.000035300	0.000023400	0.000038700	0.000039400	0.000031400	0.000032500	0.000034200	0.000026000	0.000030600	0.000019500	0.000000000	0.000000000
C12H14N2O3	234.100441	1.167	0.250	0.17	0.0000	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000060400	0.000044600	0.000057800	0.000057600	0.000051200	0.000050700	0.000054600	0.000041800	0.000042700	0.000038400	0.000043600	0.000040300	0.000040900	0.000054000	0.000058500	0.000062900	0.000062800	0.000053700	0.000050500	0.000044200	0.000052000	0.000075800	0.000068400	0.000050600	0.000060600	0.000053200	0.000058200	0.000059900	0.000067400	0.000083200	0.000077800	0.000065300	0.000063000	0.000053600	0.000057100
C10H18O6	234.110428	1.800	0.600	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H18O3	234.125643	1.286	0.214	0.00	0.0000	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000339800	0.000502900	0.000397800	0.000416800	0.000476900	0.000458600	0.000429300	0.000549100	0.000506500	0.000553600	0.000502200	0.000566700	0.000434800	0.000490600	0.000566200	0.000478700	0.000476900	0.000510600	0.000559900	0.000403900	0.000393900	0.000424900	0.000397300	0.000432400	0.000430800	0.000468100	0.000443700	0.000390200	0.000378900	0.000410300	0.000378600	0.000432400	0.000327700	0.000383900	0.000395800
C13H18N2O2	234.136853	1.385	0.154	0.15	0.0000	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020400	0.000018300	0.000000000	0.000022800	0.000000000	0.000022500	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028400	0.000027900	0.000018500	0.000022700	0.000024400	0.000019600	0.000020000	0.000031600	0.000027900	0.000000000	0.000000000	0.000021700	0.000034200	0.000021700	0.000000000	0.000019100	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000
C15H22O2	234.161966	1.467	0.133	0.00	0.0000	0.0000	0.29	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000085800	0.000132000	0.000118800	0.000116300	0.000145000	0.000169200	0.000163100	0.000170500	0.000148200	0.000155800	0.000142600	0.000156800	0.000121700	0.000172600	0.000218400	0.000183000	0.000155600	0.000176800	0.000240400	0.000146100	0.000126200	0.000193900	0.000180300	0.000126400	0.000129500	0.000151200	0.000149000	0.000141800	0.000135800	0.000150300	0.000135400	0.000141100	0.000117000	0.000121200	0.000130400
C11H9NO3S	235.030315	0.818	0.273	0.09	0.0909	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000035700	0.000024700	0.000026200	0.000027100	0.000021000	0.000000000	0.000028100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030500	0.000027400	0.000021400	0.000000000	0.000025100	0.000000000	0.000037200	0.000033700	0.000026500	0.000026300	0.000022200	0.000029400	0.000037800	0.000035800	0.000019300	0.000000000	0.000035000	0.000038200	0.000000000	0.000000000
C11H9NO5	235.048062	0.818	0.455	0.09	0.0000	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000068500	0.000039800	0.000035600	0.000041800	0.000045300	0.000042900	0.000048600	0.000043100	0.000040100	0.000040600	0.000038000	0.000046800	0.000045800	0.000034100	0.000027600	0.000040300	0.000043900	0.000045700	0.000046300	0.000043600	0.000044300	0.000028600	0.000027900	0.000055400	0.000052400	0.000050000	0.000055000	0.000057900	0.000060300	0.000081700	0.000067500	0.000068800	0.000068300	0.000083000	0.000081500
C12H13NO2S	235.066712	1.083	0.167	0.08	0.0833	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034300	0.000000000	0.000030200	0.000034300	0.000026700	0.000020300	0.000027800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000035900	0.000026600	0.000046500	0.000031800	0.000000000	0.000000000	0.000033200	0.000031300	0.000038500	0.000039200	0.000028500	0.000019000	0.000025600	0.000025500	0.000043300	0.000046900	0.000000000	0.000000000	0.000041500	0.000034800	0.000000000	0.000000000
C12H13NO4	235.084504	1.083	0.333	0.08	0.0000	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000122000	0.000093300	0.000118600	0.000128200	0.000110100	0.000111200	0.000106400	0.000085500	0.000089500	0.000076700	0.000075200	0.000085500	0.000087300	0.000111200	0.000100900	0.000122300	0.000131900	0.000103900	0.000103800	0.000096500	0.000098700	0.000136700	0.000135800	0.000110200	0.000112000	0.000119200	0.000101100	0.000128500	0.000139400	0.000130700	0.000109500	0.000138000	0.000113100	0.000100900	0.000096200
C13H17NO3	235.120851	1.308	0.231	0.08	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000071700	0.000063100	0.000090300	0.000086400	0.000091200	0.000074500	0.000079000	0.000068600	0.000065900	0.000054000	0.000060600	0.000064100	0.000049600	0.000091300	0.000101700	0.000107600	0.000099600	0.000084900	0.000087500	0.000083400	0.000079600	0.000106600	0.000102000	0.000066700	0.000071300	0.000087300	0.000081600	0.000092400	0.000095500	0.000083600	0.000082400	0.000092700	0.000091700	0.000064500	0.000065900
C14H21NO2	235.157239	1.500	0.143	0.07	0.0000	0.0000	0.25	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000019000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H4O7	235.995755	0.400	0.700	0.00	0.0000	0.0000	0.85	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000032000	0.000028600
C11H8O2S2	235.996595	0.727	0.182	0.00	0.1818	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000
C11H8O4S	236.014377	0.727	0.364	0.00	0.0909	0.0000	0.62	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000048000	0.000000000	0.000034700	0.000041400	0.000024400	0.000025000	0.000029700	0.000024000	0.000025900	0.000028100	0.000018800	0.000021900	0.000022800	0.000023100	0.000019700	0.000038800	0.000027500	0.000023500	0.000019200	0.000029600	0.000031400	0.000038200	0.000024000	0.000031100	0.000039900	0.000033900	0.000024500	0.000049000	0.000043200	0.000000000	0.000000000	0.000046200	0.000052900	0.000000000	0.000000000
C8H12O4S2	236.017715	1.500	0.500	0.00	0.2500	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000023500	0.000018000	0.000000000	0.000022700	0.000020300	0.000026800	0.000026100	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000
C11H8O6	236.032102	0.727	0.545	0.00	0.0000	0.0000	0.62	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000118300	0.000084600	0.000076200	0.000069000	0.000071500	0.000083900	0.000073400	0.000101500	0.000109300	0.000101100	0.000104300	0.000096500	0.000104900	0.000048100	0.000042700	0.000043700	0.000050200	0.000071200	0.000060500	0.000112400	0.000102100	0.000041600	0.000036800	0.000109000	0.000102400	0.000073500	0.000081600	0.000082900	0.000076300	0.000153200	0.000143300	0.000135200	0.000130400	0.000312400	0.000277900
C12H12OS2	236.032958	1.000	0.083	0.00	0.1667	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018500	0.000000000	0.000000000	0.000019500	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H12O6S	236.035450	1.500	0.750	0.00	0.1250	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000021700	0.000000000	0.000018300	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000030300	0.000020600	0.000000000	0.000000000	0.000000000	0.000020800	0.000021700	0.000024700	0.000018700	0.000000000	0.000000000
C10H8N2O5	236.043372	0.800	0.500	0.20	0.0000	0.0000	0.64	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000021600	0.000021400	0.000021800	0.000000000	0.000000000	0.000022000
C15H8O3	236.047361	0.533	0.200	0.00	0.0000	0.0000	0.78	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000028000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000026200	0.000026800	0.000021400	0.000028500	0.000023300	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000021100	0.000021700	0.000000000	0.000000000	0.000020200	0.000034300	0.000000000	0.000000000	0.000000000	0.000000000	0.000042000	0.000032300	0.000040200	0.000026800	0.000056800	0.000045500
C12H12O3S	236.050703	1.000	0.250	0.00	0.0833	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000125800	0.000051200	0.000127700	0.000159900	0.000107500	0.000109600	0.000093300	0.000062600	0.000064800	0.000044800	0.000048500	0.000057500	0.000049000	0.000102000	0.000095700	0.000134100	0.000151500	0.000087200	0.000089100	0.000115100	0.000112000	0.000175300	0.000160200	0.000082300	0.000088300	0.000107300	0.000099200	0.000158900	0.000154900	0.000028800	0.000024100	0.000149600	0.000143000	0.000029900	0.000023700
C12H12O5	236.068469	1.000	0.417	0.00	0.0000	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000477600	0.000437700	0.000391800	0.000379200	0.000394100	0.000396000	0.000377300	0.000423900	0.000438200	0.000436700	0.000408000	0.000443200	0.000444300	0.000351300	0.000321700	0.000369300	0.000350700	0.000448200	0.000435100	0.000396800	0.000417700	0.000342800	0.000327500	0.000452900	0.000490600	0.000429100	0.000412400	0.000410800	0.000412100	0.000552300	0.000524300	0.000491400	0.000466200	0.000617100	0.000623100
C9H16O5S	236.071887	1.778	0.556	0.00	0.1111	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000026300	0.000027500	0.000049000	0.000042500	0.000047000	0.000051100	0.000047400	0.000025800	0.000024600	0.000023300	0.000021600	0.000018200	0.000023500	0.000045700	0.000037000	0.000063900	0.000068300	0.000040100	0.000047900	0.000043200	0.000035700	0.000055000	0.000060400	0.000024800	0.000036900	0.000040100	0.000042600	0.000039700	0.000037000	0.000457800	0.000434400	0.000028000	0.000025100	0.000137600	0.000153400
C11H12N2O4	236.079698	1.091	0.364	0.18	0.0000	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000063200	0.000040300	0.000041900	0.000059100	0.000044000	0.000047900	0.000043500	0.000035500	0.000043500	0.000037300	0.000032900	0.000042300	0.000038500	0.000053500	0.000041900	0.000048500	0.000048400	0.000050100	0.000040100	0.000047000	0.000050300	0.000065600	0.000064600	0.000050600	0.000056500	0.000047700	0.000044700	0.000063800	0.000063300	0.000081600	0.000074800	0.000077200	0.000076600	0.000057100	0.000065500
C16H12O2	236.083729	0.750	0.125	0.00	0.0000	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037700	0.000031000	0.000037000	0.000032700	0.000030800	0.000032900	0.000021800	0.000040900	0.000039700	0.000034900	0.000034900	0.000049900	0.000041000	0.000027900	0.000029300	0.000030700	0.000036100	0.000030100	0.000027400	0.000027500	0.000037700	0.000029300	0.000029000	0.000048400	0.000045800	0.000035900	0.000032400	0.000041600	0.000035000	0.000052200	0.000047000	0.000059200	0.000052600	0.000065200	0.000060300
C13H16O2S	236.087138	1.231	0.154	0.00	0.0769	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034500	0.000000000	0.000035800	0.000034900	0.000031700	0.000042700	0.000035300	0.000029000	0.000018400	0.000000000	0.000000000	0.000000000	0.000021400	0.000031900	0.000034500	0.000045900	0.000047500	0.000037900	0.000036900	0.000033800	0.000040600	0.000046300	0.000043200	0.000026500	0.000020600	0.000035400	0.000034600	0.000044100	0.000040700	0.000000000	0.000000000	0.000043500	0.000041400	0.000000000	0.000000000
C13H16O4	236.104906	1.231	0.308	0.00	0.0000	0.0000	0.36	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000620000	0.000750400	0.000677000	0.000652400	0.000742200	0.000724700	0.000662300	0.000785500	0.000752500	0.000772300	0.000715900	0.000797500	0.000677800	0.000752600	0.000788900	0.000767900	0.000716500	0.000777900	0.000804400	0.000648000	0.000654800	0.000689900	0.000645600	0.000686200	0.000709600	0.000714600	0.000705300	0.000640200	0.000605000	0.000745600	0.000725100	0.000711500	0.000597200	0.000689500	0.000711800
C10H20O4S	236.108254	2.000	0.400	0.00	0.1000	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000019700	0.000000000	0.000027900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000026000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000024100	0.000027800	0.000019600	0.000000000	0.000023200	0.000019100	0.000000000	0.000026000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000
C12H16N2O3	236.116105	1.333	0.250	0.17	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000045900	0.000030800	0.000040300	0.000044500	0.000041400	0.000034200	0.000039900	0.000027600	0.000032600	0.000026100	0.000000000	0.000027000	0.000024800	0.000042900	0.000043300	0.000041600	0.000045400	0.000040300	0.000035800	0.000036900	0.000038700	0.000051700	0.000046300	0.000037400	0.000042500	0.000044500	0.000033800	0.000043100	0.000041400	0.000046600	0.000049900	0.000048400	0.000040200	0.000036500	0.000041000
C17H16O	236.120145	0.941	0.059	0.00	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H20O3	236.141237	1.429	0.214	0.00	0.0000	0.0000	0.28	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000355000	0.000505400	0.000434300	0.000438400	0.000507800	0.000495100	0.000458500	0.000599700	0.000517200	0.000534900	0.000499300	0.000548200	0.000425700	0.000538100	0.000644000	0.000571100	0.000519700	0.000550600	0.000652400	0.000449800	0.000438000	0.000486100	0.000469100	0.000445400	0.000448600	0.000476300	0.000452500	0.000474000	0.000453700	0.000460000	0.000435500	0.000472600	0.000419600	0.000409900	0.000446700
C15H24O2	236.177652	1.600	0.133	0.00	0.0000	0.0000	0.21	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000025900	0.000035000	0.000026400	0.000035000	0.000045900	0.000032800	0.000037100	0.000033200	0.000043300	0.000033600	0.000032900	0.000033600	0.000031700	0.000040000	0.000044200	0.000042600	0.000042600	0.000051900	0.000058100	0.000032500	0.000036400	0.000031200	0.000032500	0.000034300	0.000038400	0.000030300	0.000032900	0.000031200	0.000039100	0.000035500	0.000026400	0.000028700	0.000036100	0.000028300	0.000034600
C10H7NO4S	237.009565	0.700	0.400	0.10	0.1000	0.0000	0.67	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H7NO6	237.027403	0.700	0.600	0.10	0.0000	0.0000	0.67	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000023600	0.000028200
C11H11NO3S	237.046002	1.000	0.273	0.09	0.0909	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000039400	0.000000000	0.000045200	0.000044900	0.000033600	0.000025800	0.000033800	0.000000000	0.000000000	0.000025700	0.000000000	0.000000000	0.000019400	0.000024900	0.000018900	0.000046600	0.000040800	0.000019400	0.000026600	0.000046400	0.000040600	0.000052000	0.000048300	0.000025000	0.000030500	0.000038200	0.000038400	0.000051800	0.000046600	0.000000000	0.000000000	0.000045400	0.000039200	0.000000000	0.000000000
C11H11NO5	237.063732	1.000	0.455	0.09	0.0000	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000089500	0.000068700	0.000066500	0.000076800	0.000062000	0.000062400	0.000068100	0.000064100	0.000067200	0.000061100	0.000052800	0.000060200	0.000068700	0.000066100	0.000055700	0.000067100	0.000052700	0.000067200	0.000069300	0.000063800	0.000069800	0.000069300	0.000077400	0.000076900	0.000088300	0.000068400	0.000075700	0.000076900	0.000080800	0.000105400	0.000102000	0.000097500	0.000091000	0.000089100	0.000093100
C15H11NO2	237.078987	0.733	0.133	0.07	0.0000	0.0000	0.69	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028200	0.000021800	0.000000000	0.000028100	0.000018300	0.000020100	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000022100	0.000019400	0.000000000	0.000000000	0.000025800	0.000022900	0.000000000	0.000000000	0.000031800	0.000025100	0.000018700	0.000022900	0.000033000	0.000028300	0.000018900	0.000025000
C12H15NO2S	237.082341	1.250	0.167	0.08	0.0833	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023300	0.000000000	0.000035600	0.000029800	0.000018700	0.000026100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027300	0.000027000	0.000024100	0.000000000	0.000028400	0.000029600	0.000044700	0.000037000	0.000000000	0.000000000	0.000020400	0.000018900	0.000030800	0.000036700	0.000000000	0.000000000	0.000023600	0.000023100	0.000000000	0.000000000
C12H15NO4	237.100106	1.250	0.333	0.08	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000135500	0.000100400	0.000156200	0.000153500	0.000138200	0.000128300	0.000136600	0.000111300	0.000107600	0.000078500	0.000085100	0.000108500	0.000095500	0.000140700	0.000140400	0.000177500	0.000160000	0.000129300	0.000136600	0.000132600	0.000137800	0.000178800	0.000186700	0.000128600	0.000141600	0.000142600	0.000132400	0.000157900	0.000157400	0.000172300	0.000161000	0.000167900	0.000152700	0.000120200	0.000121000
C13H19NO3	237.136537	1.462	0.231	0.08	0.0000	0.0000	0.24	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000029200	0.000030600	0.000046600	0.000042400	0.000045300	0.000043000	0.000041200	0.000035100	0.000033200	0.000018200	0.000023500	0.000027100	0.000000000	0.000041700	0.000045900	0.000050100	0.000052100	0.000034600	0.000041300	0.000026200	0.000033200	0.000051400	0.000055600	0.000032600	0.000028700	0.000036200	0.000040700	0.000043800	0.000045400	0.000045500	0.000026800	0.000042200	0.000027000	0.000021100	0.000030500
C10H6O5S	237.993676	0.600	0.500	0.00	0.1000	0.0000	0.69	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000
C10H6O7	238.011408	0.600	0.700	0.00	0.0000	0.0000	0.69	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000022300	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000018600	0.000027500	0.000020000	0.000019500	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031400	0.000029900	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000035700	0.000028000	0.000021900	0.000026100	0.000070300	0.000069500
C11H10O2S2	238.012245	0.909	0.182	0.00	0.1818	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000022700	0.000019300	0.000000000	0.000000000	0.000000000	0.000018600	0.000023000	0.000019900	0.000000000	0.000000000	0.000023300	0.000021200	0.000000000	0.000000000
C14H6O4	238.026653	0.429	0.286	0.00	0.0000	0.0000	0.83	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000030000	0.000024000
C11H10O4S	238.029989	0.909	0.364	0.00	0.0909	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000077900	0.000039600	0.000062800	0.000073600	0.000060000	0.000057300	0.000060800	0.000041700	0.000042000	0.000037600	0.000037200	0.000049000	0.000039400	0.000051600	0.000045000	0.000070900	0.000081800	0.000055500	0.000053100	0.000050300	0.000062800	0.000064700	0.000064200	0.000055100	0.000066900	0.000055700	0.000063000	0.000080100	0.000094800	0.000028100	0.000029400	0.000081400	0.000076000	0.000025800	0.000036600
C11H10O6	238.047727	0.909	0.545	0.00	0.0000	0.0000	0.50	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000184400	0.000163200	0.000130800	0.000127300	0.000121600	0.000128800	0.000128600	0.000150000	0.000176200	0.000171000	0.000158800	0.000166700	0.000169900	0.000094400	0.000084400	0.000098100	0.000097400	0.000141000	0.000133200	0.000150700	0.000161300	0.000088900	0.000091400	0.000174100	0.000187100	0.000135200	0.000155700	0.000146400	0.000159200	0.000278700	0.000278400	0.000200800	0.000214400	0.000409900	0.000404500
C12H14OS2	238.048584	1.167	0.083	0.00	0.1667	0.0000	0.37	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000023900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C8H14O6S	238.051109	1.750	0.750	0.00	0.1250	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000020900	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000
C10H10N2O5	238.059020	1.000	0.500	0.20	0.0000	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020200	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000021900	0.000037100	0.000028900	0.000000000	0.000000000	0.000029200	0.000026500
C15H10O3	238.062988	0.667	0.200	0.00	0.0000	0.0000	0.70	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000086600	0.000065100	0.000046000	0.000065800	0.000050900	0.000062100	0.000061300	0.000086000	0.000094200	0.000072200	0.000061400	0.000085900	0.000081100	0.000045500	0.000038500	0.000044600	0.000049800	0.000054500	0.000048100	0.000069700	0.000062500	0.000052100	0.000041400	0.000083500	0.000092000	0.000052900	0.000050700	0.000073200	0.000073300	0.000114100	0.000101500	0.000098700	0.000107500	0.000147500	0.000153100
C12H14O3S	238.066358	1.167	0.250	0.00	0.0833	0.0000	0.37	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000115500	0.000042300	0.000146400	0.000150300	0.000114600	0.000103700	0.000093100	0.000061200	0.000068500	0.000047300	0.000039400	0.000040800	0.000057000	0.000103500	0.000096600	0.000152200	0.000141700	0.000083900	0.000093900	0.000122100	0.000127600	0.000202200	0.000172500	0.000080100	0.000087800	0.000117000	0.000107100	0.000148800	0.000150200	0.000029600	0.000032400	0.000134800	0.000122000	0.000022400	0.000028300
C12H14O5	238.084138	1.167	0.417	0.00	0.0000	0.0000	0.37	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000681000	0.000674900	0.000624800	0.000658400	0.000676500	0.000696200	0.000642900	0.000694900	0.000712000	0.000663200	0.000615000	0.000680700	0.000642300	0.000702000	0.000664600	0.000737700	0.000695900	0.000737600	0.000790500	0.000643300	0.000630800	0.000653100	0.000605300	0.000701000	0.000752300	0.000715300	0.000686500	0.000706900	0.000691900	0.000931800	0.000882500	0.000756300	0.000709800	0.000788100	0.000825100
C11H14N2O4	238.095345	1.273	0.364	0.18	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000063100	0.000033600	0.000064800	0.000057600	0.000046300	0.000055600	0.000053700	0.000045800	0.000041700	0.000038700	0.000037000	0.000033600	0.000041200	0.000050500	0.000048000	0.000073200	0.000070900	0.000051000	0.000050500	0.000060000	0.000061100	0.000082100	0.000080800	0.000050900	0.000049400	0.000061000	0.000056900	0.000059100	0.000071000	0.000072200	0.000080500	0.000071800	0.000062400	0.000052400	0.000055400
C16H14O2	238.099389	0.875	0.125	0.00	0.0000	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000053700	0.000048700	0.000045600	0.000059000	0.000043500	0.000052200	0.000060700	0.000054600	0.000053000	0.000059300	0.000054000	0.000051300	0.000047900	0.000051500	0.000069600	0.000056200	0.000051200	0.000046200	0.000049500	0.000052000	0.000058200	0.000037000	0.000043200	0.000049500	0.000058800	0.000049800	0.000048100	0.000055800	0.000058100	0.000053800	0.000059600	0.000067100	0.000069800	0.000059000	0.000072100
C13H18O2S	238.102792	1.385	0.154	0.00	0.0769	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000024800	0.000025300	0.000024500	0.000026600	0.000025200	0.000000000	0.000000000	0.000019200	0.000000000	0.000023600	0.000000000	0.000022500	0.000031700	0.000034900	0.000032100	0.000027200	0.000024100	0.000020200	0.000019500	0.000035200	0.000032600	0.000000000	0.000018600	0.000020900	0.000026700	0.000036000	0.000031200	0.000000000	0.000000000	0.000025600	0.000026200	0.000000000	0.000000000
C13H18O4	238.120559	1.385	0.308	0.00	0.0000	0.0000	0.27	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000581900	0.000740800	0.000728200	0.000707600	0.000845300	0.000830400	0.000772000	0.000839000	0.000792200	0.000761300	0.000689600	0.000820000	0.000673100	0.000881300	0.000984500	0.000939500	0.000835300	0.000897000	0.000997300	0.000718200	0.000730600	0.000795800	0.000770400	0.000719100	0.000717500	0.000799800	0.000776200	0.000711900	0.000719000	0.000850300	0.000786100	0.000737200	0.000634500	0.000656100	0.000713700
C12H18N2O3	238.131778	1.500	0.250	0.17	0.0000	0.0000	0.18	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000019500	0.000019900	0.000022700	0.000023600	0.000000000	0.000018900	0.000020100	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000021900	0.000000000	0.000019000	0.000000000	0.000019900	0.000028300	0.000000000	0.000000000	0.000021400	0.000000000	0.000018400	0.000021500	0.000021100	0.000022700	0.000021000	0.000000000	0.000000000	0.000000000
C17H18O	238.135827	1.059	0.059	0.00	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000020800	0.000000000	0.000019900	0.000020200	0.000000000	0.000021500	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000
C14H22O3	238.156890	1.571	0.214	0.00	0.0000	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000134900	0.000183500	0.000181700	0.000173800	0.000227600	0.000223900	0.000212100	0.000231000	0.000188700	0.000182100	0.000172600	0.000201800	0.000154300	0.000234400	0.000309100	0.000261300	0.000223000	0.000226500	0.000303500	0.000202100	0.000193800	0.000233100	0.000231300	0.000169200	0.000178400	0.000201100	0.000187800	0.000195500	0.000200700	0.000186600	0.000171000	0.000197800	0.000175600	0.000150800	0.000162300
C10H9NO4S	239.025223	0.900	0.400	0.10	0.1000	0.0000	0.50	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000032400	0.000000000	0.000000000	0.000024100	0.000026800	0.000021900	0.000019500	0.000000000	0.000019000	0.000000000	0.000000000	0.000019700	0.000000000	0.000020300	0.000000000	0.000023600	0.000026100	0.000000000	0.000000000	0.000000000	0.000025600	0.000019900	0.000023300	0.000000000	0.000020700	0.000023100	0.000021200	0.000031100	0.000027200	0.000000000	0.000000000	0.000032700	0.000035800	0.000000000	0.000000000
C10H9NO6	239.042987	0.900	0.600	0.10	0.0000	0.0000	0.50	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020900	0.000029900	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000019300	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000026400	0.000023600	0.000000000	0.000000000	0.000020500	0.000025500	0.000045900	0.000047800	0.000000000	0.000028600	0.000051000	0.000047000
C14H9NO3	239.058232	0.643	0.214	0.07	0.0000	0.0000	0.74	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000039100	0.000000000	0.000022500	0.000021500	0.000020900	0.000019000	0.000028200	0.000026000	0.000025900	0.000028000	0.000000000	0.000000000	0.000018900	0.000000000	0.000020200	0.000022400	0.000019700	0.000027000	0.000026400	0.000021900	0.000019800	0.000027800	0.000000000	0.000025000	0.000032400	0.000025200	0.000025800	0.000035500	0.000027400	0.000030900	0.000038500	0.000047200	0.000039900	0.000044200	0.000041300
C11H13NO3S	239.061610	1.182	0.273	0.09	0.0909	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000058400	0.000021600	0.000058000	0.000062400	0.000037700	0.000032900	0.000041100	0.000028400	0.000025600	0.000000000	0.000000000	0.000024500	0.000000000	0.000028500	0.000035600	0.000055100	0.000064600	0.000033500	0.000035000	0.000049300	0.000049000	0.000069800	0.000074100	0.000028300	0.000028600	0.000040500	0.000039500	0.000060800	0.000059700	0.000000000	0.000000000	0.000049900	0.000055300	0.000000000	0.000000000
C11H13NO5	239.079390	1.182	0.455	0.09	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000115000	0.000081600	0.000095400	0.000112500	0.000098000	0.000097500	0.000089700	0.000072900	0.000092800	0.000075500	0.000059200	0.000074800	0.000072100	0.000094500	0.000101200	0.000116900	0.000104500	0.000096800	0.000108300	0.000090400	0.000085400	0.000124500	0.000121300	0.000097800	0.000107800	0.000112700	0.000113100	0.000111400	0.000129800	0.000149200	0.000161600	0.000123100	0.000104000	0.000108600	0.000111300
C15H13NO2	239.094644	0.867	0.133	0.07	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028800	0.000020600	0.000025600	0.000031800	0.000029100	0.000025800	0.000026400	0.000020500	0.000027000	0.000020600	0.000021300	0.000000000	0.000026100	0.000036100	0.000020900	0.000032300	0.000023700	0.000000000	0.000025200	0.000023600	0.000027300	0.000041700	0.000028500	0.000025200	0.000039400	0.000033400	0.000031000	0.000038900	0.000039100	0.000023800	0.000027300	0.000043000	0.000042500	0.000022100	0.000025600
C12H17NO2S	239.098082	1.417	0.167	0.08	0.0833	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H17NO4	239.115806	1.417	0.333	0.08	0.0000	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061600	0.000045900	0.000089900	0.000073300	0.000080900	0.000082200	0.000080400	0.000061900	0.000057300	0.000036600	0.000037400	0.000051300	0.000046500	0.000089000	0.000097100	0.000100200	0.000093200	0.000078000	0.000081100	0.000074700	0.000092700	0.000101300	0.000105300	0.000063700	0.000069700	0.000078500	0.000080400	0.000083000	0.000078900	0.000082200	0.000075400	0.000077200	0.000072300	0.000046900	0.000046100
C13H21NO3	239.152131	1.615	0.231	0.08	0.0000	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	1	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000023800	0.000000000	0.000019500	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000021300	0.000022300	0.000000000	0.000019500	0.000020500	0.000021500	0.000018400	0.000018200	0.000021200	0.000026100	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000
C10H8O3S2	239.991522	0.800	0.300	0.00	0.2000	0.0000	0.54	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H8O5S	240.009299	0.800	0.500	0.00	0.1000	0.0000	0.54	7	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000023300	0.000000000	0.000000000	0.000000000	0.000020800	0.000018700	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000018500	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000021800	0.000027300	0.000022100	0.000025400	0.000026400	0.000022900	0.000024400	0.000000000	0.000021900	0.000022900	0.000023400	0.000000000
C10H8O7	240.027061	0.800	0.700	0.00	0.0000	0.0000	0.54	7	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000028000	0.000023000	0.000000000	0.000000000	0.000000000	0.000025000	0.000023800	0.000026300	0.000032200	0.000030300	0.000028200	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000031100	0.000031600	0.000020200	0.000000000	0.000027200	0.000023000	0.000000000	0.000024700	0.000019100	0.000000000	0.000053400	0.000036300	0.000026000	0.000027800	0.000097800	0.000088100
C11H12O2S2	240.027930	1.091	0.182	0.00	0.1818	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000023700	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000033400	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000022000	0.000000000	0.000000000	0.000021700	0.000021400	0.000000000	0.000000000
C14H8O4	240.042306	0.571	0.286	0.00	0.0000	0.0000	0.75	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000074600	0.000084700	0.000053100	0.000076900	0.000054200	0.000056800	0.000060100	0.000076700	0.000089900	0.000085100	0.000070100	0.000106300	0.000059100	0.000046900	0.000094900	0.000059400	0.000048400	0.000073000	0.000044600	0.000074800	0.000051900	0.000094900	0.000044400	0.000077600	0.000069300	0.000062100	0.000061600	0.000052000	0.000043200	0.000156400	0.000103400	0.000085500	0.000068600	0.000155900	0.000152900
C11H12O4S	240.045662	1.091	0.364	0.00	0.0909	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000091400	0.000040100	0.000103500	0.000115300	0.000076800	0.000077500	0.000083400	0.000058200	0.000069000	0.000052100	0.000034000	0.000061900	0.000055600	0.000078200	0.000061400	0.000112700	0.000109300	0.000070100	0.000073500	0.000080300	0.000078500	0.000112800	0.000106400	0.000083300	0.000080100	0.000079700	0.000084600	0.000110200	0.000113100	0.000044800	0.000042600	0.000110300	0.000097600	0.000037400	0.000039000
C13H8N2O3	240.053501	0.615	0.231	0.15	0.0000	0.0000	0.79	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000026700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000020000	0.000000000	0.000000000	0.000000000
C11H12O6	240.063394	1.091	0.545	0.00	0.0000	0.0000	0.38	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000320800	0.000277900	0.000220400	0.000256100	0.000242000	0.000266100	0.000244600	0.000267600	0.000306800	0.000281900	0.000258400	0.000282700	0.000277900	0.000253900	0.000207700	0.000248500	0.000248700	0.000302400	0.000295200	0.000249900	0.000257700	0.000193400	0.000206300	0.000310300	0.000367400	0.000271600	0.000272300	0.000309800	0.000304400	0.000588600	0.000553300	0.000364700	0.000368800	0.000512200	0.000532300
C10H12N2O5	240.074676	1.200	0.500	0.20	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022900	0.000000000	0.000000000	0.000032400	0.000023600	0.000000000	0.000018400	0.000000000	0.000024300	0.000000000	0.000000000	0.000018500	0.000000000	0.000020700	0.000000000	0.000022400	0.000021900	0.000024900	0.000022400	0.000000000	0.000018700	0.000020400	0.000000000	0.000027500	0.000000000	0.000022100	0.000027300	0.000022200	0.000030700	0.000042800	0.000043700	0.000028100	0.000024900	0.000025300	0.000034800
C15H12O3	240.078662	0.800	0.200	0.00	0.0000	0.0000	0.63	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000129100	0.000107000	0.000102300	0.000117900	0.000111400	0.000114900	0.000111800	0.000132600	0.000130500	0.000113200	0.000112200	0.000114200	0.000109200	0.000093300	0.000116600	0.000101300	0.000097100	0.000108700	0.000107400	0.000107600	0.000122900	0.000085800	0.000102200	0.000126500	0.000144000	0.000091000	0.000094000	0.000123500	0.000126400	0.000134700	0.000115800	0.000150600	0.000169900	0.000167200	0.000163500
C12H16O3S	240.082007	1.333	0.250	0.00	0.0833	0.0000	0.26	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000075800	0.000039700	0.000116400	0.000105600	0.000076200	0.000069200	0.000076600	0.000041500	0.000042100	0.000031500	0.000025900	0.000043700	0.000030900	0.000073100	0.000080000	0.000115800	0.000111900	0.000061500	0.000078400	0.000100500	0.000103800	0.000143800	0.000140600	0.000056300	0.000051600	0.000086600	0.000078400	0.000100200	0.000111800	0.000026800	0.000026100	0.000093200	0.000089900	0.000000000	0.000022000
C14H12N2O2	240.089941	0.857	0.143	0.14	0.0000	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000026400	0.000000000	0.000000000	0.000000000	0.000023600	0.000018500	0.000024000	0.000018200	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000018100	0.000018800	0.000021300	0.000021100	0.000021400	0.000000000	0.000027200	0.000000000	0.000000000	0.000021500	0.000029300	0.000000000	0.000000000	0.000000000	0.000025500	0.000019400	0.000000000
C12H16O5	240.099763	1.333	0.417	0.00	0.0000	0.0000	0.26	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000956400	0.001025500	0.001163100	0.001085400	0.001297400	0.001291600	0.001208600	0.001193300	0.001119100	0.001023800	0.000891100	0.001107500	0.000968600	0.001342700	0.001414900	0.001450400	0.001319700	0.001436000	0.001622300	0.001192200	0.001157800	0.001255400	0.001277200	0.001110000	0.001166600	0.001240100	0.001161300	0.001216200	0.001231000	0.001535200	0.001470000	0.001167400	0.001182600	0.001098000	0.001201100
C11H16N2O4	240.111023	1.455	0.364	0.18	0.0000	0.0000	0.14	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000030200	0.000000000	0.000032100	0.000032200	0.000044900	0.000036600	0.000035300	0.000028100	0.000023700	0.000018500	0.000020900	0.000020400	0.000023900	0.000045600	0.000033000	0.000046300	0.000045400	0.000036500	0.000030900	0.000042400	0.000034500	0.000045800	0.000061800	0.000028100	0.000028300	0.000035500	0.000039700	0.000036600	0.000040300	0.000038700	0.000033100	0.000039000	0.000036800	0.000028500	0.000023600
C16H16O2	240.115019	1.000	0.125	0.00	0.0000	0.0000	0.53	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000058000	0.000079400	0.000061100	0.000067600	0.000075800	0.000074500	0.000077800	0.000091200	0.000074200	0.000083900	0.000079100	0.000074900	0.000070300	0.000075700	0.000088400	0.000068600	0.000087000	0.000057800	0.000091400	0.000073000	0.000077900	0.000068400	0.000071700	0.000059900	0.000084000	0.000066400	0.000057600	0.000083600	0.000083100	0.000065100	0.000068200	0.000082600	0.000079400	0.000072200	0.000078700
C13H20O2S	240.118421	1.538	0.154	0.00	0.0769	0.0000	0.18	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020500	0.000000000	0.000019400	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000031100	0.000024800	0.000000000	0.000019100	0.000026200	0.000023800	0.000021800	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000022000	0.000000000	0.000000000	0.000020800	0.000020100	0.000000000	0.000000000
C13H20O4	240.136189	1.538	0.308	0.00	0.0000	0.0000	0.18	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000296200	0.000406000	0.000508300	0.000426000	0.000564400	0.000534700	0.000536600	0.000482100	0.000431000	0.000398800	0.000370700	0.000456900	0.000355700	0.000574400	0.000676700	0.000618000	0.000576700	0.000588900	0.000697000	0.000478000	0.000490100	0.000606600	0.000574400	0.000416800	0.000399400	0.000489500	0.000505800	0.000415500	0.000433300	0.000486200	0.000478200	0.000444100	0.000353800	0.000344900	0.000377400
C17H20O	240.151433	1.176	0.059	0.00	0.0000	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000018000	0.000025300	0.000000000	0.000024800	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000033300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000018700	0.000022500	0.000000000	0.000019500	0.000018700
C14H24O3	240.172592	1.714	0.214	0.00	0.0000	0.0000	0.12	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000022800	0.000028000	0.000019300	0.000025000	0.000025300	0.000030200	0.000023700	0.000022900	0.000000000	0.000000000	0.000022000	0.000000000	0.000041100	0.000052200	0.000047500	0.000040900	0.000031800	0.000048400	0.000026800	0.000031700	0.000033700	0.000034600	0.000026600	0.000000000	0.000026400	0.000034700	0.000023900	0.000028500	0.000022300	0.000021600	0.000025900	0.000024100	0.000000000	0.000029100
C13H7NO4	241.037490	0.538	0.308	0.08	0.0000	0.0000	0.80	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000020700	0.000019400	0.000000000	0.000022300	0.000000000	0.000000000	0.000018000	0.000000000	0.000031800	0.000000000	0.000022500	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000021300	0.000000000	0.000024400	0.000000000	0.000021600	0.000042300	0.000038700	0.000027800	0.000022000	0.000040200	0.000041300
C10H11NO4S	241.040882	1.100	0.400	0.10	0.1000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000041600	0.000020600	0.000028800	0.000043100	0.000025000	0.000024800	0.000031400	0.000000000	0.000000000	0.000000000	0.000020300	0.000019100	0.000000000	0.000035300	0.000022400	0.000039100	0.000040400	0.000025300	0.000000000	0.000030800	0.000031200	0.000045500	0.000039300	0.000026200	0.000021400	0.000030700	0.000029000	0.000052300	0.000046300	0.000000000	0.000000000	0.000032800	0.000038900	0.000000000	0.000000000
C10H11NO6	241.058658	1.100	0.600	0.10	0.0000	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000045000	0.000023400	0.000027900	0.000030300	0.000024700	0.000026900	0.000023500	0.000026100	0.000027300	0.000027700	0.000027500	0.000026600	0.000027300	0.000000000	0.000021000	0.000033700	0.000029200	0.000025300	0.000027000	0.000030300	0.000023500	0.000027200	0.000019400	0.000036900	0.000038800	0.000037400	0.000019400	0.000040000	0.000040400	0.000063200	0.000074800	0.000041400	0.000044400	0.000049000	0.000050300
C14H11NO3	241.073898	0.786	0.214	0.07	0.0000	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000065400	0.000037900	0.000046300	0.000056800	0.000043800	0.000045600	0.000061600	0.000048800	0.000040100	0.000030800	0.000047200	0.000036900	0.000038900	0.000055400	0.000047100	0.000052200	0.000057300	0.000043900	0.000046400	0.000052500	0.000046000	0.000053500	0.000055800	0.000052200	0.000049800	0.000053000	0.000050900	0.000066900	0.000073400	0.000049700	0.000045700	0.000077800	0.000067900	0.000050700	0.000039200
C11H15NO3S	241.077313	1.364	0.273	0.09	0.0909	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000035500	0.000000000	0.000045200	0.000038200	0.000022700	0.000026400	0.000031800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000030200	0.000037300	0.000039900	0.000021800	0.000023400	0.000035200	0.000040000	0.000060100	0.000064800	0.000021500	0.000023400	0.000028500	0.000032800	0.000033500	0.000040100	0.000000000	0.000000000	0.000039500	0.000032600	0.000000000	0.000000000
C11H15NO5	241.095073	1.364	0.455	0.09	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000090200	0.000071600	0.000115200	0.000106700	0.000101100	0.000109600	0.000096300	0.000060200	0.000069700	0.000043500	0.000042000	0.000063300	0.000058800	0.000098700	0.000108000	0.000131600	0.000111600	0.000117400	0.000120200	0.000096000	0.000104200	0.000151100	0.000136800	0.000091000	0.000094700	0.000105300	0.000116900	0.000103500	0.000101000	0.000120000	0.000121900	0.000100900	0.000092500	0.000067000	0.000080000
C15H15NO2	241.110334	1.000	0.133	0.07	0.0000	0.0000	0.54	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019000	0.000000000	0.000019900	0.000023200	0.000026500	0.000024700	0.000024000	0.000000000	0.000026400	0.000022400	0.000000000	0.000019200	0.000018900	0.000028100	0.000037100	0.000028300	0.000036600	0.000023300	0.000028000	0.000022100	0.000021300	0.000034700	0.000031600	0.000022800	0.000000000	0.000022200	0.000028700	0.000032100	0.000039000	0.000000000	0.000021400	0.000039800	0.000029500	0.000000000	0.000000000
C12H19NO4	241.131424	1.583	0.333	0.08	0.0000	0.0000	0.11	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000025600	0.000023500	0.000051700	0.000040500	0.000044200	0.000051900	0.000042900	0.000024100	0.000025900	0.000022400	0.000018600	0.000022800	0.000000000	0.000054400	0.000044100	0.000056200	0.000059300	0.000044800	0.000048900	0.000047500	0.000046900	0.000062600	0.000063900	0.000028300	0.000020900	0.000038900	0.000037200	0.000037700	0.000031000	0.000035300	0.000035200	0.000036000	0.000020200	0.000000000	0.000000000
C10H10O3S2	242.007126	1.000	0.300	0.00	0.2000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020100	0.000000000	0.000025400	0.000024800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000021300	0.000020600	0.000024100	0.000027100	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000028900	0.000000000	0.000000000	0.000027900	0.000024900	0.000000000	0.000000000
C13H6O5	242.021508	0.462	0.385	0.00	0.0000	0.0000	0.81	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000033500	0.000018900	0.000018200	0.000000000	0.000024300	0.000022000	0.000029900	0.000033500	0.000029900	0.000025900	0.000024400	0.000036600	0.000030700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027400	0.000031900	0.000025100	0.000000000	0.000027100	0.000035400	0.000022300	0.000000000	0.000024400	0.000000000	0.000041200	0.000039400	0.000037700	0.000045800	0.000084600	0.000089400
C10H10O5S	242.024905	1.000	0.500	0.00	0.1000	0.0000	0.38	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000067700	0.000044200	0.000063500	0.000062000	0.000042600	0.000064300	0.000051200	0.000037900	0.000041300	0.000041400	0.000028500	0.000037300	0.000039900	0.000047900	0.000048200	0.000063200	0.000065600	0.000051500	0.000052100	0.000053800	0.000056600	0.000053600	0.000071100	0.000052100	0.000064100	0.000063700	0.000052100	0.000066600	0.000071100	0.000052400	0.000041500	0.000064700	0.000062200	0.000041400	0.000033600
C14H10O2S	242.040156	0.714	0.143	0.00	0.0714	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025800	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000025700	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000026400	0.000020400	0.000000000	0.000030000	0.000029900	0.000000000	0.000000000	0.000019500	0.000024500	0.000000000	0.000000000
C10H10O7	242.042680	1.000	0.700	0.00	0.0000	0.0000	0.38	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000052700	0.000036000	0.000030200	0.000030800	0.000035800	0.000038800	0.000038000	0.000042900	0.000060500	0.000047000	0.000041100	0.000040000	0.000051800	0.000029900	0.000021200	0.000021400	0.000018500	0.000033300	0.000031500	0.000046400	0.000050600	0.000000000	0.000000000	0.000053600	0.000053900	0.000030600	0.000030500	0.000036000	0.000038300	0.000131800	0.000109500	0.000060200	0.000052600	0.000124000	0.000129200
C11H14O2S2	242.043552	1.273	0.182	0.00	0.1818	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000026800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000020400	0.000023900	0.000028200	0.000000000	0.000000000	0.000026800	0.000023600	0.000036800	0.000035900	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000024300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H10O4	242.057917	0.714	0.286	0.00	0.0000	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000188900	0.000158700	0.000140000	0.000146500	0.000135000	0.000142600	0.000149300	0.000184200	0.000204100	0.000177200	0.000162800	0.000179800	0.000180300	0.000116700	0.000114700	0.000121200	0.000117300	0.000146000	0.000129800	0.000165600	0.000150000	0.000125700	0.000111100	0.000183200	0.000204200	0.000127000	0.000138600	0.000149900	0.000163600	0.000238900	0.000212500	0.000210400	0.000206400	0.000280300	0.000280100
C11H14O4S	242.061323	1.273	0.364	0.00	0.0909	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000080100	0.000032900	0.000095000	0.000108200	0.000072900	0.000074700	0.000067800	0.000046200	0.000047000	0.000031800	0.000025600	0.000039000	0.000039100	0.000069100	0.000068400	0.000116600	0.000110700	0.000068000	0.000071700	0.000077700	0.000085500	0.000123200	0.000114400	0.000064800	0.000060500	0.000083000	0.000075500	0.000087200	0.000106300	0.000020900	0.000023800	0.000091500	0.000075700	0.000025800	0.000027800
C13H10N2O3	242.069136	0.769	0.231	0.15	0.0000	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000032600	0.000030100	0.000024400	0.000025500	0.000031300	0.000024500	0.000020600	0.000024400	0.000027400	0.000000000	0.000024800	0.000025500	0.000020800	0.000023700	0.000021500	0.000030200	0.000029200	0.000027000	0.000020600	0.000026300	0.000021200	0.000025200	0.000029300	0.000027300	0.000024700	0.000000000	0.000027200	0.000034500	0.000036800	0.000037600	0.000027100	0.000035600	0.000043500	0.000024600	0.000037300
C11H14O6	242.079089	1.273	0.545	0.00	0.0000	0.0000	0.25	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000405700	0.000421500	0.000402600	0.000449700	0.000451200	0.000484100	0.000446400	0.000429500	0.000489800	0.000426200	0.000358100	0.000427800	0.000412600	0.000505300	0.000453700	0.000542300	0.000525000	0.000570100	0.000606900	0.000425900	0.000429100	0.000400700	0.000437300	0.000499400	0.000528700	0.000495500	0.000480800	0.000506400	0.000503600	0.000965500	0.000863200	0.000520300	0.000460400	0.000570200	0.000588200
C10H14N2O5	242.090274	1.400	0.500	0.20	0.0000	0.0000	0.09	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000019100	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000019400	0.000000000	0.000024800	0.000000000	0.000024700	0.000022200	0.000000000	0.000024600	0.000018500	0.000022700	0.000033700	0.000024900	0.000030300	0.000023800	0.000018100	0.000020800	0.000025200	0.000036000	0.000037000	0.000034500	0.000023900	0.000026900	0.000000000	0.000019000
C15H14O3	242.094342	0.933	0.200	0.00	0.0000	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000134500	0.000140100	0.000133300	0.000145100	0.000158200	0.000148100	0.000140800	0.000158600	0.000170400	0.000159400	0.000155000	0.000172900	0.000144900	0.000155000	0.000159100	0.000149500	0.000145400	0.000146800	0.000150100	0.000148500	0.000144800	0.000152500	0.000137500	0.000151600	0.000159400	0.000134900	0.000132100	0.000144600	0.000157800	0.000140700	0.000134900	0.000184800	0.000147700	0.000158800	0.000161900
C12H18O3S	242.097709	1.500	0.250	0.00	0.0833	0.0000	0.16	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000036100	0.000019700	0.000048600	0.000046900	0.000044200	0.000039600	0.000029900	0.000019800	0.000000000	0.000020100	0.000000000	0.000021800	0.000000000	0.000033800	0.000042300	0.000056900	0.000057400	0.000035500	0.000038800	0.000037300	0.000043600	0.000064500	0.000064900	0.000027000	0.000000000	0.000031700	0.000037700	0.000045600	0.000055900	0.000000000	0.000019400	0.000043500	0.000028300	0.000000000	0.000000000
C14H14N2O2	242.105520	1.000	0.143	0.14	0.0000	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024700	0.000026800	0.000030600	0.000031900	0.000023300	0.000029600	0.000026400	0.000028800	0.000034400	0.000031000	0.000023900	0.000030900	0.000023100	0.000032900	0.000026000	0.000028200	0.000033100	0.000022900	0.000033300	0.000025600	0.000025100	0.000041500	0.000034600	0.000035800	0.000028400	0.000023100	0.000021700	0.000028900	0.000034200	0.000025900	0.000028800	0.000043800	0.000038900	0.000000000	0.000025600
C12H18O5	242.115447	1.500	0.417	0.00	0.0000	0.0000	0.16	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000473800	0.000602300	0.000816300	0.000676500	0.000880000	0.000874500	0.000813400	0.000687700	0.000639800	0.000555400	0.000473800	0.000655800	0.000533500	0.000859100	0.000985300	0.001004200	0.000897900	0.000948600	0.001123800	0.000757900	0.000751600	0.000922800	0.000920500	0.000613500	0.000642100	0.000797700	0.000773700	0.000690400	0.000696200	0.000884700	0.000807400	0.000634000	0.000571000	0.000531100	0.000605000
C16H18O2	242.130720	1.125	0.125	0.00	0.0000	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000060100	0.000089200	0.000069000	0.000074900	0.000080200	0.000079700	0.000086900	0.000100500	0.000101100	0.000094500	0.000091000	0.000103900	0.000077100	0.000090300	0.000102600	0.000082800	0.000071400	0.000091400	0.000099200	0.000075000	0.000078400	0.000076700	0.000076500	0.000074900	0.000083300	0.000081200	0.000090100	0.000071300	0.000072600	0.000076900	0.000065300	0.000084100	0.000064100	0.000070700	0.000083400
C13H22O2S	242.134059	1.692	0.154	0.00	0.0769	0.0000	0.09	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H22O4	242.151800	1.692	0.308	0.00	0.0000	0.0000	0.09	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000070700	0.000088700	0.000131700	0.000103200	0.000160100	0.000148200	0.000138200	0.000104400	0.000093400	0.000084800	0.000069800	0.000101400	0.000077100	0.000144900	0.000166400	0.000154700	0.000134400	0.000147000	0.000190800	0.000135300	0.000133300	0.000178600	0.000175700	0.000096900	0.000093600	0.000114600	0.000112200	0.000110600	0.000117500	0.000125500	0.000111100	0.000100800	0.000093900	0.000095100	0.000095000
C17H22O	242.167079	1.294	0.059	0.00	0.0000	0.0000	0.39	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000017900	0.000000000	0.000018800	0.000023800	0.000000000	0.000019100	0.000026800	0.000019900	0.000020900	0.000019000	0.000000000	0.000021700	0.000022200	0.000023400	0.000023000	0.000028100	0.000000000	0.000028500	0.000019000	0.000021200	0.000000000	0.000020300	0.000023400	0.000025300	0.000000000	0.000020900	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000019300	0.000000000
C15H30O2	242.224611	2.000	0.133	0.00	0.0000	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000023700	0.000000000	0.000025400	0.000000000	0.000018200	0.000038700	0.000000000	0.000026600	0.000026400	0.000020000	0.000000000	0.000035000	0.000000000	0.000000000	0.000021500	0.000017900	0.000000000	0.000000000	0.000000000	0.000045500	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000039000	0.000000000	0.000028200	0.000042100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H9NO5S	243.020151	1.000	0.556	0.11	0.1111	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019500	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000021500	0.000019200	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000019400	0.000020300	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000
C13H9NO4	243.053156	0.692	0.308	0.08	0.0000	0.0000	0.70	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000066600	0.000044400	0.000047700	0.000052500	0.000042400	0.000038200	0.000046900	0.000040300	0.000055200	0.000038700	0.000034900	0.000037700	0.000041300	0.000040800	0.000042900	0.000047400	0.000046600	0.000047300	0.000039100	0.000035400	0.000041100	0.000053800	0.000040900	0.000054700	0.000065300	0.000044700	0.000030000	0.000060200	0.000065300	0.000050000	0.000046600	0.000081900	0.000069600	0.000062500	0.000062200
C10H13NO4S	243.056563	1.300	0.400	0.10	0.1000	0.0000	0.17	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025000	0.000018200	0.000043200	0.000040200	0.000024000	0.000022000	0.000027300	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000025100	0.000047600	0.000041900	0.000033000	0.000029600	0.000037800	0.000027600	0.000049100	0.000041500	0.000000000	0.000023100	0.000029600	0.000034900	0.000038500	0.000032600	0.000000000	0.000000000	0.000032400	0.000026400	0.000000000	0.000000000
C10H13NO6	243.074341	1.300	0.600	0.10	0.0000	0.0000	0.17	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000041800	0.000030400	0.000027500	0.000042400	0.000031900	0.000031500	0.000025400	0.000026700	0.000035900	0.000026000	0.000019300	0.000030900	0.000032300	0.000040200	0.000028200	0.000036500	0.000037700	0.000049900	0.000035900	0.000027600	0.000032500	0.000032200	0.000030700	0.000038800	0.000051600	0.000032600	0.000037000	0.000047300	0.000044800	0.000086200	0.000074600	0.000045000	0.000047400	0.000053900	0.000043300
C14H13NO3	243.089582	0.929	0.214	0.07	0.0000	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000065600	0.000049600	0.000069100	0.000067000	0.000065800	0.000065300	0.000071400	0.000044200	0.000060600	0.000044700	0.000040300	0.000060000	0.000040200	0.000065000	0.000070500	0.000081900	0.000078200	0.000060000	0.000057200	0.000062400	0.000061600	0.000082300	0.000077900	0.000050700	0.000059500	0.000062200	0.000061500	0.000078800	0.000090300	0.000050300	0.000046200	0.000088200	0.000074800	0.000042200	0.000045000
C11H17NO3S	243.092981	1.545	0.273	0.09	0.0909	0.0000	0.07	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000034900	0.000032200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000020300	0.000000000	0.000024300	0.000018600	0.000040000	0.000033500	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000
C11H17NO5	243.110710	1.545	0.455	0.09	0.0000	0.0000	0.07	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000034500	0.000027600	0.000068100	0.000052500	0.000064600	0.000056600	0.000065000	0.000038000	0.000037900	0.000029300	0.000023300	0.000028300	0.000021200	0.000052200	0.000065600	0.000076500	0.000069600	0.000064100	0.000073000	0.000064300	0.000060600	0.000095300	0.000097500	0.000039900	0.000043600	0.000064900	0.000060800	0.000057300	0.000060100	0.000065500	0.000056000	0.000043500	0.000035300	0.000030400	0.000031000
C15H17NO2	243.125981	1.133	0.133	0.07	0.0000	0.0000	0.46	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000019700	0.000025300	0.000026700	0.000000000	0.000025700	0.000025100	0.000024300	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000030300	0.000023700	0.000030100	0.000025000	0.000026900	0.000000000	0.000023800	0.000029100	0.000028300	0.000023300	0.000023900	0.000022800	0.000020500	0.000037800	0.000021600	0.000025600	0.000020500	0.000026100	0.000026300	0.000000000	0.000000000
C12H21NO4	243.147044	1.750	0.333	0.08	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H8O3S	244.019442	0.615	0.231	0.00	0.0769	0.0000	0.71	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000027300	0.000000000	0.000000000	0.000019500	0.000024000	0.000000000	0.000000000	0.000019200	0.000000000	0.000019400	0.000000000	0.000020000	0.000000000	0.000019700	0.000020100	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000021000	0.000021500	0.000000000	0.000020100	0.000035500	0.000041000	0.000000000	0.000000000	0.000028200	0.000039500	0.000000000	0.000000000
C10H12O3S2	244.022781	1.200	0.300	0.00	0.2000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022600	0.000000000	0.000034900	0.000027500	0.000023000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031200	0.000024800	0.000000000	0.000000000	0.000031100	0.000041200	0.000044900	0.000044000	0.000000000	0.000023500	0.000018600	0.000020700	0.000025000	0.000031500	0.000000000	0.000000000	0.000027100	0.000027600	0.000000000	0.000000000
C13H8O5	244.037192	0.615	0.385	0.00	0.0000	0.0000	0.71	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000134700	0.000109100	0.000082500	0.000079000	0.000073700	0.000083300	0.000085600	0.000104800	0.000127000	0.000109600	0.000104600	0.000113600	0.000104900	0.000049700	0.000040300	0.000057000	0.000048400	0.000077500	0.000059200	0.000106700	0.000106600	0.000051000	0.000043800	0.000108000	0.000114700	0.000067500	0.000072300	0.000085100	0.000088900	0.000133200	0.000119700	0.000145000	0.000153200	0.000260900	0.000252800
C10H12O5S	244.040533	1.200	0.500	0.00	0.1000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000080900	0.000052500	0.000105800	0.000126300	0.000083500	0.000080700	0.000084100	0.000052800	0.000061400	0.000041600	0.000044000	0.000041800	0.000040200	0.000087800	0.000071100	0.000119000	0.000119500	0.000088500	0.000092400	0.000114400	0.000104300	0.000143900	0.000132400	0.000079100	0.000082000	0.000094600	0.000090200	0.000134000	0.000116200	0.000075000	0.000057000	0.000097700	0.000104200	0.000040500	0.000040700
C12H8N2O4	244.048442	0.667	0.333	0.17	0.0000	0.0000	0.75	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022700	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000021200	0.000022600	0.000000000	0.000022200	0.000020000	0.000021400	0.000021000
C14H12O2S	244.055803	0.857	0.143	0.00	0.0714	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000033700	0.000000000	0.000033600	0.000049300	0.000025800	0.000036100	0.000025600	0.000018100	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000027900	0.000042700	0.000041900	0.000023900	0.000022300	0.000027700	0.000025500	0.000043100	0.000032200	0.000020600	0.000027000	0.000026700	0.000022400	0.000043100	0.000048400	0.000000000	0.000000000	0.000041400	0.000042600	0.000000000	0.000000000
C10H12O7	244.058294	1.200	0.700	0.00	0.0000	0.0000	0.23	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000117200	0.000096900	0.000070000	0.000084400	0.000071500	0.000089200	0.000080600	0.000096000	0.000115600	0.000110500	0.000091800	0.000086200	0.000087500	0.000087400	0.000055700	0.000081800	0.000075600	0.000120700	0.000093600	0.000085700	0.000086500	0.000057800	0.000063800	0.000104800	0.000136200	0.000108100	0.000083000	0.000111100	0.000109800	0.000369600	0.000273800	0.000128300	0.000148200	0.000242700	0.000236900
C11H16O2S2	244.059174	1.455	0.182	0.00	0.1818	0.0000	0.12	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020300	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000020200	0.000021400	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H12O4	244.073554	0.857	0.286	0.00	0.0000	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000353500	0.000291100	0.000282900	0.000304200	0.000292900	0.000278700	0.000279600	0.000320100	0.000310700	0.000312800	0.000295400	0.000285100	0.000293500	0.000253500	0.000244900	0.000269500	0.000247100	0.000278400	0.000258500	0.000284700	0.000299900	0.000279500	0.000253300	0.000338200	0.000352300	0.000270100	0.000270600	0.000316000	0.000323600	0.000318400	0.000325300	0.000375900	0.000396000	0.000394800	0.000402400
C11H16O4S	244.076921	1.455	0.364	0.00	0.0909	0.0000	0.12	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000077800	0.000037200	0.000108300	0.000111800	0.000089400	0.000088000	0.000082300	0.000052800	0.000056900	0.000031700	0.000035100	0.000054500	0.000028300	0.000083000	0.000088700	0.000129000	0.000107100	0.000074900	0.000080100	0.000109400	0.000095300	0.000141800	0.000138300	0.000061900	0.000055600	0.000086400	0.000075800	0.000110600	0.000106300	0.000022900	0.000027000	0.000101100	0.000082200	0.000021200	0.000022900
C13H12N2O3	244.084848	0.923	0.231	0.15	0.0000	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000040000	0.000029200	0.000030600	0.000036400	0.000035000	0.000029600	0.000029700	0.000032800	0.000037100	0.000033200	0.000039000	0.000028100	0.000034100	0.000035000	0.000028800	0.000038500	0.000039000	0.000029000	0.000033000	0.000026000	0.000033400	0.000038600	0.000037000	0.000039800	0.000041200	0.000029500	0.000026100	0.000050300	0.000041700	0.000043800	0.000040700	0.000047200	0.000048100	0.000035700	0.000032700
C11H16O6	244.094685	1.455	0.545	0.00	0.0000	0.0000	0.12	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000438900	0.000478600	0.000532100	0.000537500	0.000577600	0.000588800	0.000557500	0.000491700	0.000513500	0.000460100	0.000394500	0.000472000	0.000440700	0.000619000	0.000603200	0.000743800	0.000665600	0.000759900	0.000847600	0.000564500	0.000543700	0.000585500	0.000594300	0.000567500	0.000593400	0.000646400	0.000601700	0.000598900	0.000589500	0.001138900	0.000994100	0.000545600	0.000510900	0.000611800	0.000627500
C15H16O3	244.109934	1.067	0.200	0.00	0.0000	0.0000	0.48	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000233800	0.000301500	0.000271700	0.000264400	0.000322400	0.000298500	0.000304500	0.000356700	0.000317400	0.000337300	0.000313000	0.000330600	0.000281700	0.000322100	0.000346400	0.000300000	0.000279000	0.000299300	0.000337700	0.000303100	0.000288200	0.000308400	0.000289500	0.000280800	0.000275600	0.000276400	0.000274900	0.000261400	0.000268300	0.000231400	0.000229200	0.000292600	0.000270300	0.000271700	0.000286500
C12H20O3S	244.113325	1.667	0.250	0.00	0.0833	0.0000	0.05	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000018700	0.000019700	0.000000000	0.000029900	0.000019600	0.000030600	0.000035400	0.000028800	0.000000000	0.000023000	0.000023000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H16N2O2	244.121202	1.143	0.143	0.14	0.0000	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000026900	0.000022800	0.000026400	0.000032000	0.000024800	0.000026500	0.000028300	0.000000000	0.000024300	0.000000000	0.000027100	0.000029900	0.000000000	0.000025100	0.000032800	0.000033700	0.000037100	0.000025700	0.000026900	0.000025400	0.000021000	0.000030600	0.000032400	0.000034600	0.000023800	0.000027100	0.000029200	0.000029400	0.000030000	0.000028900	0.000026800	0.000039700	0.000029500	0.000019500	0.000021200
C12H20O5	244.131092	1.667	0.417	0.00	0.0000	0.0000	0.05	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000094900	0.000119400	0.000198500	0.000157900	0.000210800	0.000197600	0.000181000	0.000146800	0.000135000	0.000111000	0.000105900	0.000128400	0.000107600	0.000195600	0.000230700	0.000228300	0.000211500	0.000232800	0.000275500	0.000183600	0.000181800	0.000230000	0.000212600	0.000135600	0.000126700	0.000188700	0.000190600	0.000149400	0.000149700	0.000189500	0.000165200	0.000132700	0.000111800	0.000124300	0.000123400
C16H20O2	244.146332	1.250	0.125	0.00	0.0000	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000086200	0.000130900	0.000094500	0.000101300	0.000112500	0.000122000	0.000118600	0.000148900	0.000134000	0.000147100	0.000130700	0.000139000	0.000127300	0.000122800	0.000172100	0.000122800	0.000123900	0.000125300	0.000165800	0.000107000	0.000108600	0.000110900	0.000106400	0.000113100	0.000115800	0.000113800	0.000102100	0.000101500	0.000113000	0.000092400	0.000094000	0.000115000	0.000101200	0.000095500	0.000107200
C13H24O4	244.167481	1.846	0.308	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000020500	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H24O	244.182750	1.412	0.059	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000020000	0.000000000	0.000021700	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H7NO3S	245.014649	0.583	0.250	0.08	0.0833	0.0000	0.76	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000022300	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000
C12H7NO5	245.032432	0.583	0.417	0.08	0.0000	0.0000	0.76	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000026800	0.000020400	0.000020200	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000018900	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000020700	0.000000000	0.000000000	0.000000000	0.000020900	0.000018200	0.000028900	0.000031900	0.000028800	0.000031900	0.000036600
C9H11NO5S	245.035858	1.222	0.556	0.11	0.1111	0.0000	0.11	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019300	0.000000000	0.000000000	0.000026500	0.000000000	0.000023800	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000018300	0.000000000	0.000000000	0.000022000	0.000023700	0.000031700	0.000037100	0.000000000	0.000021100	0.000021600	0.000019300	0.000032900	0.000023200	0.000000000	0.000000000	0.000027000	0.000000000	0.000000000	0.000000000
C13H11NO2S	245.051084	0.846	0.154	0.08	0.0769	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000042800	0.000020000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000019100	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000019000	0.000000000	0.000000000	0.000018500	0.000022500	0.000034300	0.000000000	0.000000000	0.000027600	0.000022600	0.000000000	0.000000000
C13H11NO4	245.068846	0.846	0.308	0.08	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000096700	0.000059400	0.000082700	0.000092900	0.000065800	0.000080100	0.000079300	0.000051300	0.000064300	0.000060300	0.000063400	0.000056500	0.000063400	0.000074500	0.000070700	0.000083600	0.000089800	0.000072600	0.000061400	0.000078100	0.000086100	0.000094600	0.000087500	0.000088600	0.000085900	0.000069700	0.000071400	0.000099900	0.000102900	0.000070300	0.000075800	0.000108200	0.000097200	0.000074600	0.000070000
C10H15NO4S	245.072227	1.500	0.400	0.10	0.1000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000036700	0.000032300	0.000000000	0.000025300	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000028500	0.000032000	0.000024800	0.000030900	0.000026800	0.000028300	0.000047800	0.000050000	0.000000000	0.000000000	0.000030100	0.000018500	0.000025600	0.000024600	0.000021000	0.000000000	0.000031300	0.000021800	0.000000000	0.000000000
C12H11N3O3	245.080149	0.917	0.250	0.25	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H15NO6	245.089997	1.500	0.600	0.10	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	1	0	0	0	0	0.000020700	0.000017900	0.000023600	0.000023700	0.000025500	0.000024200	0.000020000	0.000019300	0.000000000	0.000000000	0.000000000	0.000024300	0.000000000	0.000036200	0.000000000	0.000018600	0.000028000	0.000024000	0.000027400	0.000021700	0.000019000	0.000025000	0.000028800	0.000026300	0.000000000	0.000024800	0.000026500	0.000025900	0.000024100	0.000043900	0.000036900	0.000033800	0.000022100	0.000028900	0.000024200
C14H15NO3	245.105245	1.071	0.214	0.07	0.0000	0.0000	0.48	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000075400	0.000049800	0.000082300	0.000088800	0.000078300	0.000086600	0.000079700	0.000057500	0.000048900	0.000045500	0.000050000	0.000060100	0.000051300	0.000069200	0.000077400	0.000084800	0.000080800	0.000069800	0.000065300	0.000066700	0.000079000	0.000105900	0.000099900	0.000063200	0.000071200	0.000072200	0.000074000	0.000079200	0.000088000	0.000064300	0.000056000	0.000101300	0.000069800	0.000047300	0.000050600
C11H19NO5	245.126330	1.727	0.455	0.09	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000
C15H19NO2	245.141620	1.267	0.133	0.07	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019000	0.000000000	0.000000000	0.000000000	0.000029300	0.000000000	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000020200	0.000000000	0.000023000	0.000037200	0.000000000	0.000028200	0.000000000	0.000019400	0.000000000	0.000024700	0.000028400	0.000023300	0.000023400	0.000000000	0.000000000	0.000021300	0.000000000	0.000023000	0.000000000	0.000024900	0.000022800	0.000000000	0.000000000	0.000000000
C12H6O4S	245.998756	0.500	0.333	0.00	0.0833	0.0000	0.78	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000018400	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000018100	0.000022500	0.000000000	0.000020000
C9H10O4S2	246.002110	1.111	0.444	0.00	0.2222	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000020400	0.000031900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025700	0.000024300	0.000030100	0.000027600	0.000000000	0.000000000	0.000000000	0.000000000	0.000028700	0.000024200	0.000000000	0.000000000	0.000030300	0.000000000	0.000000000	0.000000000
C12H6O6	246.016484	0.500	0.500	0.00	0.0000	0.0000	0.78	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000044600	0.000033700	0.000024700	0.000021900	0.000024100	0.000032000	0.000025100	0.000041200	0.000036700	0.000042100	0.000038800	0.000036900	0.000034700	0.000000000	0.000000000	0.000000000	0.000019100	0.000024200	0.000000000	0.000038000	0.000037000	0.000000000	0.000000000	0.000023300	0.000035400	0.000000000	0.000020200	0.000020100	0.000025100	0.000050500	0.000043400	0.000046000	0.000044200	0.000119600	0.000107400
C9H10O6S	246.019860	1.111	0.667	0.00	0.1111	0.0000	0.20	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000025900	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030400	0.000000000	0.000000000	0.000020800	0.000025100	0.000023200	0.000019200	0.000000000	0.000000000	0.000018500	0.000000000	0.000019800	0.000025000	0.000000000	0.000022000	0.000024100	0.000028900	0.000026000	0.000000000	0.000019000	0.000024500	0.000000000	0.000000000
C13H10O3S	246.035118	0.769	0.231	0.00	0.0769	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000049500	0.000000000	0.000040200	0.000080400	0.000048100	0.000037600	0.000042000	0.000032200	0.000040400	0.000021700	0.000024400	0.000026900	0.000023500	0.000033400	0.000040000	0.000059700	0.000047200	0.000035700	0.000043400	0.000040900	0.000047300	0.000050200	0.000049600	0.000038200	0.000045700	0.000036200	0.000039000	0.000063400	0.000068900	0.000000000	0.000000000	0.000080900	0.000057900	0.000000000	0.000000000
C9H10O8	246.037523	1.111	0.889	0.00	0.0000	0.0000	0.20	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000025400	0.000021200
C10H14O3S2	246.038491	1.400	0.300	0.00	0.2000	0.0000	0.08	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000028700	0.000024400	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000025600	0.000025500	0.000000000	0.000000000	0.000019300	0.000024900	0.000036600	0.000035500	0.000020400	0.000000000	0.000018300	0.000020100	0.000022000	0.000020900	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000
C13H10O5	246.052875	0.769	0.385	0.00	0.0000	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000236800	0.000205500	0.000181800	0.000160700	0.000177200	0.000158000	0.000163700	0.000203500	0.000225200	0.000213000	0.000206400	0.000199100	0.000215300	0.000135500	0.000113400	0.000136200	0.000139600	0.000184100	0.000145800	0.000181200	0.000202500	0.000129200	0.000117600	0.000223600	0.000226200	0.000178600	0.000188600	0.000171300	0.000169000	0.000245100	0.000242000	0.000257700	0.000227400	0.000363500	0.000352600
C10H14O5S	246.056230	1.400	0.500	0.00	0.1000	0.0000	0.08	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000060800	0.000048000	0.000097900	0.000098100	0.000068200	0.000073800	0.000076000	0.000053200	0.000059500	0.000042800	0.000036900	0.000050300	0.000045300	0.000079500	0.000077300	0.000106500	0.000112300	0.000079400	0.000089000	0.000091600	0.000091400	0.000122900	0.000122200	0.000067300	0.000073000	0.000098700	0.000083500	0.000111000	0.000098500	0.000051800	0.000039000	0.000091500	0.000071300	0.000029900	0.000026000
C12H10N2O4	246.064050	0.833	0.333	0.17	0.0000	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000050200	0.000030300	0.000028900	0.000038200	0.000035500	0.000039000	0.000035500	0.000038600	0.000035200	0.000033600	0.000027900	0.000033000	0.000040700	0.000026000	0.000034300	0.000039700	0.000035500	0.000035300	0.000036200	0.000031500	0.000036200	0.000041200	0.000037000	0.000039900	0.000049900	0.000049000	0.000041100	0.000047500	0.000049100	0.000056500	0.000048700	0.000055000	0.000061600	0.000048400	0.000050000
C14H14O2S	246.071503	1.000	0.143	0.00	0.0714	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027100	0.000026900	0.000021600	0.000047800	0.000024300	0.000028000	0.000025500	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000021000	0.000028200	0.000031300	0.000045300	0.000033300	0.000027800	0.000031100	0.000028700	0.000022400	0.000030700	0.000034200	0.000020700	0.000024100	0.000029400	0.000021600	0.000044800	0.000041900	0.000000000	0.000000000	0.000043500	0.000031100	0.000000000	0.000000000
C10H14O7	246.073976	1.400	0.700	0.00	0.0000	0.0000	0.08	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000064000	0.000069000	0.000055600	0.000066100	0.000061100	0.000071900	0.000068500	0.000060900	0.000096700	0.000063300	0.000046500	0.000068600	0.000067300	0.000068600	0.000048300	0.000071800	0.000059100	0.000103500	0.000088900	0.000072300	0.000061900	0.000053500	0.000054500	0.000081700	0.000097400	0.000081400	0.000073100	0.000074900	0.000075200	0.000233900	0.000181800	0.000081000	0.000082100	0.000127800	0.000114200
C14H14O4	246.089251	1.000	0.286	0.00	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000397900	0.000416000	0.000410900	0.000408200	0.000419000	0.000409100	0.000401000	0.000426900	0.000432500	0.000434000	0.000391100	0.000441700	0.000396700	0.000394400	0.000412000	0.000405000	0.000408300	0.000425300	0.000407300	0.000388300	0.000392200	0.000422300	0.000397300	0.000417200	0.000416600	0.000421000	0.000422000	0.000385600	0.000398900	0.000377800	0.000370100	0.000453200	0.000400900	0.000401100	0.000420200
C11H18O4S	246.092590	1.636	0.364	0.00	0.0909	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000038500	0.000000000	0.000085100	0.000058100	0.000061800	0.000060300	0.000074200	0.000027400	0.000031100	0.000022700	0.000000000	0.000019100	0.000027100	0.000054800	0.000064000	0.000076800	0.000068900	0.000043400	0.000047100	0.000077100	0.000076300	0.000104400	0.000102000	0.000038700	0.000044500	0.000059900	0.000058700	0.000064300	0.000066800	0.000000000	0.000000000	0.000051400	0.000043400	0.000000000	0.000000000
C13H14N2O3	246.100457	1.077	0.231	0.15	0.0000	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000066700	0.000046400	0.000053200	0.000060800	0.000053600	0.000045700	0.000052100	0.000045900	0.000052600	0.000039000	0.000044800	0.000051600	0.000030700	0.000062600	0.000058500	0.000064200	0.000058700	0.000058400	0.000057400	0.000044400	0.000053000	0.000067600	0.000064700	0.000059300	0.000053900	0.000059700	0.000052900	0.000061300	0.000069900	0.000078000	0.000073100	0.000068400	0.000061600	0.000058600	0.000055500
C11H18O6	246.110343	1.636	0.545	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000089100	0.000121500	0.000153500	0.000128400	0.000148800	0.000155400	0.000146600	0.000114700	0.000106600	0.000100200	0.000079700	0.000112300	0.000099400	0.000142800	0.000151000	0.000198400	0.000182100	0.000208400	0.000218900	0.000149800	0.000142300	0.000166300	0.000170100	0.000130400	0.000120800	0.000169300	0.000158400	0.000139500	0.000146500	0.000257600	0.000243500	0.000118000	0.000102200	0.000142200	0.000165400
C15H18O3	246.125627	1.200	0.200	0.00	0.0000	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000266700	0.000365500	0.000308200	0.000305100	0.000373500	0.000347200	0.000348200	0.000429900	0.000400000	0.000420200	0.000393600	0.000405700	0.000339400	0.000361900	0.000424600	0.000374800	0.000351700	0.000366800	0.000407600	0.000321000	0.000318900	0.000334700	0.000321400	0.000315400	0.000306400	0.000339800	0.000336800	0.000292200	0.000290100	0.000247500	0.000262800	0.000321800	0.000286600	0.000298600	0.000306200
C14H18N2O2	246.136864	1.286	0.143	0.14	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023400	0.000000000	0.000000000	0.000020200	0.000023600	0.000024900	0.000021400	0.000021400	0.000000000	0.000018700	0.000000000	0.000021600	0.000000000	0.000026400	0.000023300	0.000020700	0.000030800	0.000000000	0.000021500	0.000023400	0.000018900	0.000027500	0.000031000	0.000000000	0.000020100	0.000000000	0.000018400	0.000025500	0.000025000	0.000027700	0.000029200	0.000034600	0.000020300	0.000000000	0.000000000
C12H22O5	246.146716	1.833	0.417	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000022300	0.000000000	0.000023200	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033500	0.000026600	0.000018000	0.000019900	0.000022400	0.000000000	0.000000000	0.000026700	0.000019400	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000022000	0.000022200	0.000000000	0.000000000	0.000024500
C16H22O2	246.161993	1.375	0.125	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000076800	0.000110200	0.000091800	0.000085500	0.000105500	0.000102400	0.000102200	0.000137500	0.000116200	0.000136900	0.000120000	0.000133200	0.000103500	0.000119000	0.000150500	0.000115200	0.000117100	0.000120900	0.000133000	0.000092400	0.000090900	0.000101400	0.000099300	0.000092500	0.000108300	0.000105800	0.000102400	0.000104700	0.000105500	0.000085400	0.000085800	0.000096200	0.000090300	0.000089900	0.000089300
C12H9NO3S	247.030379	0.750	0.250	0.08	0.0833	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000027300	0.000000000	0.000000000	0.000031300	0.000000000	0.000022700	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000021000	0.000018100	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000019400	0.000000000	0.000027400	0.000029500	0.000030400	0.000000000	0.000000000	0.000039900	0.000027200	0.000000000	0.000000000
C12H9NO5	247.048116	0.750	0.417	0.08	0.0000	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000051500	0.000035900	0.000033800	0.000042900	0.000040500	0.000038700	0.000043700	0.000039800	0.000048300	0.000028700	0.000035200	0.000038500	0.000035400	0.000035300	0.000027200	0.000035300	0.000040700	0.000040200	0.000031500	0.000032200	0.000042700	0.000036100	0.000039700	0.000048300	0.000054900	0.000033200	0.000038000	0.000051700	0.000036600	0.000049900	0.000053000	0.000051100	0.000056900	0.000061300	0.000063100
C9H13NO5S	247.051447	1.444	0.556	0.11	0.1111	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000024300	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000000000	0.000018800	0.000021100	0.000018300	0.000027700	0.000037200	0.000000000	0.000018800	0.000025000	0.000000000	0.000026900	0.000033900	0.000000000	0.000000000	0.000018900	0.000020900	0.000000000	0.000000000
C13H13NO2S	247.066747	1.000	0.154	0.08	0.0769	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023900	0.000000000	0.000019600	0.000029400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000023700	0.000035300	0.000023700	0.000000000	0.000000000	0.000000000	0.000021900	0.000039000	0.000030200	0.000000000	0.000000000	0.000000000	0.000027900	0.000032400	0.000037900	0.000000000	0.000000000	0.000028900	0.000018700	0.000000000	0.000000000
C13H13NO4	247.084495	1.000	0.308	0.08	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000140300	0.000080600	0.000118200	0.000145600	0.000110400	0.000111600	0.000107600	0.000085700	0.000097700	0.000078400	0.000063400	0.000098500	0.000082300	0.000124100	0.000113000	0.000130300	0.000137000	0.000102400	0.000098900	0.000108200	0.000113800	0.000144200	0.000129900	0.000121000	0.000112700	0.000114700	0.000138000	0.000139400	0.000139000	0.000121200	0.000101300	0.000154800	0.000135300	0.000089300	0.000099400
C12H13N3O3	247.095735	1.083	0.250	0.25	0.0000	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000
C14H17NO3	247.120870	1.214	0.214	0.07	0.0000	0.0000	0.39	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000072600	0.000058700	0.000083700	0.000090400	0.000082700	0.000075600	0.000077600	0.000065500	0.000064200	0.000051900	0.000046500	0.000051600	0.000052700	0.000074600	0.000092900	0.000095700	0.000091700	0.000070500	0.000074300	0.000076800	0.000085600	0.000108400	0.000102300	0.000068400	0.000075000	0.000081500	0.000077700	0.000085900	0.000087300	0.000068300	0.000066900	0.000075800	0.000080300	0.000051100	0.000049700
C15H21NO2	247.157236	1.400	0.133	0.07	0.0000	0.0000	0.31	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000021600	0.000000000	0.000020300	0.000000000	0.000022800	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000
C12H8O4S	248.014369	0.667	0.333	0.00	0.0833	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000035100	0.000019600	0.000023600	0.000047500	0.000033700	0.000028800	0.000018600	0.000020600	0.000031700	0.000000000	0.000000000	0.000021100	0.000022700	0.000019100	0.000000000	0.000034200	0.000032100	0.000000000	0.000019900	0.000022700	0.000022500	0.000031900	0.000028500	0.000038100	0.000037000	0.000033700	0.000022100	0.000045300	0.000041300	0.000000000	0.000000000	0.000045200	0.000044000	0.000000000	0.000021000
C9H12O4S2	248.017759	1.333	0.444	0.00	0.2222	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025800	0.000000000	0.000035300	0.000039400	0.000018700	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000036700	0.000029600	0.000000000	0.000020700	0.000030000	0.000040700	0.000050000	0.000056600	0.000024500	0.000000000	0.000025700	0.000024100	0.000034200	0.000033900	0.000000000	0.000000000	0.000029500	0.000027100	0.000000000	0.000000000
C12H8O6	248.032126	0.667	0.500	0.00	0.0000	0.0000	0.67	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000123000	0.000099000	0.000070500	0.000057000	0.000064300	0.000066700	0.000083100	0.000096000	0.000112100	0.000094400	0.000098600	0.000090000	0.000107200	0.000041700	0.000037600	0.000042500	0.000042100	0.000067800	0.000057400	0.000094900	0.000102500	0.000044800	0.000037300	0.000104600	0.000110000	0.000073300	0.000069200	0.000086100	0.000077200	0.000130000	0.000130300	0.000129200	0.000113600	0.000283500	0.000268300
C9H12O6S	248.035517	1.333	0.667	0.00	0.1111	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000018800	0.000023500	0.000023300	0.000029900	0.000024300	0.000031700	0.000000000	0.000000000	0.000027800	0.000000000	0.000018500	0.000000000	0.000021200	0.000019600	0.000022600	0.000026400	0.000032400	0.000027800	0.000024600	0.000028500	0.000024900	0.000025800	0.000030600	0.000025000	0.000035900	0.000027400	0.000026400	0.000036100	0.000025300	0.000025400	0.000024400	0.000024300	0.000030000	0.000000000	0.000020500
C11H8N2O5	248.043306	0.727	0.455	0.18	0.0000	0.0000	0.69	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019300	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000024800	0.000000000	0.000022300	0.000000000	0.000020300	0.000000000	0.000029800	0.000029100	0.000000000	0.000018500	0.000038800	0.000035400
C16H8O3	248.047352	0.500	0.188	0.00	0.0000	0.0000	0.79	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000022200	0.000000000	0.000000000	0.000033700	0.000025100
C13H12O3S	248.050754	0.923	0.231	0.00	0.0769	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000088000	0.000031700	0.000100700	0.000115000	0.000093200	0.000075300	0.000072000	0.000044500	0.000045200	0.000041300	0.000035700	0.000043400	0.000036700	0.000079100	0.000064700	0.000115400	0.000130700	0.000065600	0.000056000	0.000089600	0.000090600	0.000142200	0.000122600	0.000068700	0.000068500	0.000079800	0.000083100	0.000115200	0.000130600	0.000000000	0.000000000	0.000118300	0.000094700	0.000000000	0.000020200
C10H16O3S2	248.054160	1.600	0.300	0.00	0.2000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000020800	0.000029600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000025600	0.000030400	0.000029700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H12O5	248.068515	0.923	0.385	0.00	0.0000	0.0000	0.52	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000409300	0.000384500	0.000341800	0.000366300	0.000362400	0.000361600	0.000356200	0.000376300	0.000404100	0.000397400	0.000367100	0.000394500	0.000369100	0.000326400	0.000289800	0.000340900	0.000337200	0.000401300	0.000361500	0.000365500	0.000378800	0.000335400	0.000314400	0.000426700	0.000436900	0.000376600	0.000382700	0.000364800	0.000375300	0.000448500	0.000440700	0.000443100	0.000408200	0.000502200	0.000515400
C10H16O5S	248.071898	1.600	0.500	0.00	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000091500	0.000067700	0.000110100	0.000122600	0.000092200	0.000108600	0.000091800	0.000074400	0.000074000	0.000062100	0.000060700	0.000081600	0.000064200	0.000105500	0.000106000	0.000143300	0.000142500	0.000105400	0.000112600	0.000102300	0.000098400	0.000120200	0.000123400	0.000084900	0.000091200	0.000112500	0.000110600	0.000105400	0.000105900	0.000154600	0.000154600	0.000110700	0.000076300	0.000082900	0.000077100
C12H12N2O4	248.079691	1.000	0.333	0.17	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000084000	0.000054300	0.000062100	0.000084600	0.000062400	0.000049000	0.000051300	0.000049500	0.000057000	0.000052500	0.000049000	0.000056600	0.000062400	0.000057900	0.000066300	0.000062000	0.000071400	0.000062100	0.000049900	0.000054900	0.000051900	0.000069200	0.000071000	0.000068500	0.000061400	0.000058900	0.000054900	0.000073600	0.000077000	0.000082400	0.000081500	0.000088300	0.000086200	0.000072200	0.000078300
C17H12O2	248.083748	0.706	0.118	0.00	0.0000	0.0000	0.69	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000024800	0.000024400	0.000023100	0.000024300	0.000000000	0.000027100	0.000021600	0.000035100	0.000023900	0.000000000	0.000020000	0.000027500	0.000020700	0.000000000	0.000000000	0.000000000	0.000024000	0.000023000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000025000	0.000031800	0.000000000	0.000000000	0.000000000	0.000000000	0.000037800	0.000034900	0.000027600	0.000032100	0.000040600	0.000041300
C14H16O2S	248.087147	1.143	0.143	0.00	0.0714	0.0000	0.42	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021800	0.000000000	0.000028400	0.000037600	0.000028700	0.000030000	0.000023800	0.000000000	0.000021600	0.000023300	0.000019300	0.000000000	0.000000000	0.000021400	0.000031500	0.000043500	0.000038200	0.000028200	0.000027200	0.000020100	0.000024200	0.000023600	0.000031100	0.000024900	0.000023600	0.000000000	0.000032000	0.000030400	0.000033800	0.000000000	0.000000000	0.000032300	0.000022200	0.000000000	0.000000000
C10H16O7	248.089662	1.600	0.700	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025900	0.000019900	0.000022100	0.000019000	0.000018900	0.000000000	0.000021000	0.000021200	0.000018100	0.000022800	0.000019600	0.000018800	0.000018700	0.000000000	0.000023200	0.000028100	0.000021500	0.000000000	0.000019900	0.000000000	0.000024300	0.000020400	0.000024600	0.000021400	0.000019000	0.000024800	0.000059000	0.000049200	0.000021600	0.000022600	0.000034600	0.000030700
C14H16O4	248.104908	1.143	0.286	0.00	0.0000	0.0000	0.42	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000539700	0.000658300	0.000622500	0.000588600	0.000674500	0.000641500	0.000604400	0.000695300	0.000659300	0.000684000	0.000628700	0.000688000	0.000595800	0.000647300	0.000695200	0.000665600	0.000632100	0.000650600	0.000687500	0.000595900	0.000597200	0.000650400	0.000612200	0.000601600	0.000586600	0.000639300	0.000619700	0.000558700	0.000554500	0.000547900	0.000544300	0.000598300	0.000516200	0.000585000	0.000578500
C11H20O4S	248.108285	1.818	0.364	0.00	0.0909	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000022900	0.000000000	0.000018700	0.000024000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027700	0.000021300	0.000000000	0.000022300	0.000026500	0.000019600	0.000025000	0.000036400	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000
C13H16N2O3	248.116087	1.231	0.231	0.15	0.0000	0.0000	0.37	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000060400	0.000047600	0.000059800	0.000070100	0.000050400	0.000060200	0.000057100	0.000042900	0.000041700	0.000042400	0.000039700	0.000047400	0.000054700	0.000057400	0.000065900	0.000070900	0.000066500	0.000054800	0.000062600	0.000061300	0.000054800	0.000080900	0.000067200	0.000069300	0.000061800	0.000063900	0.000065400	0.000074000	0.000076400	0.000082600	0.000083900	0.000068700	0.000076500	0.000068000	0.000060700
C11H20O6	248.126042	1.818	0.545	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000028600	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000023900	0.000000000	0.000018800	0.000000000	0.000022200	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H20O3	248.141300	1.333	0.200	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000242700	0.000375500	0.000305300	0.000292700	0.000344500	0.000347700	0.000335000	0.000436200	0.000381700	0.000404300	0.000381700	0.000410000	0.000325100	0.000378500	0.000459400	0.000388700	0.000352300	0.000358500	0.000436900	0.000302200	0.000306800	0.000321000	0.000308100	0.000303200	0.000302300	0.000334200	0.000330300	0.000298800	0.000301800	0.000286600	0.000278300	0.000318000	0.000263300	0.000284000	0.000280100
C14H20N2O2	248.152475	1.429	0.143	0.14	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000021100	0.000020700	0.000000000	0.000021300	0.000018700	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H24O2	248.177680	1.500	0.125	0.00	0.0000	0.0000	0.27	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000042800	0.000046000	0.000044500	0.000040200	0.000057000	0.000051400	0.000049700	0.000057600	0.000057600	0.000066700	0.000056700	0.000060400	0.000033100	0.000054100	0.000077500	0.000073300	0.000059100	0.000054200	0.000076200	0.000044500	0.000045600	0.000044300	0.000050500	0.000044000	0.000048600	0.000049800	0.000050500	0.000046900	0.000048800	0.000047000	0.000044600	0.000055400	0.000044500	0.000038300	0.000049600
C11H7NO4S	249.009555	0.636	0.364	0.09	0.0909	0.0000	0.71	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000019900	0.000000000	0.000000000
C11H7NO6	249.027322	0.636	0.545	0.09	0.0000	0.0000	0.71	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000023600	0.000024500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000018900	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031000	0.000036200	0.000000000	0.000024300	0.000046800	0.000039500
C12H11NO3S	249.045951	0.917	0.250	0.08	0.0833	0.0000	0.53	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000048000	0.000021200	0.000040300	0.000055800	0.000043800	0.000027100	0.000031100	0.000019100	0.000020800	0.000021300	0.000019600	0.000022400	0.000000000	0.000029400	0.000032500	0.000048800	0.000057500	0.000025300	0.000028300	0.000039200	0.000048200	0.000057500	0.000054700	0.000042500	0.000035400	0.000041100	0.000045000	0.000054500	0.000055100	0.000000000	0.000000000	0.000055700	0.000060800	0.000000000	0.000000000
C12H11NO5	249.063713	0.917	0.417	0.08	0.0000	0.0000	0.53	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000125000	0.000083200	0.000088100	0.000109800	0.000090700	0.000079600	0.000083100	0.000078400	0.000090400	0.000069500	0.000069900	0.000085300	0.000077900	0.000083100	0.000073000	0.000095600	0.000102600	0.000097200	0.000095800	0.000093200	0.000094400	0.000098100	0.000101600	0.000096000	0.000116500	0.000101300	0.000100000	0.000122600	0.000125300	0.000123900	0.000121100	0.000128100	0.000136000	0.000112900	0.000127700
C16H11NO2	249.078946	0.688	0.125	0.06	0.0000	0.0000	0.71	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025500	0.000000000	0.000000000	0.000000000	0.000023600	0.000020300	0.000000000
C13H15NO2S	249.082352	1.154	0.154	0.08	0.0769	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021300	0.000000000	0.000031300	0.000032800	0.000000000	0.000021400	0.000024200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000036400	0.000029100	0.000000000	0.000000000	0.000025400	0.000018500	0.000035700	0.000039000	0.000000000	0.000000000	0.000019600	0.000019300	0.000024700	0.000035400	0.000000000	0.000000000	0.000019500	0.000032500	0.000000000	0.000000000
C13H15NO4	249.100102	1.154	0.308	0.08	0.0000	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000168900	0.000118100	0.000195400	0.000189400	0.000170300	0.000167100	0.000161700	0.000130200	0.000116600	0.000101600	0.000099800	0.000133300	0.000119600	0.000168300	0.000175500	0.000198600	0.000196000	0.000156400	0.000163400	0.000175000	0.000167100	0.000233300	0.000223000	0.000159200	0.000166800	0.000162300	0.000166900	0.000184200	0.000200100	0.000165000	0.000171200	0.000195700	0.000183500	0.000131000	0.000137400
C14H19NO3	249.136489	1.357	0.214	0.07	0.0000	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000056300	0.000039800	0.000059800	0.000061500	0.000061700	0.000067000	0.000048100	0.000043200	0.000047200	0.000042600	0.000037500	0.000035100	0.000040100	0.000062000	0.000071700	0.000068900	0.000072000	0.000052500	0.000067900	0.000063300	0.000074200	0.000081100	0.000080000	0.000054600	0.000041500	0.000066500	0.000060400	0.000064700	0.000063000	0.000048000	0.000057400	0.000051700	0.000060000	0.000043500	0.000042800
C8H10O5S2	249.996973	1.250	0.625	0.00	0.2500	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O7	250.011398	0.545	0.636	0.00	0.0000	0.0000	0.73	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031400	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000025700	0.000030600	0.000025400	0.000025500	0.000023500	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000026400	0.000031300	0.000000000	0.000000000	0.000028800	0.000029100	0.000000000	0.000000000	0.000000000	0.000000000	0.000037100	0.000028900	0.000031700	0.000032500	0.000103900	0.000088300
C12H10O2S2	250.012297	0.833	0.167	0.00	0.1667	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H10O4S	250.030029	0.833	0.333	0.00	0.0833	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000080400	0.000033800	0.000055600	0.000082800	0.000053000	0.000054700	0.000057200	0.000035100	0.000042700	0.000029700	0.000028600	0.000033500	0.000035600	0.000042100	0.000031000	0.000070300	0.000055000	0.000049100	0.000040500	0.000043300	0.000046200	0.000067300	0.000057300	0.000053500	0.000054500	0.000050900	0.000044900	0.000075600	0.000093800	0.000018200	0.000000000	0.000074000	0.000081000	0.000024700	0.000031100
C9H14O4S2	250.033388	1.556	0.444	0.00	0.2222	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000035300	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000022900	0.000023500	0.000000000	0.000000000	0.000021700	0.000026200	0.000039600	0.000039400	0.000000000	0.000000000	0.000021800	0.000018700	0.000021500	0.000023500	0.000000000	0.000000000	0.000021100	0.000021600	0.000000000	0.000000000
C12H10O6	250.047790	0.833	0.500	0.00	0.0000	0.0000	0.56	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000191000	0.000167300	0.000127400	0.000131900	0.000133600	0.000130300	0.000141500	0.000160900	0.000187000	0.000178600	0.000170900	0.000169000	0.000183800	0.000094900	0.000089600	0.000101200	0.000118500	0.000156100	0.000145900	0.000175300	0.000165000	0.000096800	0.000096300	0.000185100	0.000205800	0.000159200	0.000150300	0.000146900	0.000146500	0.000260600	0.000248900	0.000196900	0.000184100	0.000371500	0.000367100
C9H14O6S	250.051138	1.556	0.667	0.00	0.1111	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000027000	0.000025200	0.000027300	0.000044000	0.000029500	0.000028800	0.000026100	0.000022900	0.000035500	0.000025100	0.000019600	0.000030200	0.000018700	0.000026700	0.000028100	0.000030600	0.000033100	0.000037800	0.000034500	0.000028500	0.000030100	0.000034900	0.000029000	0.000035000	0.000024000	0.000036600	0.000031200	0.000035800	0.000033800	0.000042400	0.000031100	0.000026600	0.000022300	0.000000000	0.000018800
C11H10N2O5	250.058963	0.909	0.455	0.18	0.0000	0.0000	0.54	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000032200	0.000029600	0.000021000	0.000026500	0.000025300	0.000024800	0.000025500	0.000029100	0.000031500	0.000025600	0.000025400	0.000018400	0.000029300	0.000027600	0.000000000	0.000026000	0.000024200	0.000020200	0.000026700	0.000019400	0.000018800	0.000000000	0.000033400	0.000027600	0.000030800	0.000026900	0.000026000	0.000035000	0.000039300	0.000048900	0.000048000	0.000028400	0.000043800	0.000041000	0.000039800
C16H10O3	250.063027	0.625	0.188	0.00	0.0000	0.0000	0.72	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000048600	0.000041600	0.000025200	0.000034600	0.000035200	0.000034200	0.000033400	0.000040800	0.000047500	0.000035100	0.000039000	0.000038000	0.000044300	0.000000000	0.000018800	0.000022100	0.000018100	0.000000000	0.000021900	0.000034000	0.000037600	0.000020800	0.000019900	0.000049600	0.000056500	0.000024600	0.000025700	0.000030900	0.000032300	0.000055600	0.000057500	0.000054500	0.000049000	0.000080600	0.000073600
C13H14O3S	250.066419	1.077	0.231	0.00	0.0769	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000081000	0.000038100	0.000111900	0.000118500	0.000084100	0.000087000	0.000084800	0.000053200	0.000055100	0.000041100	0.000031500	0.000038800	0.000044900	0.000086600	0.000082900	0.000124800	0.000123500	0.000071400	0.000069200	0.000092800	0.000095100	0.000145000	0.000132600	0.000061300	0.000068400	0.000079100	0.000084800	0.000116700	0.000124900	0.000025600	0.000023300	0.000107900	0.000094600	0.000000000	0.000000000
C13H14O5	250.084177	1.077	0.385	0.00	0.0000	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000568100	0.000595400	0.000575600	0.000542100	0.000567900	0.000585000	0.000563000	0.000613300	0.000608200	0.000586200	0.000582600	0.000633400	0.000600100	0.000578600	0.000572700	0.000610600	0.000560600	0.000647400	0.000654200	0.000563700	0.000575200	0.000546600	0.000540700	0.000595000	0.000616500	0.000618800	0.000627100	0.000553400	0.000571700	0.000623800	0.000613900	0.000609800	0.000555800	0.000644800	0.000670600
C10H18O5S	250.087522	1.800	0.500	0.00	0.1000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000088000	0.000069000	0.000124800	0.000127000	0.000120800	0.000124300	0.000127200	0.000059800	0.000058800	0.000050600	0.000060100	0.000066700	0.000064400	0.000138500	0.000144400	0.000219400	0.000213000	0.000111300	0.000110200	0.000111400	0.000110000	0.000125800	0.000136700	0.000088300	0.000098500	0.000105600	0.000107000	0.000125500	0.000128400	0.000553900	0.000547500	0.000086800	0.000073900	0.000218300	0.000217900
C12H14N2O4	250.095352	1.167	0.333	0.17	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000089300	0.000059000	0.000078000	0.000087000	0.000072300	0.000068300	0.000068600	0.000059900	0.000062100	0.000044500	0.000047500	0.000066500	0.000056500	0.000073600	0.000071100	0.000093500	0.000088900	0.000062900	0.000069800	0.000072100	0.000067800	0.000097600	0.000088100	0.000071400	0.000078800	0.000080200	0.000078100	0.000089200	0.000095500	0.000106100	0.000100800	0.000099100	0.000098400	0.000077500	0.000081400
C17H14O2	250.099414	0.824	0.118	0.00	0.0000	0.0000	0.62	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029100	0.000030500	0.000025300	0.000029200	0.000032200	0.000000000	0.000031700	0.000030200	0.000032400	0.000033500	0.000025000	0.000025800	0.000029300	0.000028100	0.000036000	0.000030200	0.000026400	0.000025700	0.000020800	0.000024600	0.000027100	0.000000000	0.000000000	0.000041000	0.000036100	0.000018100	0.000000000	0.000030200	0.000039900	0.000040400	0.000037000	0.000047800	0.000039600	0.000038400	0.000037000
C14H18O2S	250.102801	1.286	0.143	0.00	0.0714	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000020000	0.000018800	0.000020800	0.000025700	0.000023800	0.000026800	0.000018800	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000024500	0.000028300	0.000033300	0.000026500	0.000029500	0.000032000	0.000028000	0.000018700	0.000025000	0.000034600	0.000028400	0.000020300	0.000024700	0.000021400	0.000036700	0.000029000	0.000000000	0.000000000	0.000034500	0.000021100	0.000000000	0.000000000
C14H18O4	250.120561	1.286	0.286	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000640700	0.000854600	0.000757100	0.000749000	0.000865500	0.000827000	0.000815600	0.000970600	0.000877000	0.000894600	0.000855800	0.000950100	0.000798200	0.000913100	0.001004500	0.000922500	0.000852700	0.000921400	0.001020400	0.000739600	0.000747800	0.000806100	0.000751600	0.000776900	0.000761600	0.000815500	0.000847100	0.000726200	0.000732600	0.000749400	0.000769600	0.000763900	0.000654100	0.000725800	0.000757700
C13H18N2O3	250.131737	1.385	0.231	0.15	0.0000	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041400	0.000020200	0.000034000	0.000036700	0.000032500	0.000033800	0.000036400	0.000025500	0.000030400	0.000031000	0.000019500	0.000029300	0.000032200	0.000035900	0.000035300	0.000047300	0.000050500	0.000038000	0.000038500	0.000034000	0.000034100	0.000059200	0.000051100	0.000035900	0.000027500	0.000039200	0.000028800	0.000046500	0.000037700	0.000044100	0.000041500	0.000045600	0.000045400	0.000022700	0.000032500
C15H22O3	250.156949	1.467	0.200	0.00	0.0000	0.0000	0.26	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000150200	0.000236300	0.000192000	0.000201500	0.000240300	0.000224100	0.000225000	0.000268900	0.000234100	0.000240100	0.000228000	0.000258200	0.000194900	0.000268800	0.000330800	0.000269500	0.000258800	0.000254200	0.000319200	0.000200600	0.000209000	0.000234500	0.000235200	0.000214400	0.000196800	0.000227500	0.000222900	0.000203500	0.000210700	0.000201000	0.000196600	0.000226500	0.000172100	0.000174600	0.000193700
C16H26O2	250.193329	1.625	0.125	0.00	0.0000	0.0000	0.20	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000022900	0.000022100	0.000000000	0.000000000	0.000027200	0.000026800	0.000000000	0.000000000	0.000000000	0.000022600	0.000018900	0.000000000	0.000024400	0.000032600	0.000031000	0.000029000	0.000025700	0.000036400	0.000024000	0.000021900	0.000049700	0.000048300	0.000000000	0.000020300	0.000024300	0.000026600	0.000000000	0.000020300	0.000018300	0.000021300	0.000000000	0.000000000	0.000000000	0.000019200
C11H9NO4S	251.025224	0.818	0.364	0.09	0.0909	0.0000	0.57	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000039500	0.000000000	0.000020200	0.000030600	0.000000000	0.000022700	0.000023800	0.000018400	0.000018900	0.000020100	0.000000000	0.000000000	0.000021800	0.000020100	0.000000000	0.000018900	0.000035900	0.000022600	0.000026300	0.000019900	0.000020300	0.000021000	0.000020900	0.000029900	0.000019600	0.000019400	0.000024000	0.000034900	0.000050700	0.000018000	0.000000000	0.000038500	0.000034300	0.000000000	0.000019500
C11H9NO6	251.042979	0.818	0.545	0.09	0.0000	0.0000	0.57	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000039900	0.000032700	0.000026900	0.000028900	0.000029500	0.000018500	0.000021500	0.000026500	0.000029700	0.000035500	0.000028200	0.000019800	0.000032800	0.000000000	0.000018100	0.000000000	0.000000000	0.000027800	0.000000000	0.000025000	0.000019700	0.000000000	0.000019200	0.000032800	0.000037300	0.000032200	0.000027300	0.000029400	0.000022700	0.000053800	0.000064400	0.000038900	0.000033500	0.000056100	0.000063500
C15H9NO3	251.058271	0.600	0.200	0.07	0.0000	0.0000	0.76	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027500	0.000000000	0.000000000	0.000019200	0.000022600	0.000027100
C12H13NO3S	251.061606	1.083	0.250	0.08	0.0833	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000053000	0.000000000	0.000060100	0.000063000	0.000035800	0.000032500	0.000036700	0.000028400	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000035400	0.000034000	0.000060900	0.000065500	0.000035800	0.000036000	0.000047100	0.000056400	0.000073300	0.000077000	0.000023800	0.000034300	0.000047300	0.000038600	0.000065800	0.000073300	0.000000000	0.000000000	0.000062800	0.000056000	0.000000000	0.000000000
C12H13NO5	251.079367	1.083	0.417	0.08	0.0000	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000167500	0.000103800	0.000131700	0.000158700	0.000128000	0.000136500	0.000117300	0.000117800	0.000124000	0.000096900	0.000095700	0.000104600	0.000104400	0.000131100	0.000124000	0.000156100	0.000159500	0.000138500	0.000140100	0.000140500	0.000142000	0.000167300	0.000160600	0.000144600	0.000155600	0.000145000	0.000141500	0.000167900	0.000171200	0.000179700	0.000181800	0.000173200	0.000182400	0.000141000	0.000136600
C16H13NO2	251.094652	0.812	0.125	0.06	0.0000	0.0000	0.64	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000024100	0.000000000	0.000000000	0.000020000	0.000023400	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000020200	0.000023000	0.000019500	0.000000000	0.000029700	0.000000000	0.000000000	0.000022000
C13H17NO2S	251.098002	1.308	0.154	0.08	0.0769	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000019400	0.000023200	0.000024500	0.000000000	0.000000000	0.000019100	0.000018800	0.000027800	0.000027600	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000
C13H17NO4	251.115763	1.308	0.308	0.08	0.0000	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000114100	0.000090200	0.000151200	0.000137000	0.000126100	0.000132700	0.000131700	0.000099700	0.000095400	0.000076000	0.000084800	0.000095900	0.000084400	0.000142100	0.000149900	0.000157900	0.000163600	0.000130300	0.000141100	0.000138800	0.000136800	0.000186200	0.000179200	0.000102600	0.000109700	0.000132300	0.000131700	0.000137300	0.000137200	0.000135200	0.000137800	0.000138400	0.000133100	0.000097900	0.000105200
C14H21NO3	251.152151	1.500	0.214	0.07	0.0000	0.0000	0.22	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000021200	0.000000000	0.000034700	0.000035200	0.000025600	0.000034800	0.000028100	0.000027800	0.000033800	0.000018900	0.000019500	0.000020000	0.000000000	0.000036600	0.000045800	0.000039400	0.000047000	0.000025500	0.000034000	0.000035200	0.000027700	0.000047800	0.000038000	0.000023300	0.000000000	0.000038400	0.000030900	0.000040300	0.000032200	0.000036900	0.000024800	0.000030700	0.000028900	0.000000000	0.000000000
C11H8O3S2	251.991480	0.727	0.273	0.00	0.1818	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000020600	0.000000000	0.000000000	0.000027200	0.000000000	0.000000000	0.000000000
C11H8O5S	252.009234	0.727	0.455	0.00	0.0909	0.0000	0.60	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000049100	0.000022100	0.000026700	0.000036300	0.000029200	0.000025400	0.000026700	0.000025900	0.000032200	0.000027900	0.000024600	0.000022600	0.000028800	0.000021200	0.000000000	0.000029100	0.000034200	0.000029800	0.000026600	0.000024200	0.000036700	0.000023700	0.000032000	0.000031200	0.000046100	0.000030300	0.000025100	0.000051200	0.000052000	0.000033300	0.000029700	0.000053500	0.000052200	0.000033400	0.000047200
C8H12O5S2	252.012643	1.500	0.625	0.00	0.2500	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000019100	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H8O7	252.026986	0.727	0.636	0.00	0.0000	0.0000	0.60	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000066700	0.000048300	0.000033100	0.000027800	0.000040200	0.000035100	0.000043500	0.000048500	0.000051600	0.000045300	0.000050000	0.000037800	0.000057500	0.000019800	0.000000000	0.000019900	0.000018000	0.000034000	0.000028200	0.000061400	0.000060400	0.000025700	0.000022700	0.000050300	0.000062000	0.000039200	0.000038500	0.000042400	0.000041000	0.000089500	0.000085100	0.000056900	0.000069500	0.000220500	0.000183700
C12H12O2S2	252.027862	1.000	0.167	0.00	0.1667	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020500	0.000000000	0.000018400	0.000027800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027000	0.000027000	0.000000000	0.000000000	0.000024800	0.000000000	0.000026400	0.000028700	0.000000000	0.000000000	0.000019300	0.000018200	0.000025700	0.000026200	0.000000000	0.000000000	0.000026600	0.000019600	0.000000000	0.000000000
C15H8O4	252.042259	0.533	0.267	0.00	0.0000	0.0000	0.77	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000049900	0.000058200	0.000028800	0.000034300	0.000028000	0.000033400	0.000037400	0.000052500	0.000049700	0.000050300	0.000039200	0.000055700	0.000048200	0.000028600	0.000032400	0.000023400	0.000021000	0.000031400	0.000020600	0.000044400	0.000036200	0.000042600	0.000019200	0.000055700	0.000048600	0.000034100	0.000031500	0.000036800	0.000032700	0.000077100	0.000072600	0.000065600	0.000063300	0.000122300	0.000114200
C12H12O4S	252.045621	1.000	0.333	0.00	0.0833	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000122200	0.000057900	0.000120900	0.000152200	0.000109400	0.000102100	0.000095900	0.000064800	0.000069600	0.000054600	0.000060000	0.000056100	0.000066900	0.000087700	0.000095500	0.000148000	0.000138400	0.000085800	0.000095100	0.000111400	0.000105400	0.000146200	0.000138900	0.000103400	0.000107400	0.000099000	0.000101400	0.000158800	0.000169200	0.000034700	0.000036400	0.000137300	0.000143300	0.000037200	0.000033000
C12H12O6	252.063377	1.000	0.500	0.00	0.0000	0.0000	0.44	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000428600	0.000372900	0.000315200	0.000333900	0.000327800	0.000340000	0.000342000	0.000361800	0.000403300	0.000364900	0.000349100	0.000367400	0.000399600	0.000292100	0.000265900	0.000330800	0.000315600	0.000410700	0.000394400	0.000372300	0.000357400	0.000288300	0.000285900	0.000422800	0.000475000	0.000372700	0.000364300	0.000392800	0.000391400	0.000587200	0.000578100	0.000433400	0.000483200	0.000632600	0.000661900
C9H16O6S	252.066753	1.778	0.667	0.00	0.1111	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000022100	0.000020700	0.000027300	0.000026200	0.000031400	0.000029300	0.000030200	0.000023800	0.000000000	0.000020500	0.000000000	0.000000000	0.000018900	0.000022200	0.000018500	0.000040700	0.000033500	0.000033900	0.000031400	0.000025900	0.000021900	0.000027900	0.000033900	0.000027300	0.000019700	0.000033800	0.000027200	0.000030500	0.000022500	0.000056500	0.000044000	0.000024100	0.000021600	0.000027500	0.000028000
C11H12N2O5	252.074677	1.091	0.455	0.18	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033800	0.000030100	0.000024000	0.000032200	0.000024800	0.000029200	0.000022200	0.000022600	0.000025200	0.000023300	0.000019800	0.000025600	0.000022700	0.000020200	0.000025100	0.000028100	0.000036500	0.000021000	0.000032500	0.000024800	0.000025700	0.000030400	0.000029600	0.000034900	0.000035400	0.000038700	0.000029900	0.000036500	0.000043900	0.000044300	0.000052900	0.000034000	0.000039900	0.000038100	0.000038000
C16H12O3	252.078656	0.750	0.188	0.00	0.0000	0.0000	0.66	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000098700	0.000062100	0.000064800	0.000083300	0.000071200	0.000070200	0.000061300	0.000083100	0.000092500	0.000078400	0.000074500	0.000091400	0.000081300	0.000067300	0.000062300	0.000056600	0.000063700	0.000071900	0.000061800	0.000070600	0.000078600	0.000059700	0.000054600	0.000089000	0.000098100	0.000057100	0.000063600	0.000076300	0.000081600	0.000104300	0.000098100	0.000119300	0.000120000	0.000128700	0.000117900
C13H16O3S	252.081999	1.231	0.231	0.00	0.0769	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000088600	0.000045200	0.000128700	0.000117200	0.000101700	0.000090900	0.000082400	0.000058800	0.000053700	0.000039900	0.000036300	0.000036900	0.000044700	0.000082100	0.000084800	0.000134700	0.000120600	0.000079700	0.000079000	0.000103800	0.000109300	0.000153800	0.000146900	0.000072600	0.000069600	0.000090700	0.000086600	0.000119600	0.000130100	0.000028500	0.000026000	0.000112500	0.000101400	0.000026600	0.000018700
C15H12N2O2	252.089948	0.800	0.133	0.13	0.0000	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H16O5	252.099762	1.231	0.385	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001130200	0.001232500	0.001248100	0.001183000	0.001347400	0.001337800	0.001273900	0.001375200	0.001278000	0.001254800	0.001152800	0.001295400	0.001180000	0.001395600	0.001446200	0.001451800	0.001348000	0.001411600	0.001559800	0.001252100	0.001258700	0.001291000	0.001279800	0.001245400	0.001270500	0.001324600	0.001259700	0.001261100	0.001299800	0.001377500	0.001440400	0.001274300	0.001305100	0.001244100	0.001341000
C10H20O5S	252.103137	2.000	0.500	0.00	0.1000	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000022600	0.000021300	0.000023600	0.000019700	0.000000000	0.000000000	0.000000000	0.000020200	0.000023100	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000
C12H16N2O4	252.111055	1.333	0.333	0.17	0.0000	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047100	0.000040600	0.000061500	0.000053400	0.000045000	0.000050100	0.000050400	0.000036300	0.000043900	0.000025800	0.000030700	0.000044500	0.000038000	0.000053100	0.000050900	0.000058000	0.000055900	0.000048600	0.000059200	0.000047200	0.000050700	0.000071900	0.000068700	0.000042700	0.000043900	0.000058000	0.000050500	0.000057400	0.000059500	0.000057600	0.000064100	0.000048800	0.000049400	0.000043100	0.000045300
C17H16O2	252.115050	0.941	0.118	0.00	0.0000	0.0000	0.56	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000035100	0.000030200	0.000034700	0.000048100	0.000045600	0.000045400	0.000051700	0.000053000	0.000046200	0.000051200	0.000043300	0.000043300	0.000033500	0.000067100	0.000063000	0.000062400	0.000057500	0.000037600	0.000051000	0.000045100	0.000047200	0.000052400	0.000052600	0.000049300	0.000047100	0.000038200	0.000048200	0.000058400	0.000051800	0.000033300	0.000037300	0.000057100	0.000048500	0.000043700	0.000045100
C14H20O2S	252.118394	1.429	0.143	0.00	0.0714	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019700	0.000000000	0.000024300	0.000030400	0.000025300	0.000018900	0.000000000	0.000018400	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000025400	0.000028900	0.000030500	0.000000000	0.000020600	0.000021700	0.000000000	0.000029900	0.000023200	0.000018300	0.000000000	0.000000000	0.000020300	0.000025900	0.000022700	0.000000000	0.000000000	0.000000000	0.000025800	0.000000000	0.000000000
C14H20O4	252.136157	1.429	0.286	0.00	0.0000	0.0000	0.25	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000665300	0.000854600	0.000886600	0.000801500	0.001008500	0.000974300	0.000944700	0.001064500	0.000906800	0.000893200	0.000810400	0.000946100	0.000788200	0.001032400	0.001273700	0.001131400	0.001010300	0.001047500	0.001263900	0.000893100	0.000879900	0.001010300	0.000978500	0.000815900	0.000825300	0.000911300	0.000899200	0.000874400	0.000893500	0.000876500	0.000868800	0.000842600	0.000863500	0.000839800	0.000959500
C15H24O3	252.172549	1.600	0.200	0.00	0.0000	0.0000	0.19	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000061800	0.000083300	0.000097400	0.000080000	0.000108100	0.000100400	0.000112400	0.000103400	0.000085100	0.000084500	0.000092100	0.000104000	0.000079500	0.000111000	0.000161000	0.000122800	0.000108600	0.000104100	0.000154000	0.000096400	0.000102100	0.000116300	0.000119500	0.000080900	0.000081800	0.000083700	0.000084900	0.000089500	0.000097500	0.000086800	0.000082700	0.000091200	0.000078900	0.000072100	0.000087900
C14H7NO4	253.037483	0.500	0.286	0.07	0.0000	0.0000	0.82	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000022600	0.000020900
C11H11NO4S	253.040876	1.000	0.364	0.09	0.0909	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000045700	0.000020200	0.000047300	0.000054600	0.000041200	0.000038600	0.000033600	0.000022200	0.000021300	0.000023400	0.000020500	0.000019800	0.000000000	0.000027600	0.000029800	0.000041900	0.000039800	0.000023800	0.000031800	0.000044000	0.000044900	0.000051700	0.000049900	0.000030200	0.000033100	0.000043100	0.000044100	0.000051600	0.000062100	0.000024300	0.000000000	0.000050100	0.000050800	0.000000000	0.000000000
C11H11NO6	253.058628	1.000	0.545	0.09	0.0000	0.0000	0.43	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000066300	0.000043100	0.000035400	0.000047000	0.000044500	0.000045900	0.000044600	0.000048100	0.000038800	0.000051700	0.000041300	0.000043900	0.000046200	0.000042400	0.000035400	0.000047500	0.000048500	0.000051600	0.000046500	0.000040500	0.000036000	0.000044700	0.000042400	0.000060400	0.000064400	0.000053400	0.000047000	0.000059500	0.000060000	0.000103100	0.000109200	0.000071300	0.000082700	0.000081200	0.000087700
C15H11NO3	253.073896	0.733	0.200	0.07	0.0000	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000049600	0.000034800	0.000032700	0.000034500	0.000035800	0.000029900	0.000028000	0.000029000	0.000031300	0.000029800	0.000032000	0.000026800	0.000033200	0.000025200	0.000040100	0.000042400	0.000028700	0.000025600	0.000025600	0.000031400	0.000034600	0.000034200	0.000034200	0.000048000	0.000044300	0.000025800	0.000035200	0.000047400	0.000046900	0.000030900	0.000045600	0.000051700	0.000053900	0.000042400	0.000044600
C12H15NO3S	253.077250	1.250	0.250	0.08	0.0833	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000046500	0.000021700	0.000065700	0.000058500	0.000042900	0.000033000	0.000035200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033600	0.000041500	0.000063300	0.000059500	0.000030300	0.000030200	0.000044100	0.000048700	0.000080300	0.000078500	0.000024600	0.000031700	0.000035700	0.000045800	0.000060300	0.000059900	0.000000000	0.000000000	0.000046900	0.000046500	0.000000000	0.000000000
C12H15NO5	253.095009	1.250	0.417	0.08	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000176000	0.000134200	0.000184200	0.000188900	0.000166600	0.000188400	0.000174000	0.000135200	0.000137900	0.000110100	0.000100600	0.000123400	0.000122900	0.000179000	0.000178900	0.000207700	0.000205100	0.000172700	0.000194900	0.000191000	0.000195500	0.000239300	0.000228900	0.000165200	0.000178900	0.000186100	0.000187200	0.000214400	0.000215000	0.000219900	0.000217200	0.000208300	0.000211400	0.000161200	0.000154300
C16H15NO2	253.110298	0.938	0.125	0.06	0.0000	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000027200	0.000000000	0.000019800	0.000020900	0.000000000	0.000023600	0.000000000	0.000000000	0.000020600	0.000000000	0.000027100	0.000021100	0.000000000	0.000023200	0.000021400	0.000019700	0.000000000	0.000021900	0.000027700	0.000027900	0.000000000	0.000026000	0.000000000	0.000021900	0.000032800	0.000026400	0.000000000	0.000000000	0.000026500	0.000027900	0.000000000	0.000000000
C13H19NO4	253.131397	1.462	0.308	0.08	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000046800	0.000051300	0.000088700	0.000079700	0.000078200	0.000078900	0.000079000	0.000063000	0.000055300	0.000038000	0.000036600	0.000057000	0.000037800	0.000078100	0.000100100	0.000101600	0.000097800	0.000075200	0.000082100	0.000090400	0.000089500	0.000119700	0.000112200	0.000056100	0.000054300	0.000082900	0.000078600	0.000079800	0.000082300	0.000068700	0.000074000	0.000073700	0.000076400	0.000047400	0.000058700
C10H6O8	254.006239	0.600	0.800	0.00	0.0000	0.0000	0.67	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000040300	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000018900	0.000022100	0.000000000	0.000000000	0.000030200	0.000000000	0.000000000	0.000000000	0.000031400	0.000031200
C11H10O3S2	254.007126	0.909	0.273	0.00	0.1818	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022500	0.000000000	0.000029200	0.000033400	0.000030500	0.000025800	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000018800	0.000046800	0.000035600	0.000000000	0.000000000	0.000023200	0.000027700	0.000035600	0.000045300	0.000000000	0.000000000	0.000024400	0.000024700	0.000043100	0.000036200	0.000000000	0.000000000	0.000027800	0.000034200	0.000000000	0.000000000
C14H6O5	254.021525	0.429	0.357	0.00	0.0000	0.0000	0.83	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022600	0.000020400	0.000019900	0.000000000	0.000019200	0.000000000	0.000000000	0.000018300	0.000024000	0.000028300	0.000023500	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000026400	0.000000000	0.000000000	0.000019000	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000031000	0.000032800	0.000023700	0.000029700	0.000071500	0.000061900
C11H10O5S	254.024878	0.909	0.455	0.00	0.0909	0.0000	0.47	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000077300	0.000040600	0.000057400	0.000076500	0.000048300	0.000056800	0.000070600	0.000048000	0.000046500	0.000027900	0.000030500	0.000038400	0.000057100	0.000043600	0.000034700	0.000068500	0.000070100	0.000061400	0.000047200	0.000054400	0.000061400	0.000063400	0.000063100	0.000056100	0.000068500	0.000061400	0.000065200	0.000095300	0.000084200	0.000041300	0.000038500	0.000087400	0.000093100	0.000032500	0.000041100
C11H10O7	254.042643	0.909	0.636	0.00	0.0000	0.0000	0.47	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000107700	0.000080800	0.000064700	0.000056700	0.000068100	0.000065000	0.000078300	0.000084100	0.000096400	0.000097600	0.000088200	0.000080300	0.000089900	0.000044500	0.000030100	0.000044000	0.000048600	0.000068900	0.000054400	0.000084200	0.000083900	0.000042700	0.000042200	0.000094500	0.000107700	0.000065400	0.000069700	0.000083800	0.000081700	0.000197000	0.000162400	0.000117100	0.000131300	0.000267000	0.000268300
C12H14O2S2	254.043497	1.167	0.167	0.00	0.1667	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000026700	0.000000000	0.000000000	0.000000000	0.000020500	0.000028600	0.000027600	0.000000000	0.000000000	0.000000000	0.000022300	0.000026800	0.000027700	0.000000000	0.000000000	0.000021300	0.000020300	0.000000000	0.000000000
C10H10N2O6	254.053991	1.000	0.600	0.20	0.0000	0.0000	0.40	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000
C15H10O4	254.057937	0.667	0.267	0.00	0.0000	0.0000	0.69	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000122800	0.000098500	0.000071800	0.000082500	0.000082800	0.000090900	0.000085500	0.000111200	0.000125400	0.000097600	0.000097200	0.000092300	0.000095800	0.000066100	0.000065700	0.000066800	0.000064200	0.000078500	0.000067800	0.000094100	0.000101300	0.000065700	0.000050900	0.000111400	0.000121500	0.000077700	0.000077800	0.000096200	0.000105200	0.000122100	0.000128400	0.000148500	0.000140700	0.000184500	0.000204300
C12H14O4S	254.061273	1.167	0.333	0.00	0.0833	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000131100	0.000074500	0.000149700	0.000179700	0.000121600	0.000123000	0.000109500	0.000081300	0.000074300	0.000059500	0.000060100	0.000061100	0.000063900	0.000105100	0.000110400	0.000163800	0.000159300	0.000099600	0.000112000	0.000130400	0.000129700	0.000176000	0.000177400	0.000099900	0.000104600	0.000120200	0.000131100	0.000170700	0.000173100	0.000040200	0.000041900	0.000143300	0.000140600	0.000041900	0.000040400
C14H10N2O3	254.069177	0.714	0.214	0.14	0.0000	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022400	0.000000000	0.000000000	0.000020600	0.000018300	0.000000000	0.000024500	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000018200	0.000026700	0.000020000	0.000022200	0.000000000	0.000000000	0.000019900	0.000000000	0.000025900	0.000020800	0.000024100	0.000025100
C12H14O6	254.079039	1.167	0.500	0.00	0.0000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000780200	0.000730900	0.000693200	0.000765100	0.000748800	0.000801500	0.000762900	0.000759100	0.000806800	0.000736700	0.000654000	0.000747400	0.000769600	0.000820200	0.000749200	0.000850000	0.000805100	0.000907500	0.000947000	0.000755600	0.000760500	0.000685600	0.000730100	0.000855400	0.000907100	0.000802000	0.000779100	0.000900600	0.000878300	0.001222700	0.001196600	0.000867200	0.000955100	0.000973900	0.001021300
C11H14N2O5	254.090324	1.273	0.455	0.18	0.0000	0.0000	0.23	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033000	0.000036800	0.000031100	0.000039400	0.000029100	0.000032400	0.000033400	0.000020000	0.000023100	0.000024200	0.000000000	0.000020700	0.000027400	0.000036700	0.000042000	0.000040300	0.000034700	0.000034000	0.000032800	0.000026000	0.000033700	0.000042600	0.000039100	0.000039100	0.000034500	0.000039600	0.000033600	0.000045900	0.000038900	0.000050600	0.000059200	0.000044900	0.000034200	0.000036800	0.000035600
C16H14O3	254.094334	0.875	0.188	0.00	0.0000	0.0000	0.59	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000096600	0.000090500	0.000085200	0.000108600	0.000095000	0.000099200	0.000104100	0.000118500	0.000119100	0.000100000	0.000099900	0.000110400	0.000097500	0.000109300	0.000108000	0.000098800	0.000095000	0.000091900	0.000091900	0.000099900	0.000107600	0.000085300	0.000082500	0.000106400	0.000110900	0.000080200	0.000096300	0.000110200	0.000114000	0.000093700	0.000095300	0.000116000	0.000126900	0.000123100	0.000124300
C13H18O3S	254.097672	1.385	0.231	0.00	0.0769	0.0000	0.24	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000056600	0.000037400	0.000082800	0.000082600	0.000062900	0.000058200	0.000064700	0.000037600	0.000025300	0.000028400	0.000030100	0.000037900	0.000031100	0.000064900	0.000055300	0.000089300	0.000082000	0.000052000	0.000055600	0.000074800	0.000074400	0.000108900	0.000104600	0.000055300	0.000054200	0.000063900	0.000067500	0.000074200	0.000083200	0.000000000	0.000000000	0.000068200	0.000067900	0.000000000	0.000000000
C15H14N2O2	254.105536	0.933	0.133	0.13	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000027300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027200	0.000020500	0.000018000	0.000000000	0.000000000	0.000022400	0.000000000	0.000018700	0.000022300	0.000000000	0.000000000	0.000021400	0.000020600	0.000000000	0.000030200	0.000031800	0.000021400	0.000021000	0.000032100	0.000025900	0.000000000	0.000020200
C13H18O5	254.115446	1.385	0.385	0.00	0.0000	0.0000	0.24	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001004300	0.001197900	0.001447000	0.001255100	0.001606400	0.001609000	0.001577500	0.001418100	0.001350500	0.001249200	0.001086500	0.001327500	0.001145600	0.001701400	0.001884500	0.001794300	0.001667200	0.001719400	0.002026400	0.001384800	0.001428200	0.001645400	0.001654800	0.001259400	0.001279100	0.001479500	0.001467000	0.001320200	0.001378400	0.001533000	0.001507900	0.001290200	0.001190800	0.001086700	0.001208000
C12H18N2O4	254.126684	1.500	0.333	0.17	0.0000	0.0000	0.12	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000028300	0.000021800	0.000037500	0.000027300	0.000030400	0.000021800	0.000026300	0.000023100	0.000025800	0.000023700	0.000020200	0.000021700	0.000000000	0.000026100	0.000025700	0.000031900	0.000035600	0.000031500	0.000038400	0.000031000	0.000034900	0.000053800	0.000040900	0.000019600	0.000028200	0.000028400	0.000030600	0.000000000	0.000035700	0.000037900	0.000033000	0.000028500	0.000021900	0.000000000	0.000020300
C17H18O2	254.130735	1.059	0.118	0.00	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034700	0.000039600	0.000032400	0.000038700	0.000038500	0.000043600	0.000042700	0.000058700	0.000053500	0.000050700	0.000049600	0.000047500	0.000045700	0.000051900	0.000059000	0.000048100	0.000045500	0.000041000	0.000059800	0.000037600	0.000044000	0.000041900	0.000043400	0.000038400	0.000044100	0.000035300	0.000045400	0.000041800	0.000043100	0.000036500	0.000039200	0.000039200	0.000047100	0.000041000	0.000052200
C14H22O2S	254.134052	1.571	0.143	0.00	0.0714	0.0000	0.17	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000024800	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H22O4	254.151848	1.571	0.286	0.00	0.0000	0.0000	0.17	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000207500	0.000285700	0.000348500	0.000298800	0.000391600	0.000398800	0.000399200	0.000346600	0.000290900	0.000284400	0.000256500	0.000340300	0.000252200	0.000415700	0.000515200	0.000458500	0.000420000	0.000416300	0.000521600	0.000349800	0.000368600	0.000438700	0.000411500	0.000275800	0.000276400	0.000346600	0.000352000	0.000300400	0.000295400	0.000328500	0.000300600	0.000289700	0.000249500	0.000235200	0.000267500
C15H26O3	254.188231	1.733	0.200	0.00	0.0000	0.0000	0.11	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000019300	0.000026200	0.000022000	0.000021100	0.000018300	0.000000000	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000023300	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000
C16H30O2	254.224626	1.875	0.125	0.00	0.0000	0.0000	0.07	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000019500	0.000000000	0.000026000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000042200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000042400	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000030000	0.000000000	0.000022100	0.000020200	0.000020200	0.000000000	0.000000000	0.000000000	0.000031200
C10H9NO5S	255.020131	0.900	0.500	0.10	0.1000	0.0000	0.45	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019400	0.000000000	0.000000000	0.000027500	0.000000000	0.000019300	0.000021700	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000000000	0.000019500	0.000021700	0.000024600	0.000020700	0.000020300	0.000018600	0.000030600	0.000026700	0.000028100	0.000025300	0.000024400	0.000022600	0.000030300	0.000038400	0.000000000	0.000000000	0.000027000	0.000034700	0.000000000	0.000000000
C10H9NO7	255.037889	0.900	0.700	0.10	0.0000	0.0000	0.45	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000019500	0.000000000	0.000018700	0.000021100	0.000000000
C14H9NO4	255.053203	0.643	0.286	0.07	0.0000	0.0000	0.73	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000034700	0.000034100	0.000019500	0.000042500	0.000027200	0.000026500	0.000024900	0.000029000	0.000038000	0.000027300	0.000029600	0.000028800	0.000018600	0.000028300	0.000019100	0.000027000	0.000019900	0.000030500	0.000032500	0.000028200	0.000029500	0.000027500	0.000027600	0.000031700	0.000037000	0.000000000	0.000020700	0.000035900	0.000032300	0.000038700	0.000042100	0.000041000	0.000042000	0.000045900	0.000039800
C11H13NO4S	255.056551	1.182	0.364	0.09	0.0909	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037200	0.000022700	0.000049300	0.000066000	0.000042900	0.000031400	0.000035100	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000042000	0.000041500	0.000063400	0.000062900	0.000032700	0.000030900	0.000048900	0.000057600	0.000073800	0.000065800	0.000023700	0.000023700	0.000045300	0.000046700	0.000054300	0.000061300	0.000000000	0.000000000	0.000049800	0.000053700	0.000000000	0.000000000
C11H13NO6	255.074322	1.182	0.545	0.09	0.0000	0.0000	0.29	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000082000	0.000057400	0.000063600	0.000082100	0.000061200	0.000073100	0.000053200	0.000058100	0.000067900	0.000046500	0.000059500	0.000064900	0.000064000	0.000075000	0.000065500	0.000082600	0.000072800	0.000070400	0.000074500	0.000060000	0.000063300	0.000073100	0.000080100	0.000076500	0.000087600	0.000076100	0.000074300	0.000090700	0.000091800	0.000133800	0.000126000	0.000091900	0.000088400	0.000092900	0.000089500
C15H13NO3	255.089594	0.867	0.200	0.07	0.0000	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000050800	0.000026900	0.000047400	0.000049700	0.000043800	0.000044500	0.000043100	0.000031800	0.000041500	0.000029800	0.000035800	0.000035300	0.000035200	0.000056300	0.000044600	0.000050700	0.000058500	0.000038800	0.000037300	0.000041000	0.000046900	0.000055500	0.000042300	0.000045700	0.000047900	0.000032700	0.000046200	0.000059600	0.000056200	0.000040900	0.000036200	0.000063500	0.000060600	0.000038100	0.000030700
C12H17NO3S	255.092944	1.417	0.250	0.08	0.0833	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028400	0.000000000	0.000035400	0.000026000	0.000022100	0.000025400	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000033500	0.000028600	0.000000000	0.000021000	0.000032300	0.000034900	0.000049100	0.000043600	0.000000000	0.000000000	0.000029700	0.000039000	0.000024800	0.000026500	0.000000000	0.000000000	0.000024900	0.000019600	0.000000000	0.000000000
C12H17NO5	255.110728	1.417	0.417	0.08	0.0000	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000077500	0.000066700	0.000129200	0.000116200	0.000130800	0.000123700	0.000135900	0.000073800	0.000076700	0.000058600	0.000040500	0.000074400	0.000055700	0.000133100	0.000138300	0.000144600	0.000140900	0.000119300	0.000131400	0.000114700	0.000134200	0.000171300	0.000171400	0.000087000	0.000089600	0.000125200	0.000125000	0.000121800	0.000116200	0.000119500	0.000115700	0.000098800	0.000090300	0.000070200	0.000072900
C16H17NO2	255.125976	1.062	0.125	0.06	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024200	0.000000000	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000021100	0.000000000	0.000000000	0.000020300	0.000000000	0.000021400	0.000024100	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000018200	0.000000000	0.000000000	0.000029200	0.000018600	0.000000000	0.000021400
C13H21NO4	255.147104	1.615	0.308	0.08	0.0000	0.0000	0.10	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000027200	0.000020800	0.000026500	0.000033100	0.000023700	0.000022400	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000031700	0.000032600	0.000020700	0.000023200	0.000022700	0.000033900	0.000028600	0.000034900	0.000036700	0.000026900	0.000000000	0.000030300	0.000033100	0.000000000	0.000028000	0.000000000	0.000022200	0.000025200	0.000000000	0.000000000	0.000000000
C10H8O6S	256.004222	0.800	0.600	0.00	0.1000	0.0000	0.50	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000028000	0.000023000	0.000019200	0.000000000	0.000025800	0.000020100
C14H8O3S	256.019441	0.571	0.214	0.00	0.0714	0.0000	0.74	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000
C11H12O3S2	256.022839	1.091	0.273	0.00	0.1818	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028200	0.000000000	0.000034900	0.000025300	0.000023500	0.000020500	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031100	0.000036200	0.000000000	0.000000000	0.000027800	0.000037300	0.000044400	0.000046000	0.000019800	0.000021000	0.000032500	0.000027200	0.000034600	0.000033100	0.000000000	0.000000000	0.000020700	0.000020900	0.000000000	0.000000000
C14H8O5	256.037185	0.571	0.357	0.00	0.0000	0.0000	0.74	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000097400	0.000098500	0.000067100	0.000080100	0.000062500	0.000072800	0.000072100	0.000091600	0.000117900	0.000098400	0.000092300	0.000097000	0.000085400	0.000037300	0.000094600	0.000053600	0.000044200	0.000069300	0.000047400	0.000088900	0.000085800	0.000084700	0.000044100	0.000078200	0.000090000	0.000074800	0.000058600	0.000063200	0.000060800	0.000161500	0.000107400	0.000120600	0.000107200	0.000209500	0.000198200
C11H12O5S	256.040588	1.091	0.455	0.00	0.0909	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000094700	0.000056100	0.000107300	0.000128200	0.000086800	0.000097300	0.000097600	0.000066000	0.000063600	0.000048400	0.000043800	0.000061000	0.000059200	0.000092800	0.000078400	0.000132900	0.000127100	0.000087600	0.000086800	0.000100600	0.000104500	0.000127500	0.000124800	0.000088300	0.000087200	0.000105700	0.000100500	0.000118200	0.000121200	0.000056300	0.000058500	0.000109700	0.000101500	0.000037400	0.000042200
C13H8N2O4	256.048437	0.615	0.308	0.15	0.0000	0.0000	0.78	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000023900	0.000000000	0.000020600	0.000000000	0.000018700	0.000020300	0.000028100	0.000024100
C15H12O2S	256.055793	0.800	0.133	0.00	0.0667	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025700	0.000000000	0.000000000	0.000027300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000021500	0.000024800	0.000019100	0.000000000	0.000000000	0.000000000	0.000023100	0.000020400	0.000018900	0.000022000	0.000000000	0.000023300	0.000031600	0.000025400	0.000000000	0.000000000	0.000033400	0.000026300	0.000000000	0.000000000
C11H12O7	256.058328	1.091	0.636	0.00	0.0000	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000192800	0.000154700	0.000110000	0.000142900	0.000129500	0.000155200	0.000154000	0.000156800	0.000193400	0.000172700	0.000141200	0.000160500	0.000161100	0.000143700	0.000105200	0.000137200	0.000129200	0.000184100	0.000159000	0.000146900	0.000149200	0.000095800	0.000109800	0.000208600	0.000228000	0.000161300	0.000161200	0.000173400	0.000189400	0.000466100	0.000404600	0.000212500	0.000204100	0.000334400	0.000327600
C12H16O2S2	256.059217	1.333	0.167	0.00	0.1667	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H12N2O6	256.069517	1.200	0.600	0.20	0.0000	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019200	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026400	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000018400	0.000022600	0.000000000	0.000032000	0.000000000	0.000000000	0.000000000	0.000022300
C15H12O4	256.073547	0.800	0.267	0.00	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000253500	0.000200100	0.000195200	0.000220500	0.000214700	0.000206600	0.000210500	0.000231600	0.000231500	0.000212700	0.000201400	0.000208500	0.000204800	0.000181100	0.000194500	0.000184800	0.000175900	0.000198900	0.000184400	0.000207000	0.000216100	0.000184000	0.000180200	0.000239800	0.000254200	0.000190000	0.000181500	0.000237900	0.000234100	0.000232800	0.000219800	0.000271300	0.000296700	0.000301600	0.000307300
C12H16O4S	256.076946	1.333	0.333	0.00	0.0833	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000082200	0.000043300	0.000123300	0.000127000	0.000087200	0.000095900	0.000097800	0.000051600	0.000046500	0.000042200	0.000041200	0.000057400	0.000047600	0.000094700	0.000088300	0.000130600	0.000133400	0.000071000	0.000088100	0.000113800	0.000110900	0.000158200	0.000153900	0.000075800	0.000063400	0.000101900	0.000110200	0.000119600	0.000125200	0.000026000	0.000027500	0.000103600	0.000092500	0.000026000	0.000027500
C14H12N2O3	256.084832	0.857	0.214	0.14	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000040800	0.000023400	0.000029600	0.000037900	0.000031100	0.000023000	0.000029000	0.000032400	0.000018000	0.000027300	0.000026700	0.000024100	0.000024500	0.000021500	0.000023400	0.000036400	0.000023400	0.000022200	0.000022500	0.000025800	0.000037000	0.000038000	0.000029100	0.000026300	0.000027600	0.000032800	0.000032900	0.000044800	0.000036100	0.000036800	0.000033200	0.000043900	0.000042100	0.000027200	0.000040300
C12H16O6	256.094688	1.333	0.500	0.00	0.0000	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001100500	0.001169900	0.001353300	0.001310000	0.001498100	0.001545700	0.001442600	0.001265400	0.001295600	0.001178600	0.000982700	0.001187000	0.001102600	0.001622900	0.001584800	0.001744600	0.001617900	0.001722200	0.001893100	0.001401400	0.001352700	0.001480200	0.001503600	0.001329800	0.001432700	0.001468800	0.001386700	0.001491500	0.001495400	0.002075100	0.001911600	0.001402000	0.001379800	0.001281900	0.001386000
C11H16N2O5	256.105940	1.455	0.455	0.18	0.0000	0.0000	0.08	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000024200	0.000026800	0.000031300	0.000024600	0.000026000	0.000033000	0.000028300	0.000000000	0.000025800	0.000000000	0.000000000	0.000025400	0.000022100	0.000029100	0.000031900	0.000031200	0.000040400	0.000032800	0.000034000	0.000028200	0.000027700	0.000044900	0.000037600	0.000029300	0.000031000	0.000032700	0.000000000	0.000033100	0.000028300	0.000041900	0.000029800	0.000032500	0.000032000	0.000030300	0.000026400
C16H16O3	256.109931	1.000	0.188	0.00	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000148600	0.000159900	0.000158300	0.000152200	0.000168000	0.000181100	0.000173100	0.000198600	0.000182000	0.000194200	0.000194900	0.000186900	0.000169700	0.000176900	0.000200000	0.000167200	0.000161700	0.000157000	0.000195300	0.000171000	0.000169400	0.000171400	0.000168700	0.000160600	0.000181400	0.000150100	0.000156300	0.000172900	0.000160000	0.000136400	0.000144800	0.000186100	0.000185000	0.000173300	0.000181700
C13H20O3S	256.113309	1.538	0.231	0.00	0.0769	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000027300	0.000027100	0.000046400	0.000051400	0.000031000	0.000034200	0.000027500	0.000019400	0.000018300	0.000000000	0.000000000	0.000018100	0.000000000	0.000043000	0.000039400	0.000046100	0.000048400	0.000024100	0.000027400	0.000039800	0.000045700	0.000060800	0.000060000	0.000027700	0.000027900	0.000033300	0.000042600	0.000041600	0.000042400	0.000000000	0.000000000	0.000032000	0.000033300	0.000000000	0.000000000
C15H16N2O2	256.121226	1.067	0.133	0.13	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018800	0.000000000	0.000000000	0.000028500	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000020300	0.000018000	0.000028600	0.000018900	0.000024800	0.000000000	0.000000000	0.000019900	0.000000000	0.000018500	0.000021100	0.000000000	0.000000000	0.000025200	0.000018500	0.000021100	0.000021800	0.000028600	0.000019400	0.000000000	0.000000000
C13H20O5	256.131060	1.538	0.385	0.00	0.0000	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000575200	0.000708100	0.001040600	0.000779800	0.001124500	0.001072100	0.001050300	0.000845000	0.000749500	0.000682300	0.000590200	0.000743000	0.000644900	0.001089000	0.001291400	0.001237300	0.001089500	0.001156800	0.001363200	0.000975400	0.000979400	0.001191300	0.001194100	0.000723100	0.000754900	0.000946900	0.000927900	0.000854500	0.000869700	0.000940100	0.000905300	0.000771900	0.000733500	0.000632600	0.000702200
C17H20O2	256.146334	1.176	0.118	0.00	0.0000	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044400	0.000078100	0.000057700	0.000060600	0.000081000	0.000079600	0.000072500	0.000092700	0.000081700	0.000083300	0.000081200	0.000090800	0.000068500	0.000074900	0.000103100	0.000077900	0.000068100	0.000074000	0.000099800	0.000070600	0.000068000	0.000069100	0.000067600	0.000067100	0.000066800	0.000065000	0.000065700	0.000061700	0.000064700	0.000058400	0.000057600	0.000068000	0.000060800	0.000066500	0.000069600
C14H24O4	256.167454	1.714	0.286	0.00	0.0000	0.0000	0.08	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000041600	0.000053700	0.000085300	0.000063900	0.000089700	0.000099600	0.000093200	0.000061200	0.000053500	0.000050000	0.000056700	0.000053000	0.000042000	0.000091600	0.000112700	0.000106500	0.000097700	0.000094700	0.000120500	0.000087100	0.000088800	0.000110400	0.000110900	0.000063000	0.000061100	0.000074600	0.000075600	0.000069000	0.000073500	0.000068800	0.000059200	0.000068600	0.000054500	0.000053000	0.000056000
C13H7NO5	257.032413	0.538	0.385	0.08	0.0000	0.0000	0.79	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019900	0.000000000	0.000018600	0.000023200	0.000000000	0.000000000	0.000019000	0.000000000	0.000031500	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000022600	0.000023800	0.000020700	0.000020800	0.000000000	0.000000000	0.000030000	0.000032500	0.000030600	0.000029400	0.000043600	0.000037200
C10H11NO5S	257.035784	1.100	0.500	0.10	0.1000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034700	0.000000000	0.000046000	0.000047500	0.000037200	0.000036000	0.000041500	0.000021800	0.000037000	0.000018400	0.000021900	0.000000000	0.000020500	0.000033500	0.000027900	0.000039600	0.000037400	0.000026000	0.000029900	0.000038600	0.000042800	0.000054900	0.000061800	0.000037400	0.000030100	0.000035100	0.000035400	0.000049200	0.000057500	0.000043000	0.000035500	0.000043200	0.000046900	0.000020900	0.000000000
C14H11NO2S	257.051055	0.786	0.143	0.07	0.0714	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000000000	0.000000000	0.000000000	0.000028400	0.000000000	0.000000000	0.000000000
C10H11NO7	257.053534	1.100	0.700	0.10	0.0000	0.0000	0.27	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000028400	0.000000000	0.000021300	0.000028500	0.000019200
C14H11NO4	257.068837	0.786	0.286	0.07	0.0000	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000078700	0.000047700	0.000066100	0.000089900	0.000063000	0.000065800	0.000060900	0.000052900	0.000055100	0.000050300	0.000045200	0.000053000	0.000048400	0.000056000	0.000058400	0.000063800	0.000077600	0.000063800	0.000050500	0.000055600	0.000058100	0.000073300	0.000068400	0.000066900	0.000072500	0.000057800	0.000054100	0.000086800	0.000091800	0.000043500	0.000055200	0.000094300	0.000088300	0.000067200	0.000068800
C11H15NO4S	257.072179	1.364	0.364	0.09	0.0909	0.0000	0.14	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037400	0.000018700	0.000065600	0.000049000	0.000043100	0.000041600	0.000040800	0.000022400	0.000024300	0.000000000	0.000000000	0.000000000	0.000020400	0.000031300	0.000034100	0.000052500	0.000048600	0.000028000	0.000025800	0.000058500	0.000056800	0.000089500	0.000079700	0.000018600	0.000031900	0.000049600	0.000041700	0.000053500	0.000055600	0.000020300	0.000000000	0.000047500	0.000045400	0.000000000	0.000000000
C11H15NO6	257.089946	1.364	0.545	0.09	0.0000	0.0000	0.14	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000091400	0.000069800	0.000085300	0.000096600	0.000094800	0.000100900	0.000094100	0.000058700	0.000071000	0.000053200	0.000053600	0.000058700	0.000064300	0.000101300	0.000081700	0.000119600	0.000109300	0.000109300	0.000096300	0.000100000	0.000092900	0.000117800	0.000125100	0.000094900	0.000101700	0.000097200	0.000093200	0.000112800	0.000116300	0.000160000	0.000149400	0.000104100	0.000105600	0.000078200	0.000089100
C15H15NO3	257.105241	1.000	0.200	0.07	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000049000	0.000026500	0.000048300	0.000057300	0.000051500	0.000042900	0.000058500	0.000046700	0.000038300	0.000043000	0.000031300	0.000042900	0.000037100	0.000052800	0.000061200	0.000067000	0.000054200	0.000042700	0.000050000	0.000053400	0.000058600	0.000070700	0.000059300	0.000055100	0.000054200	0.000044000	0.000046700	0.000061400	0.000066800	0.000030100	0.000034600	0.000071700	0.000056800	0.000042000	0.000034000
C12H19NO3S	257.108607	1.583	0.250	0.08	0.0833	0.0000	0.06	4	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000020400	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000027200	0.000029600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H19NO5	257.126363	1.583	0.417	0.08	0.0000	0.0000	0.06	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000032300	0.000021900	0.000072400	0.000046800	0.000068300	0.000053800	0.000065800	0.000039800	0.000026300	0.000000000	0.000000000	0.000028900	0.000024500	0.000055700	0.000063600	0.000077600	0.000060100	0.000052300	0.000067300	0.000056700	0.000063700	0.000090800	0.000095000	0.000039400	0.000031500	0.000057300	0.000055400	0.000050700	0.000049700	0.000052100	0.000045100	0.000027100	0.000042800	0.000019300	0.000027300
C16H19NO2	257.141631	1.188	0.125	0.06	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000025700	0.000000000	0.000022100	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H10O4S2	258.002091	1.000	0.400	0.00	0.2000	0.0000	0.33	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000021800	0.000000000	0.000000000	0.000027700	0.000000000	0.000026000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000027600	0.000031700	0.000018500	0.000000000	0.000020900	0.000022000	0.000024100	0.000020600	0.000021900	0.000020300	0.000021200	0.000020900	0.000029400	0.000035700	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000
C13H6O6	258.016476	0.462	0.462	0.00	0.0000	0.0000	0.80	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000032500	0.000023700	0.000000000	0.000000000	0.000000000	0.000020400	0.000024300	0.000019200	0.000029000	0.000027700	0.000021400	0.000023700	0.000031000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000029400	0.000019200	0.000000000	0.000000000	0.000024100	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000037800	0.000030800	0.000033300	0.000029000	0.000087500	0.000082800
C10H10O6S	258.019855	1.000	0.600	0.00	0.1000	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026600	0.000027000	0.000029500	0.000033900	0.000039200	0.000034000	0.000033200	0.000028400	0.000024600	0.000034300	0.000031000	0.000026900	0.000030000	0.000026200	0.000022300	0.000038600	0.000035500	0.000024500	0.000036400	0.000033400	0.000030300	0.000028500	0.000034900	0.000032000	0.000037900	0.000034500	0.000042500	0.000034600	0.000040800	0.000032500	0.000027900	0.000037000	0.000037300	0.000020100	0.000025700
C14H10O3S	258.035082	0.714	0.214	0.00	0.0714	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000046300	0.000000000	0.000024500	0.000047300	0.000024800	0.000030900	0.000027600	0.000021600	0.000000000	0.000023200	0.000020200	0.000000000	0.000020200	0.000031800	0.000031300	0.000039100	0.000045100	0.000019900	0.000000000	0.000000000	0.000021600	0.000032600	0.000041200	0.000030100	0.000038100	0.000018900	0.000027200	0.000053900	0.000044000	0.000000000	0.000000000	0.000047800	0.000036900	0.000000000	0.000000000
C10H10O8	258.037629	1.000	0.800	0.00	0.0000	0.0000	0.33	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025700	0.000019100	0.000018300	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000056900	0.000045100	0.000019700	0.000028300	0.000057000	0.000044600
C11H14O3S2	258.038483	1.273	0.273	0.00	0.1818	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023000	0.000000000	0.000033700	0.000029200	0.000000000	0.000027100	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000035000	0.000033600	0.000000000	0.000020200	0.000033000	0.000028300	0.000047900	0.000047800	0.000000000	0.000000000	0.000025100	0.000019500	0.000026700	0.000028000	0.000000000	0.000000000	0.000025300	0.000024100	0.000000000	0.000000000
C14H10O5	258.052823	0.714	0.357	0.00	0.0000	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000231700	0.000189800	0.000162200	0.000178500	0.000168500	0.000164300	0.000171900	0.000208600	0.000216000	0.000198900	0.000192200	0.000191500	0.000204400	0.000138600	0.000117800	0.000121700	0.000117400	0.000149400	0.000144300	0.000188200	0.000183700	0.000135600	0.000109500	0.000210000	0.000238900	0.000154300	0.000158700	0.000191700	0.000176400	0.000242300	0.000218400	0.000243900	0.000261400	0.000341300	0.000357200
C11H14O5S	258.056233	1.273	0.455	0.00	0.0909	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000133000	0.000082400	0.000175300	0.000190200	0.000143500	0.000147400	0.000130300	0.000083300	0.000086400	0.000066800	0.000053900	0.000073100	0.000079100	0.000149800	0.000136300	0.000205600	0.000206600	0.000131600	0.000141600	0.000178700	0.000199100	0.000232100	0.000218200	0.000130300	0.000121200	0.000148800	0.000156000	0.000193700	0.000198300	0.000129800	0.000122700	0.000158400	0.000129200	0.000056000	0.000076800
C13H10N2O4	258.064073	0.769	0.308	0.15	0.0000	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028900	0.000025400	0.000025600	0.000035300	0.000021500	0.000032700	0.000030700	0.000027900	0.000029500	0.000029800	0.000024500	0.000032500	0.000018200	0.000025200	0.000021400	0.000026500	0.000026600	0.000028100	0.000026600	0.000026200	0.000020500	0.000025800	0.000026900	0.000036200	0.000039300	0.000024500	0.000031700	0.000036800	0.000030800	0.000031600	0.000028600	0.000044400	0.000049400	0.000028300	0.000032100
C15H14O2S	258.071442	0.933	0.133	0.00	0.0667	0.0000	0.54	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022800	0.000000000	0.000018400	0.000034600	0.000023400	0.000021400	0.000025100	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000023200	0.000024100	0.000042800	0.000039700	0.000024500	0.000020600	0.000018800	0.000026600	0.000026300	0.000028500	0.000026600	0.000000000	0.000026000	0.000000000	0.000040900	0.000049000	0.000000000	0.000000000	0.000040300	0.000038200	0.000000000	0.000000000
C11H14O7	258.073969	1.273	0.636	0.00	0.0000	0.0000	0.20	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000332800	0.000301300	0.000257200	0.000321900	0.000301500	0.000337200	0.000302800	0.000295700	0.000367800	0.000316900	0.000272200	0.000290200	0.000307600	0.000363300	0.000272300	0.000341700	0.000353400	0.000432700	0.000400900	0.000291400	0.000300800	0.000265600	0.000284800	0.000379100	0.000439800	0.000373100	0.000343200	0.000405600	0.000397000	0.000941600	0.000785500	0.000397600	0.000380900	0.000520500	0.000524200
C10H14N2O6	258.085207	1.400	0.600	0.20	0.0000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000019900	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000018400	0.000021400	0.000000000	0.000000000	0.000023900	0.000020700	0.000000000	0.000000000	0.000000000
C15H14O4	258.089194	0.933	0.267	0.00	0.0000	0.0000	0.54	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000346300	0.000326400	0.000344400	0.000341000	0.000351700	0.000341000	0.000327900	0.000364800	0.000348500	0.000345400	0.000324800	0.000333900	0.000319900	0.000315700	0.000358200	0.000332100	0.000320900	0.000328700	0.000325000	0.000348600	0.000339800	0.000370800	0.000355800	0.000353000	0.000347500	0.000322500	0.000311100	0.000357300	0.000354400	0.000311500	0.000293300	0.000396900	0.000408000	0.000358300	0.000376800
C12H18O4S	258.092585	1.500	0.333	0.00	0.0833	0.0000	0.11	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000061300	0.000032900	0.000099100	0.000096700	0.000076400	0.000079100	0.000068100	0.000046800	0.000048300	0.000035500	0.000037400	0.000035600	0.000033500	0.000057400	0.000083100	0.000107500	0.000100300	0.000070200	0.000075700	0.000087000	0.000088700	0.000117400	0.000112100	0.000051400	0.000061600	0.000076900	0.000072700	0.000090100	0.000093500	0.000020600	0.000018400	0.000077400	0.000063900	0.000021100	0.000000000
C14H14N2O3	258.100489	1.000	0.214	0.14	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000040500	0.000036900	0.000032200	0.000039600	0.000036300	0.000030000	0.000039000	0.000037000	0.000043200	0.000031100	0.000024500	0.000036100	0.000030100	0.000040200	0.000038200	0.000047900	0.000043800	0.000034600	0.000035300	0.000030600	0.000035800	0.000041200	0.000036300	0.000041500	0.000047000	0.000028000	0.000037600	0.000046700	0.000052600	0.000049500	0.000051800	0.000048900	0.000051300	0.000039400	0.000036000
C12H18O6	258.110326	1.500	0.500	0.00	0.0000	0.0000	0.11	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000678200	0.000774400	0.000992400	0.000875900	0.001028000	0.001034200	0.000959400	0.000803400	0.000793000	0.000709500	0.000597400	0.000775500	0.000681800	0.001013600	0.001101100	0.001234400	0.001118600	0.001175600	0.001363200	0.000985500	0.000919100	0.001067700	0.001075600	0.000846900	0.000865100	0.001006500	0.000954900	0.000962900	0.000937800	0.001364000	0.001256600	0.000856400	0.000831500	0.000790700	0.000862700
C16H18O3	258.125596	1.125	0.188	0.00	0.0000	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000175800	0.000247900	0.000217000	0.000201700	0.000264300	0.000230400	0.000243900	0.000296400	0.000256500	0.000288000	0.000273800	0.000275900	0.000227700	0.000256000	0.000300700	0.000231500	0.000243300	0.000246800	0.000279500	0.000235500	0.000228600	0.000241200	0.000221800	0.000202300	0.000216800	0.000235700	0.000218700	0.000215700	0.000219400	0.000172000	0.000158100	0.000226000	0.000216800	0.000202700	0.000231500
C13H22O3S	258.128960	1.692	0.231	0.00	0.0769	0.0000	0.05	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000032600	0.000017900	0.000000000	0.000000000	0.000018900	0.000024200	0.000033300	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H18N2O2	258.136885	1.200	0.133	0.13	0.0000	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018900	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000024600	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000024800	0.000021700	0.000028700	0.000019700	0.000023500	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000020300	0.000000000	0.000019800	0.000026700	0.000025900	0.000000000	0.000019300	0.000027500	0.000026800	0.000021800	0.000000000
C13H22O5	258.146719	1.692	0.385	0.00	0.0000	0.0000	0.05	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000094100	0.000108700	0.000191400	0.000127700	0.000210200	0.000194200	0.000193200	0.000138300	0.000119700	0.000105100	0.000099300	0.000131200	0.000100000	0.000190900	0.000227200	0.000207700	0.000196700	0.000203100	0.000260600	0.000190900	0.000180600	0.000228700	0.000232800	0.000126600	0.000118300	0.000176600	0.000171800	0.000134700	0.000142600	0.000162300	0.000139200	0.000127600	0.000116300	0.000107100	0.000121700
C17H22O2	258.162018	1.294	0.118	0.00	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000050700	0.000081000	0.000056400	0.000063300	0.000061200	0.000077500	0.000063400	0.000092700	0.000098500	0.000094300	0.000088700	0.000099400	0.000071100	0.000089200	0.000109200	0.000071700	0.000082900	0.000080000	0.000097600	0.000066300	0.000058500	0.000054800	0.000064700	0.000071100	0.000067700	0.000069800	0.000069400	0.000059200	0.000062300	0.000064100	0.000056000	0.000067100	0.000052100	0.000062100	0.000068000
C13H9NO3S	259.030336	0.692	0.231	0.08	0.0769	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000023000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000022800	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000020200	0.000000000	0.000000000	0.000031500	0.000020900	0.000000000	0.000000000	0.000026000	0.000030000	0.000000000	0.000000000
C13H9NO5	259.048109	0.692	0.385	0.08	0.0000	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000046300	0.000018800	0.000033000	0.000044100	0.000037300	0.000037900	0.000035900	0.000038400	0.000052000	0.000028500	0.000033900	0.000023200	0.000033900	0.000028400	0.000031600	0.000028200	0.000042300	0.000023200	0.000031600	0.000030400	0.000030300	0.000040500	0.000036600	0.000049400	0.000050700	0.000035800	0.000030600	0.000041100	0.000042000	0.000043200	0.000041400	0.000055200	0.000055300	0.000061200	0.000056400
C10H13NO5S	259.051448	1.300	0.500	0.10	0.1000	0.0000	0.09	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000054900	0.000000000	0.000076000	0.000072100	0.000047200	0.000047600	0.000055800	0.000023800	0.000026800	0.000000000	0.000000000	0.000000000	0.000020100	0.000042900	0.000040600	0.000067700	0.000073900	0.000045600	0.000043900	0.000077600	0.000074500	0.000097800	0.000104400	0.000029800	0.000042900	0.000049100	0.000051200	0.000091100	0.000074000	0.000018800	0.000000000	0.000051900	0.000060400	0.000000000	0.000000000
C14H13NO2S	259.066757	0.929	0.143	0.07	0.0714	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H13NO7	259.069235	1.300	0.700	0.10	0.0000	0.0000	0.09	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000031100	0.000022000	0.000000000	0.000000000	0.000019000	0.000022000
C14H13NO4	259.084509	0.929	0.286	0.07	0.0000	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000106600	0.000069000	0.000093300	0.000117800	0.000098400	0.000094800	0.000087200	0.000072600	0.000071300	0.000058500	0.000059600	0.000067800	0.000062800	0.000088800	0.000089300	0.000107500	0.000107300	0.000081300	0.000076100	0.000078000	0.000096700	0.000128600	0.000116500	0.000099500	0.000093100	0.000085900	0.000101300	0.000124600	0.000118900	0.000070200	0.000068000	0.000124400	0.000108100	0.000067300	0.000070800
C11H17NO4S	259.087877	1.545	0.364	0.09	0.0909	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000019900	0.000000000	0.000034700	0.000027500	0.000028600	0.000024000	0.000028100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000031100	0.000000000	0.000000000	0.000033300	0.000042000	0.000040500	0.000040000	0.000000000	0.000000000	0.000023200	0.000029800	0.000000000	0.000030800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H17NO6	259.105646	1.545	0.545	0.09	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	0	0	0	0	0	0.000024600	0.000018700	0.000041400	0.000039400	0.000031900	0.000032600	0.000029000	0.000021300	0.000025900	0.000018900	0.000000000	0.000023000	0.000000000	0.000028400	0.000026200	0.000043300	0.000042000	0.000029400	0.000040300	0.000029400	0.000037300	0.000047400	0.000042100	0.000027300	0.000037500	0.000043100	0.000031600	0.000034100	0.000031700	0.000043100	0.000040000	0.000034500	0.000023400	0.000021400	0.000023100
C15H17NO3	259.120864	1.133	0.200	0.07	0.0000	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000056400	0.000042300	0.000066900	0.000070400	0.000055000	0.000057600	0.000061600	0.000046700	0.000049900	0.000051800	0.000041400	0.000039600	0.000041200	0.000070100	0.000070400	0.000071900	0.000068300	0.000065900	0.000063800	0.000062600	0.000065200	0.000086900	0.000069900	0.000048400	0.000052900	0.000050000	0.000058500	0.000068100	0.000064900	0.000047400	0.000047300	0.000059800	0.000061500	0.000034400	0.000037900
C16H21NO2	259.157200	1.312	0.125	0.06	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000022100	0.000000000	0.000000000	0.000000000	0.000024400	0.000021200	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000021600
C13H8O4S	260.014329	0.615	0.308	0.00	0.0769	0.0000	0.70	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000050700	0.000024900	0.000020500	0.000049700	0.000022900	0.000028900	0.000018300	0.000020700	0.000029800	0.000025400	0.000022900	0.000024800	0.000019600	0.000018900	0.000019800	0.000035000	0.000024200	0.000029200	0.000018100	0.000025000	0.000023800	0.000022900	0.000031200	0.000036900	0.000039600	0.000025200	0.000018600	0.000045900	0.000047600	0.000000000	0.000000000	0.000051000	0.000059300	0.000019600	0.000021000
C10H12O4S2	260.017732	1.200	0.400	0.00	0.2000	0.0000	0.17	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000034600	0.000000000	0.000044900	0.000037400	0.000019600	0.000034000	0.000029800	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000023700	0.000047100	0.000042800	0.000000000	0.000026800	0.000039500	0.000043000	0.000060000	0.000054000	0.000021500	0.000020800	0.000027000	0.000033700	0.000044500	0.000050200	0.000000000	0.000000000	0.000036800	0.000033700	0.000000000	0.000000000
C13H8O6	260.032071	0.615	0.462	0.00	0.0000	0.0000	0.70	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000141400	0.000100100	0.000082600	0.000067100	0.000078400	0.000075400	0.000083200	0.000111200	0.000137300	0.000112600	0.000116600	0.000098600	0.000113400	0.000055500	0.000040800	0.000048500	0.000049000	0.000072900	0.000059000	0.000122500	0.000115600	0.000051500	0.000046600	0.000111700	0.000115100	0.000074400	0.000067300	0.000080600	0.000088100	0.000140900	0.000136600	0.000156100	0.000153100	0.000280700	0.000286300
C10H12O6S	260.035460	1.200	0.600	0.00	0.1000	0.0000	0.17	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000076500	0.000030900	0.000060400	0.000089500	0.000060800	0.000056900	0.000056600	0.000033400	0.000058700	0.000036400	0.000044500	0.000042600	0.000044900	0.000062200	0.000046500	0.000068100	0.000072400	0.000067000	0.000063100	0.000064600	0.000068000	0.000072300	0.000078100	0.000067700	0.000074400	0.000077800	0.000069000	0.000102200	0.000090800	0.000046400	0.000039600	0.000082100	0.000078400	0.000032100	0.000028000
C12H8N2O5	260.043367	0.667	0.417	0.17	0.0000	0.0000	0.73	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000018000	0.000000000	0.000023300	0.000022900
C14H12O3S	260.050705	0.857	0.214	0.00	0.0714	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000090800	0.000027300	0.000075900	0.000114500	0.000077100	0.000060800	0.000057300	0.000035800	0.000039400	0.000021800	0.000026500	0.000030500	0.000025500	0.000056400	0.000063000	0.000097400	0.000097200	0.000053200	0.000051800	0.000063800	0.000068600	0.000105300	0.000087000	0.000066300	0.000072000	0.000064300	0.000053800	0.000108300	0.000110300	0.000000000	0.000018300	0.000094900	0.000107900	0.000019600	0.000000000
C10H12O8	260.053203	1.200	0.800	0.00	0.0000	0.0000	0.17	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000037900	0.000026500	0.000021000	0.000018600	0.000023300	0.000041400	0.000020200	0.000025900	0.000044400	0.000033800	0.000031200	0.000028600	0.000036600	0.000022500	0.000000000	0.000020600	0.000000000	0.000031600	0.000022800	0.000035900	0.000029400	0.000000000	0.000000000	0.000032500	0.000036600	0.000027900	0.000022900	0.000021800	0.000020400	0.000136000	0.000096700	0.000042300	0.000046400	0.000089300	0.000095100
C11H16O3S2	260.054089	1.455	0.273	0.00	0.1818	0.0000	0.07	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021500	0.000000000	0.000030800	0.000032100	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000024500	0.000030100	0.000027200	0.000000000	0.000026500	0.000023300	0.000045600	0.000043900	0.000000000	0.000019000	0.000000000	0.000025200	0.000030100	0.000028200	0.000000000	0.000000000	0.000024400	0.000027200	0.000000000	0.000000000
C14H12O5	260.068484	0.857	0.357	0.00	0.0000	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000429600	0.000329500	0.000338900	0.000368700	0.000349200	0.000338600	0.000330100	0.000364500	0.000365700	0.000366200	0.000350200	0.000355000	0.000361500	0.000293100	0.000261300	0.000306300	0.000303700	0.000342300	0.000309400	0.000354000	0.000363600	0.000310300	0.000303100	0.000380300	0.000424500	0.000343300	0.000340200	0.000368600	0.000375900	0.000371000	0.000356400	0.000452900	0.000466000	0.000503800	0.000495800
C11H16O5S	260.071834	1.455	0.455	0.00	0.0909	0.0000	0.07	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000107700	0.000083400	0.000175800	0.000155900	0.000142500	0.000146300	0.000122400	0.000086500	0.000082100	0.000056500	0.000051300	0.000064200	0.000063300	0.000137300	0.000122700	0.000176400	0.000175100	0.000115500	0.000131600	0.000161300	0.000146500	0.000224500	0.000219800	0.000107200	0.000099100	0.000148700	0.000128800	0.000162600	0.000169200	0.000061300	0.000048900	0.000126300	0.000132000	0.000038300	0.000044800
C13H12N2O4	260.079743	0.923	0.308	0.15	0.0000	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000070200	0.000040800	0.000049600	0.000062400	0.000054300	0.000054000	0.000052700	0.000045800	0.000051700	0.000034200	0.000043800	0.000044000	0.000038900	0.000051200	0.000057300	0.000057400	0.000054700	0.000047100	0.000046000	0.000047200	0.000054900	0.000063000	0.000066800	0.000062800	0.000062200	0.000051500	0.000058300	0.000068700	0.000061000	0.000062600	0.000056800	0.000073400	0.000063600	0.000050700	0.000053000
C18H12O2	260.083776	0.667	0.111	0.00	0.0000	0.0000	0.71	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000018400	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000025500	0.000019900	0.000000000	0.000000000	0.000024100
C15H16O2S	260.087140	1.067	0.133	0.00	0.0667	0.0000	0.46	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019100	0.000000000	0.000020300	0.000028400	0.000027800	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000021100	0.000025100	0.000025400	0.000019900	0.000000000	0.000024800	0.000000000	0.000019900	0.000024300	0.000000000	0.000024400	0.000000000	0.000026100	0.000027900	0.000022700	0.000000000	0.000000000	0.000029300	0.000026100	0.000000000	0.000000000
C11H16O7	260.089610	1.455	0.636	0.00	0.0000	0.0000	0.07	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000204100	0.000201500	0.000207300	0.000226200	0.000227900	0.000262700	0.000223000	0.000200400	0.000233000	0.000198200	0.000168100	0.000190900	0.000192200	0.000264700	0.000221700	0.000278300	0.000267800	0.000341100	0.000332500	0.000239600	0.000230800	0.000225600	0.000249700	0.000248000	0.000281800	0.000291600	0.000262300	0.000280400	0.000277600	0.000571500	0.000487900	0.000259600	0.000242500	0.000312000	0.000315200
C15H16O4	260.104916	1.067	0.267	0.00	0.0000	0.0000	0.46	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000342000	0.000442600	0.000416700	0.000383500	0.000425300	0.000422300	0.000404300	0.000461700	0.000438700	0.000436800	0.000416200	0.000457600	0.000393900	0.000425800	0.000460800	0.000431200	0.000414600	0.000433000	0.000437900	0.000383900	0.000394800	0.000440100	0.000415000	0.000388400	0.000376200	0.000407500	0.000409200	0.000375700	0.000376200	0.000333000	0.000313700	0.000410600	0.000353500	0.000367800	0.000374700
C12H20O4S	260.108251	1.667	0.333	0.00	0.0833	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000027200	0.000000000	0.000051800	0.000045800	0.000052100	0.000043100	0.000044600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029900	0.000042100	0.000051900	0.000054100	0.000036100	0.000042500	0.000050700	0.000052000	0.000069900	0.000073400	0.000000000	0.000000000	0.000039400	0.000029600	0.000042400	0.000042700	0.000000000	0.000000000	0.000038000	0.000031200	0.000000000	0.000000000
C14H16N2O3	260.116087	1.143	0.214	0.14	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000060000	0.000047900	0.000050400	0.000070100	0.000052200	0.000061500	0.000053800	0.000054100	0.000045600	0.000044500	0.000032800	0.000049600	0.000044200	0.000060800	0.000062200	0.000063600	0.000056500	0.000044000	0.000048900	0.000050000	0.000059400	0.000067300	0.000069300	0.000059300	0.000058200	0.000056900	0.000058900	0.000074200	0.000073800	0.000075100	0.000068900	0.000072000	0.000067600	0.000053100	0.000044600
C12H20O6	260.126033	1.667	0.500	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000092700	0.000112100	0.000160300	0.000134400	0.000156400	0.000143100	0.000144100	0.000114900	0.000102700	0.000089500	0.000104500	0.000116100	0.000100400	0.000146600	0.000160200	0.000203300	0.000187700	0.000175700	0.000212600	0.000152500	0.000137600	0.000174600	0.000165600	0.000119400	0.000111700	0.000171300	0.000174700	0.000122200	0.000126500	0.000191000	0.000193700	0.000115500	0.000103500	0.000119300	0.000120100
C16H20O3	260.141277	1.250	0.188	0.00	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000190600	0.000301200	0.000243100	0.000226700	0.000269900	0.000272000	0.000263900	0.000353900	0.000301600	0.000331400	0.000317400	0.000330700	0.000257100	0.000301200	0.000346000	0.000289100	0.000283100	0.000283000	0.000342200	0.000234600	0.000249400	0.000261500	0.000228300	0.000251400	0.000240300	0.000271900	0.000267400	0.000222100	0.000218000	0.000194200	0.000200200	0.000247300	0.000204600	0.000217700	0.000228400
C15H20N2O2	260.152475	1.333	0.133	0.13	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000024900	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H24O5	260.162390	1.846	0.385	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H24O2	260.177621	1.412	0.118	0.00	0.0000	0.0000	0.31	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000046500	0.000071600	0.000057400	0.000065000	0.000066300	0.000065400	0.000068400	0.000103500	0.000063700	0.000088300	0.000081100	0.000080700	0.000063300	0.000076400	0.000101600	0.000079700	0.000081400	0.000073400	0.000089900	0.000058100	0.000058500	0.000057600	0.000057300	0.000064700	0.000069200	0.000065300	0.000056700	0.000059400	0.000060900	0.000049400	0.000053400	0.000070500	0.000053000	0.000049100	0.000054700
C12H7NO6	261.027436	0.583	0.500	0.08	0.0000	0.0000	0.75	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024500	0.000000000	0.000000000	0.000000000	0.000027400	0.000027900
C13H11NO3S	261.045991	0.846	0.231	0.08	0.0769	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000038700	0.000000000	0.000029200	0.000040600	0.000026100	0.000030300	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000026500	0.000030800	0.000039900	0.000036200	0.000018100	0.000020200	0.000022100	0.000022500	0.000036300	0.000029000	0.000033900	0.000030400	0.000029400	0.000030500	0.000043300	0.000040100	0.000000000	0.000000000	0.000037100	0.000035900	0.000000000	0.000000000
C13H11NO5	261.063719	0.846	0.385	0.08	0.0000	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000132100	0.000064400	0.000100700	0.000115100	0.000095300	0.000092500	0.000095300	0.000076300	0.000084200	0.000067700	0.000074600	0.000070900	0.000075600	0.000081500	0.000080100	0.000104700	0.000098200	0.000092400	0.000088000	0.000094500	0.000094800	0.000113000	0.000108000	0.000097500	0.000108600	0.000090100	0.000088500	0.000128100	0.000127500	0.000096800	0.000090000	0.000139100	0.000139200	0.000096800	0.000103800
C10H15NO5S	261.067130	1.500	0.500	0.10	0.1000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000037200	0.000038100	0.000026400	0.000024100	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025800	0.000000000	0.000033700	0.000028200	0.000000000	0.000020900	0.000037300	0.000029200	0.000047700	0.000044500	0.000000000	0.000020800	0.000025900	0.000028400	0.000033200	0.000035000	0.000000000	0.000000000	0.000027000	0.000027500	0.000000000	0.000000000
C14H15NO2S	261.082342	1.071	0.143	0.07	0.0714	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022900	0.000000000	0.000000000	0.000032300	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027600	0.000000000	0.000028600	0.000029900	0.000000000	0.000020400	0.000022400	0.000000000	0.000023000	0.000026000	0.000000000	0.000025500	0.000000000	0.000018500	0.000039300	0.000031100	0.000000000	0.000000000	0.000000000	0.000029200	0.000000000	0.000000000
C10H15NO7	261.084848	1.500	0.700	0.10	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000
C14H15NO4	261.100106	1.071	0.286	0.07	0.0000	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000168600	0.000103300	0.000178400	0.000185400	0.000157200	0.000157100	0.000155700	0.000124200	0.000115400	0.000097500	0.000097700	0.000109300	0.000102100	0.000154400	0.000159500	0.000191800	0.000181200	0.000134800	0.000130300	0.000153000	0.000162300	0.000210800	0.000216900	0.000136800	0.000138900	0.000159400	0.000146000	0.000191100	0.000182300	0.000119000	0.000121600	0.000184700	0.000178600	0.000110800	0.000123100
C13H15N3O3	261.111393	1.154	0.231	0.23	0.0000	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000018600
C15H19NO3	261.136533	1.267	0.200	0.07	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000038400	0.000038500	0.000062700	0.000058400	0.000047600	0.000041100	0.000051400	0.000040600	0.000042400	0.000035500	0.000031400	0.000036400	0.000029400	0.000060400	0.000063600	0.000062500	0.000065400	0.000038200	0.000050500	0.000044100	0.000047500	0.000065800	0.000059200	0.000041300	0.000040400	0.000043200	0.000049700	0.000047200	0.000056900	0.000042900	0.000052000	0.000056700	0.000047200	0.000032400	0.000037100
C12H6O5S	261.993630	0.500	0.417	0.00	0.0833	0.0000	0.76	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000
C9H10O5S2	261.996949	1.111	0.556	0.00	0.2222	0.0000	0.11	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020200	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000021100	0.000000000	0.000028500	0.000020400	0.000000000	0.000000000	0.000024200	0.000019200	0.000027800	0.000021200	0.000000000	0.000022600	0.000027100	0.000021900	0.000032800	0.000025900	0.000000000	0.000000000	0.000023000	0.000028600	0.000000000	0.000000000
C12H6O7	262.011408	0.500	0.583	0.00	0.0000	0.0000	0.76	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028900	0.000000000	0.000020200	0.000019200	0.000000000	0.000024500	0.000020100	0.000024700	0.000022200	0.000000000	0.000022700	0.000026000	0.000030000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029000	0.000032800	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000031300	0.000027500	0.000034800	0.000029100	0.000099200	0.000084200
C13H10O2S2	262.012258	0.769	0.154	0.00	0.1538	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000020500	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000
C9H10O7S	262.014718	1.111	0.778	0.00	0.1111	0.0000	0.11	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000
C13H10O4S	262.030036	0.769	0.308	0.00	0.0769	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000076800	0.000026500	0.000050600	0.000079800	0.000054500	0.000045500	0.000044400	0.000035400	0.000037700	0.000036600	0.000026500	0.000038600	0.000029300	0.000046700	0.000042400	0.000071100	0.000065000	0.000040800	0.000041600	0.000046500	0.000040900	0.000059500	0.000059000	0.000059000	0.000067600	0.000038400	0.000046800	0.000079300	0.000087900	0.000000000	0.000000000	0.000081600	0.000073900	0.000024200	0.000021200
C10H14O4S2	262.033391	1.400	0.400	0.00	0.2000	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000030300	0.000000000	0.000054000	0.000042200	0.000030400	0.000027500	0.000031000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028300	0.000023500	0.000032500	0.000044200	0.000019200	0.000026300	0.000052300	0.000049000	0.000071100	0.000077600	0.000000000	0.000019000	0.000030200	0.000046900	0.000037800	0.000050200	0.000000000	0.000000000	0.000034900	0.000032900	0.000000000	0.000000000
C13H10O6	262.047772	0.769	0.462	0.00	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000226400	0.000191100	0.000148700	0.000153300	0.000153900	0.000162300	0.000165800	0.000185700	0.000218000	0.000198300	0.000200700	0.000191900	0.000212300	0.000118300	0.000093800	0.000119300	0.000123800	0.000169300	0.000145700	0.000189900	0.000186800	0.000095100	0.000103600	0.000222600	0.000223100	0.000166000	0.000165800	0.000178700	0.000170900	0.000246300	0.000244600	0.000237800	0.000221000	0.000378800	0.000382800
C10H14O6S	262.051170	1.400	0.600	0.00	0.1000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000068600	0.000048700	0.000061800	0.000083800	0.000073200	0.000076000	0.000068400	0.000053300	0.000068200	0.000039200	0.000049500	0.000055800	0.000047600	0.000074200	0.000065000	0.000092300	0.000094000	0.000077600	0.000073400	0.000074300	0.000075300	0.000079600	0.000086500	0.000063600	0.000076900	0.000080200	0.000092300	0.000099300	0.000092800	0.000063200	0.000061300	0.000071500	0.000060000	0.000040700	0.000041000
C12H10N2O5	262.058961	0.833	0.417	0.17	0.0000	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047400	0.000028100	0.000034900	0.000025900	0.000034000	0.000031500	0.000033700	0.000028200	0.000032300	0.000028600	0.000040600	0.000028100	0.000034000	0.000031400	0.000030700	0.000029000	0.000033300	0.000040400	0.000031800	0.000035300	0.000035600	0.000041800	0.000030900	0.000035500	0.000038900	0.000050100	0.000040200	0.000041600	0.000048800	0.000043200	0.000040600	0.000045700	0.000049800	0.000043100	0.000050900
C17H10O3	262.062978	0.588	0.176	0.00	0.0000	0.0000	0.74	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000046100	0.000032200	0.000019800	0.000021300	0.000000000	0.000024600	0.000000000	0.000032300	0.000038500	0.000030100	0.000031400	0.000033400	0.000030400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000023000	0.000028100	0.000000000	0.000000000	0.000021000	0.000039500	0.000019300	0.000000000	0.000024700	0.000028200	0.000056500	0.000047000	0.000054200	0.000043100	0.000065300	0.000075100
C14H14O3S	262.066381	1.000	0.214	0.00	0.0714	0.0000	0.48	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000082300	0.000022000	0.000101900	0.000110300	0.000089800	0.000087500	0.000071200	0.000050100	0.000043400	0.000032600	0.000036900	0.000032400	0.000033800	0.000077200	0.000069600	0.000115000	0.000109900	0.000067000	0.000062600	0.000085700	0.000086700	0.000133400	0.000121800	0.000053700	0.000070600	0.000071100	0.000079000	0.000117700	0.000117300	0.000000000	0.000000000	0.000111100	0.000094500	0.000000000	0.000021400
C10H14O8	262.068924	1.400	0.800	0.00	0.0000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000018700	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000022900	0.000057200	0.000043100	0.000000000	0.000000000	0.000027500	0.000028300
C11H18O3S2	262.069786	1.636	0.273	0.00	0.1818	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000021300	0.000021500	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000
C14H14O5	262.084114	1.000	0.357	0.00	0.0000	0.0000	0.48	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000723400	0.000678600	0.000727300	0.000687800	0.000726700	0.000719000	0.000689200	0.000707600	0.000670900	0.000670700	0.000641800	0.000666400	0.000669300	0.000666600	0.000651500	0.000709400	0.000645900	0.000709800	0.000709700	0.000708300	0.000687100	0.000729700	0.000716900	0.000688300	0.000718600	0.000703000	0.000682100	0.000708800	0.000696600	0.000627600	0.000664600	0.000741600	0.000783100	0.000747200	0.000757800
C11H18O5S	262.087515	1.636	0.455	0.00	0.0909	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000070200	0.000048100	0.000110800	0.000100900	0.000090100	0.000091700	0.000092800	0.000063100	0.000055700	0.000044900	0.000038600	0.000058000	0.000055800	0.000073800	0.000087800	0.000120400	0.000113900	0.000096500	0.000088400	0.000101900	0.000100400	0.000137300	0.000135700	0.000068100	0.000068300	0.000087200	0.000088200	0.000097600	0.000097300	0.000066600	0.000064600	0.000076100	0.000067000	0.000037600	0.000039900
C13H14N2O4	262.095395	1.077	0.308	0.15	0.0000	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000081000	0.000056100	0.000070500	0.000080000	0.000061300	0.000060300	0.000065100	0.000057800	0.000052600	0.000048400	0.000055800	0.000056400	0.000060400	0.000065700	0.000065800	0.000074700	0.000078800	0.000061700	0.000061500	0.000064000	0.000066500	0.000087400	0.000073200	0.000076900	0.000074300	0.000074500	0.000072900	0.000080300	0.000092000	0.000078700	0.000083200	0.000088400	0.000082900	0.000065200	0.000078400
C18H14O2	262.099388	0.778	0.111	0.00	0.0000	0.0000	0.65	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025200	0.000021100	0.000000000	0.000028500	0.000000000	0.000018100	0.000000000	0.000025700	0.000019400	0.000031100	0.000022400	0.000000000	0.000000000	0.000024400	0.000018600	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000024500	0.000000000	0.000000000	0.000022900	0.000036700	0.000023100	0.000029300	0.000018700	0.000000000	0.000032000	0.000024500	0.000023600	0.000028900	0.000039900	0.000038600
C15H18O2S	262.102741	1.200	0.133	0.00	0.0667	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000021000	0.000020500	0.000025300	0.000022000	0.000026400	0.000022900	0.000019300	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000029500	0.000033700	0.000033500	0.000022800	0.000025000	0.000022100	0.000021700	0.000024000	0.000022700	0.000000000	0.000022300	0.000023700	0.000028000	0.000029900	0.000025000	0.000000000	0.000000000	0.000027900	0.000024300	0.000000000	0.000000000
C11H18O7	262.105244	1.636	0.636	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000037300	0.000043000	0.000037800	0.000055100	0.000054900	0.000047600	0.000043900	0.000034900	0.000033800	0.000038300	0.000042600	0.000038800	0.000038900	0.000055900	0.000043000	0.000067600	0.000067700	0.000063600	0.000067000	0.000042300	0.000052600	0.000048900	0.000051800	0.000045400	0.000061300	0.000059200	0.000055000	0.000059100	0.000053900	0.000106500	0.000103200	0.000059800	0.000052700	0.000063900	0.000073800
C15H18O4	262.120517	1.200	0.267	0.00	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000567800	0.000780300	0.000705200	0.000620600	0.000786400	0.000745100	0.000726200	0.000845700	0.000750300	0.000812000	0.000759300	0.000825700	0.000718400	0.000781800	0.000891600	0.000780400	0.000728300	0.000776700	0.000848400	0.000703500	0.000693000	0.000756300	0.000728300	0.000684000	0.000653900	0.000728900	0.000709500	0.000645900	0.000627900	0.000561100	0.000578200	0.000649600	0.000625600	0.000621600	0.000689700
C12H22O4S	262.123884	1.833	0.333	0.00	0.0833	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000020900	0.000024300	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000019600	0.000019900	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H18N2O3	262.131783	1.286	0.214	0.14	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041800	0.000032700	0.000036100	0.000054700	0.000034200	0.000030800	0.000035300	0.000038900	0.000026800	0.000028300	0.000030100	0.000029600	0.000021100	0.000046600	0.000042200	0.000042700	0.000048200	0.000043300	0.000043300	0.000036200	0.000034200	0.000048900	0.000048100	0.000043900	0.000035700	0.000039300	0.000045000	0.000048500	0.000048200	0.000048400	0.000050800	0.000049600	0.000045400	0.000022000	0.000035000
C12H22O6	262.141635	1.833	0.500	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000020000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029300	0.000000000	0.000025600	0.000028100	0.000019000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000022200
C16H22O3	262.156950	1.375	0.188	0.00	0.0000	0.0000	0.31	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000156000	0.000260300	0.000193800	0.000212800	0.000236600	0.000231600	0.000217700	0.000286200	0.000256300	0.000273500	0.000249000	0.000281400	0.000223000	0.000265900	0.000323300	0.000253400	0.000246400	0.000261600	0.000300900	0.000196800	0.000204600	0.000221700	0.000199600	0.000216200	0.000203700	0.000227000	0.000222400	0.000201500	0.000204600	0.000182900	0.000171400	0.000213400	0.000179100	0.000184100	0.000207300
C17H26O2	262.193306	1.529	0.118	0.00	0.0000	0.0000	0.25	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000019500	0.000023400	0.000024300	0.000021900	0.000037200	0.000032200	0.000023700	0.000035500	0.000041000	0.000021300	0.000029300	0.000031800	0.000020700	0.000036300	0.000039600	0.000036700	0.000027400	0.000036200	0.000029700	0.000028700	0.000000000	0.000023300	0.000024200	0.000024600	0.000028800	0.000020700	0.000031200	0.000023300	0.000028200	0.000023500	0.000000000	0.000029900	0.000020900	0.000020600	0.000024200
C12H9NO4S	263.025251	0.750	0.333	0.08	0.0833	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000031000	0.000019200	0.000021200	0.000040700	0.000023100	0.000000000	0.000030000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000019500	0.000018200	0.000000000	0.000021800	0.000032700	0.000000000	0.000019200	0.000000000	0.000021800	0.000032900	0.000030600	0.000031800	0.000025300	0.000019700	0.000025600	0.000045800	0.000042200	0.000000000	0.000000000	0.000035500	0.000042800	0.000000000	0.000000000
C12H9NO6	263.043041	0.750	0.500	0.08	0.0000	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000040200	0.000027200	0.000018200	0.000024600	0.000023900	0.000023700	0.000027200	0.000024200	0.000031200	0.000029500	0.000024100	0.000023400	0.000023300	0.000028300	0.000000000	0.000000000	0.000000000	0.000019700	0.000020600	0.000023100	0.000025100	0.000000000	0.000020000	0.000036100	0.000032300	0.000025100	0.000032200	0.000024900	0.000031600	0.000039600	0.000047200	0.000040600	0.000034400	0.000048000	0.000050600
C16H9NO3	263.058318	0.562	0.188	0.06	0.0000	0.0000	0.78	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000018400	0.000000000
C13H13NO3S	263.061667	1.000	0.231	0.08	0.0769	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000043400	0.000000000	0.000042000	0.000052000	0.000032800	0.000030600	0.000027000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000039500	0.000028800	0.000043400	0.000044400	0.000021300	0.000020800	0.000034700	0.000035200	0.000049500	0.000046100	0.000022200	0.000030900	0.000033600	0.000028300	0.000047000	0.000048900	0.000000000	0.000000000	0.000048800	0.000036900	0.000000000	0.000000000
C13H13NO5	263.079401	1.000	0.385	0.08	0.0000	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000160900	0.000107400	0.000144000	0.000165800	0.000138800	0.000151900	0.000132200	0.000101800	0.000115200	0.000082800	0.000097600	0.000105000	0.000113300	0.000137500	0.000123300	0.000156900	0.000167900	0.000117900	0.000134900	0.000138500	0.000136400	0.000177900	0.000169500	0.000142700	0.000149900	0.000149300	0.000138000	0.000169700	0.000176400	0.000133100	0.000135600	0.000187100	0.000168400	0.000125100	0.000125100
C14H17NO2S	263.098011	1.214	0.143	0.07	0.0714	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029300	0.000019000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000
C14H17NO4	263.115742	1.214	0.286	0.07	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000149400	0.000103700	0.000180500	0.000170000	0.000166500	0.000154700	0.000160800	0.000114100	0.000116600	0.000095700	0.000096200	0.000115700	0.000111100	0.000161200	0.000188500	0.000194800	0.000190600	0.000148800	0.000159200	0.000165300	0.000169600	0.000227700	0.000206500	0.000126000	0.000132100	0.000157000	0.000152800	0.000167000	0.000176500	0.000145300	0.000142200	0.000156600	0.000175100	0.000106000	0.000111400
C15H21NO3	263.152168	1.400	0.200	0.07	0.0000	0.0000	0.28	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025000	0.000022600	0.000028400	0.000026400	0.000041800	0.000027900	0.000026500	0.000028700	0.000023600	0.000000000	0.000022400	0.000034200	0.000021600	0.000037000	0.000038400	0.000037200	0.000041000	0.000025000	0.000033200	0.000026400	0.000037600	0.000045900	0.000045400	0.000018800	0.000028100	0.000028500	0.000023400	0.000035900	0.000025600	0.000027800	0.000022700	0.000039700	0.000029100	0.000023500	0.000021200
C12H8O3S2	263.991481	0.667	0.250	0.00	0.1667	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019100	0.000000000	0.000019200	0.000024500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000022400	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H8O5S	264.009229	0.667	0.417	0.00	0.0833	0.0000	0.65	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000043000	0.000000000	0.000034500	0.000036200	0.000031000	0.000033300	0.000026100	0.000022800	0.000029700	0.000000000	0.000000000	0.000000000	0.000027600	0.000019700	0.000000000	0.000035600	0.000024300	0.000027200	0.000000000	0.000027100	0.000022800	0.000026200	0.000020200	0.000028300	0.000047000	0.000018600	0.000025600	0.000040700	0.000048200	0.000020900	0.000020600	0.000036400	0.000056700	0.000020100	0.000000000
C9H12O5S2	264.012616	1.333	0.556	0.00	0.2222	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028900	0.000000000	0.000052300	0.000040900	0.000021800	0.000026300	0.000034500	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000020100	0.000022100	0.000037000	0.000040500	0.000027300	0.000024600	0.000045100	0.000050200	0.000058800	0.000070200	0.000021800	0.000000000	0.000041300	0.000030800	0.000041800	0.000045300	0.000000000	0.000000000	0.000033600	0.000033500	0.000000000	0.000000000
C12H8O7	264.027021	0.667	0.583	0.00	0.0000	0.0000	0.65	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000082000	0.000053200	0.000046100	0.000028100	0.000048800	0.000043000	0.000049000	0.000057700	0.000067800	0.000058700	0.000064300	0.000064600	0.000053900	0.000024900	0.000000000	0.000021700	0.000028200	0.000044200	0.000027000	0.000067700	0.000075500	0.000020200	0.000024700	0.000059800	0.000067000	0.000039900	0.000032700	0.000041700	0.000039000	0.000094100	0.000087400	0.000077800	0.000089000	0.000221200	0.000206700
C13H12O2S2	264.027866	0.923	0.154	0.00	0.1538	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000023000	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000027700	0.000000000	0.000000000	0.000022000	0.000019500	0.000000000	0.000000000
C9H12O7S	264.030363	1.333	0.778	0.00	0.1111	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000022100	0.000020800	0.000023700	0.000036200	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900
C11H8N2O6	264.038250	0.727	0.545	0.18	0.0000	0.0000	0.67	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000022500	0.000000000
C16H8O4	264.042317	0.500	0.250	0.00	0.0000	0.0000	0.79	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000030000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000019000	0.000020000	0.000022700	0.000019300	0.000019300	0.000020700	0.000025200	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000018600	0.000000000	0.000000000	0.000025800	0.000020800	0.000000000	0.000019400	0.000021300	0.000036900	0.000039600	0.000029100	0.000030300	0.000057700	0.000059700
C13H12O4S	264.045676	0.923	0.308	0.00	0.0769	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000108600	0.000049100	0.000110500	0.000138600	0.000091200	0.000093300	0.000092000	0.000067700	0.000061700	0.000041800	0.000046900	0.000049100	0.000058800	0.000090800	0.000077800	0.000124700	0.000121000	0.000074100	0.000073500	0.000092100	0.000097200	0.000119500	0.000120100	0.000075900	0.000076600	0.000085800	0.000090000	0.000128900	0.000128300	0.000024100	0.000024100	0.000126200	0.000118400	0.000026700	0.000019600
C10H16O4S2	264.049027	1.600	0.400	0.00	0.2000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025700	0.000025800	0.000019000	0.000020200	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028200	0.000022600	0.000000000	0.000000000	0.000026300	0.000025200	0.000041000	0.000038600	0.000000000	0.000019100	0.000019800	0.000022300	0.000029500	0.000029600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H12O6	264.063443	0.923	0.462	0.00	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000382800	0.000353100	0.000312600	0.000327400	0.000305800	0.000334300	0.000313000	0.000329600	0.000379500	0.000350500	0.000358200	0.000342200	0.000369000	0.000285700	0.000241100	0.000294400	0.000292400	0.000379800	0.000344600	0.000336800	0.000357600	0.000273800	0.000259800	0.000390000	0.000427800	0.000351600	0.000355700	0.000348300	0.000351300	0.000438100	0.000441800	0.000407800	0.000379700	0.000505100	0.000504900
C10H16O6S	264.066810	1.600	0.600	0.00	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000050100	0.000037200	0.000075700	0.000076000	0.000072100	0.000080600	0.000083000	0.000056800	0.000054900	0.000035800	0.000039500	0.000053900	0.000048900	0.000073500	0.000056400	0.000092400	0.000083800	0.000080000	0.000072400	0.000066000	0.000077800	0.000086800	0.000087400	0.000061400	0.000073800	0.000087300	0.000064900	0.000073000	0.000065400	0.000107600	0.000084500	0.000052800	0.000046700	0.000047600	0.000053800
C12H12N2O5	264.074609	1.000	0.417	0.17	0.0000	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000074700	0.000037200	0.000055000	0.000071200	0.000040100	0.000055800	0.000051200	0.000050900	0.000047100	0.000044000	0.000036800	0.000038400	0.000052500	0.000052500	0.000052800	0.000061800	0.000061500	0.000054200	0.000052000	0.000057100	0.000052400	0.000064100	0.000061600	0.000057400	0.000065200	0.000059400	0.000045900	0.000073400	0.000074100	0.000079000	0.000083300	0.000079500	0.000093500	0.000059300	0.000064200
C17H12O3	264.078640	0.706	0.176	0.00	0.0000	0.0000	0.68	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000067300	0.000055400	0.000033700	0.000043200	0.000048400	0.000038800	0.000039800	0.000060700	0.000060800	0.000052900	0.000049700	0.000051600	0.000045900	0.000035500	0.000041800	0.000042000	0.000026600	0.000036500	0.000042800	0.000048900	0.000057200	0.000035200	0.000024000	0.000064500	0.000070800	0.000034400	0.000044000	0.000050700	0.000059300	0.000057700	0.000076400	0.000070500	0.000073700	0.000098200	0.000088000
C14H16O3S	264.082048	1.143	0.214	0.00	0.0714	0.0000	0.39	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000070100	0.000033100	0.000085400	0.000100300	0.000086000	0.000073200	0.000070300	0.000057500	0.000041500	0.000036200	0.000038100	0.000037500	0.000032200	0.000075100	0.000084500	0.000113500	0.000105700	0.000060700	0.000059000	0.000077100	0.000086000	0.000130000	0.000109300	0.000060100	0.000061100	0.000071800	0.000074200	0.000108900	0.000097200	0.000020200	0.000019200	0.000084700	0.000077800	0.000000000	0.000022000
C14H16O5	264.099773	1.143	0.357	0.00	0.0000	0.0000	0.39	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000957200	0.001121300	0.001098200	0.001011900	0.001139800	0.001111400	0.001097300	0.001178900	0.001097800	0.001119300	0.001061300	0.001161400	0.001090500	0.001133600	0.001193500	0.001182600	0.001105700	0.001156100	0.001257800	0.001100500	0.001063900	0.001119600	0.001072400	0.001029600	0.001045800	0.001114500	0.001104100	0.001025100	0.001032300	0.000965600	0.001012800	0.001051300	0.001042100	0.001039500	0.001095000
C11H20O5S	264.103182	1.818	0.455	0.00	0.0909	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000028200	0.000027400	0.000047600	0.000039500	0.000038100	0.000041900	0.000043400	0.000025100	0.000000000	0.000000000	0.000019200	0.000000000	0.000024500	0.000033800	0.000035800	0.000050600	0.000047200	0.000038700	0.000031500	0.000041700	0.000052100	0.000065900	0.000065500	0.000027200	0.000018600	0.000040100	0.000047600	0.000043900	0.000027200	0.000035000	0.000025100	0.000019100	0.000024800	0.000000000	0.000023300
C13H16N2O4	264.111036	1.231	0.308	0.15	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000083700	0.000053400	0.000085200	0.000085900	0.000071700	0.000061700	0.000069800	0.000059700	0.000060700	0.000061300	0.000045500	0.000060200	0.000057700	0.000072300	0.000075100	0.000091800	0.000104500	0.000073700	0.000075600	0.000078700	0.000076200	0.000114600	0.000096800	0.000079800	0.000077200	0.000090200	0.000087000	0.000082900	0.000093500	0.000112200	0.000104400	0.000090400	0.000087300	0.000075100	0.000070300
C18H16O2	264.115023	0.889	0.111	0.00	0.0000	0.0000	0.59	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025100	0.000023500	0.000024900	0.000020300	0.000034500	0.000024300	0.000028800	0.000030800	0.000025200	0.000032300	0.000020800	0.000032500	0.000023700	0.000028200	0.000030300	0.000027700	0.000000000	0.000024100	0.000000000	0.000024100	0.000024500	0.000026900	0.000021700	0.000030900	0.000037100	0.000019600	0.000000000	0.000025300	0.000035600	0.000019500	0.000022700	0.000029900	0.000036900	0.000026800	0.000033900
C15H20O2S	264.118388	1.333	0.133	0.00	0.0667	0.0000	0.31	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000024400	0.000030400	0.000023000	0.000019800	0.000000000	0.000024100	0.000018800	0.000000000	0.000000000	0.000017900	0.000000000	0.000023900	0.000020000	0.000029900	0.000026300	0.000000000	0.000034900	0.000000000	0.000000000	0.000023200	0.000024300	0.000000000	0.000000000	0.000020400	0.000020500	0.000024200	0.000033400	0.000000000	0.000000000	0.000023600	0.000024800	0.000000000	0.000000000
C15H20O4	264.136160	1.333	0.267	0.00	0.0000	0.0000	0.31	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000681500	0.000937200	0.000853900	0.000809100	0.000996100	0.000935800	0.000897800	0.001077700	0.000931300	0.000964600	0.000904900	0.001041700	0.000839800	0.001030900	0.001203400	0.001061800	0.000955400	0.001013400	0.001187800	0.000856400	0.000830600	0.000935900	0.000917400	0.000814500	0.000830300	0.000892900	0.000900900	0.000852100	0.000822200	0.000779400	0.000784100	0.000843400	0.000821600	0.000755400	0.000847700
C14H20N2O3	264.147432	1.429	0.214	0.14	0.0000	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000019500	0.000020700	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000023800	0.000028100	0.000019900	0.000028100	0.000000000	0.000018200	0.000018800	0.000000000	0.000023200	0.000025600	0.000021200	0.000027200	0.000019900	0.000024500	0.000020000	0.000022600	0.000000000	0.000019000	0.000029900	0.000020400	0.000000000	0.000000000
C16H24O3	264.172601	1.500	0.188	0.00	0.0000	0.0000	0.24	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000078200	0.000112000	0.000104100	0.000102500	0.000130800	0.000130200	0.000135200	0.000150300	0.000122600	0.000139600	0.000114700	0.000140700	0.000114900	0.000150100	0.000203100	0.000150700	0.000142900	0.000146000	0.000180300	0.000106900	0.000118600	0.000129600	0.000126800	0.000115700	0.000114100	0.000119300	0.000129500	0.000112100	0.000107800	0.000105300	0.000116700	0.000121900	0.000100400	0.000094800	0.000104500
C15H7NO4	265.037536	0.467	0.267	0.07	0.0000	0.0000	0.83	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000026900	0.000000000
C12H11NO4S	265.040887	0.917	0.333	0.08	0.0833	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047900	0.000021200	0.000044600	0.000060700	0.000038500	0.000032800	0.000025600	0.000000000	0.000022000	0.000020200	0.000021100	0.000020400	0.000023900	0.000034400	0.000023200	0.000039000	0.000047000	0.000034200	0.000028600	0.000039600	0.000034500	0.000050800	0.000048900	0.000031300	0.000046600	0.000034200	0.000039900	0.000060000	0.000063500	0.000020100	0.000000000	0.000055200	0.000062700	0.000020400	0.000000000
C12H11NO6	265.058682	0.917	0.500	0.08	0.0000	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000075600	0.000053200	0.000055100	0.000067700	0.000051000	0.000057200	0.000053100	0.000041600	0.000062500	0.000052200	0.000047800	0.000046200	0.000056700	0.000045700	0.000041400	0.000046800	0.000045300	0.000054100	0.000058800	0.000049200	0.000058500	0.000056400	0.000046400	0.000057900	0.000079400	0.000064700	0.000071000	0.000069900	0.000078900	0.000087000	0.000086400	0.000081500	0.000079000	0.000075700	0.000082800
C16H11NO3	265.073934	0.688	0.188	0.06	0.0000	0.0000	0.70	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000030800	0.000000000	0.000018500	0.000027500	0.000000000	0.000021200	0.000019500	0.000000000	0.000026600	0.000000000	0.000026400	0.000000000	0.000021800	0.000000000	0.000025500	0.000020700	0.000020600	0.000023500	0.000020200	0.000000000	0.000000000	0.000000000	0.000019500	0.000028800	0.000029600	0.000000000	0.000023300	0.000026700	0.000022200	0.000025700	0.000031400	0.000034400	0.000033900	0.000027000	0.000027900
C13H15NO3S	265.077319	1.154	0.231	0.08	0.0769	0.0000	0.37	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000037100	0.000020300	0.000044300	0.000032900	0.000031900	0.000030800	0.000032200	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026700	0.000029400	0.000047100	0.000038300	0.000025500	0.000018400	0.000029400	0.000038700	0.000049100	0.000055100	0.000021000	0.000000000	0.000025700	0.000040100	0.000037300	0.000046300	0.000000000	0.000000000	0.000041800	0.000033300	0.000000000	0.000000000
C13H15NO5	265.095051	1.154	0.385	0.08	0.0000	0.0000	0.37	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000178200	0.000129800	0.000190400	0.000185700	0.000159200	0.000165500	0.000176500	0.000132100	0.000130100	0.000112000	0.000104600	0.000139800	0.000127100	0.000171700	0.000168700	0.000201000	0.000210000	0.000157700	0.000172900	0.000172100	0.000175500	0.000232800	0.000225600	0.000165900	0.000160600	0.000182600	0.000199100	0.000192400	0.000199000	0.000177600	0.000175400	0.000198100	0.000186200	0.000144800	0.000138100
C12H15N3O4	265.106250	1.250	0.333	0.25	0.0000	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000024400	0.000018500	0.000024100	0.000022700	0.000000000	0.000019100
C17H15NO2	265.110265	0.882	0.118	0.06	0.0000	0.0000	0.60	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000026700	0.000026000	0.000022200	0.000000000
C14H19NO4	265.131395	1.357	0.286	0.07	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000092100	0.000070000	0.000125700	0.000111700	0.000117800	0.000108700	0.000107600	0.000087400	0.000073500	0.000066500	0.000066700	0.000073000	0.000067200	0.000121900	0.000138500	0.000137900	0.000141000	0.000110800	0.000127100	0.000121600	0.000125400	0.000157100	0.000168700	0.000093300	0.000093700	0.000115500	0.000110800	0.000118800	0.000118300	0.000103000	0.000102300	0.000111200	0.000112200	0.000067000	0.000079300
C15H23NO3	265.167830	1.533	0.200	0.07	0.0000	0.0000	0.20	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000020400	0.000018300	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H6O8	266.006243	0.545	0.727	0.00	0.0000	0.0000	0.71	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000064100	0.000064800
C12H10O3S2	266.007119	0.833	0.250	0.00	0.1667	0.0000	0.53	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020700	0.000019100	0.000027200	0.000037800	0.000000000	0.000025000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000019500	0.000024000	0.000029800	0.000031600	0.000000000	0.000000000	0.000024200	0.000000000	0.000034500	0.000032900	0.000026600	0.000025500	0.000000000	0.000000000	0.000028700	0.000036700	0.000000000	0.000000000	0.000027400	0.000026200	0.000000000	0.000000000
C15H6O5	266.021526	0.400	0.333	0.00	0.0000	0.0000	0.84	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000024300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000040900	0.000039200
C12H10O5S	266.024882	0.833	0.417	0.00	0.0833	0.0000	0.53	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000096200	0.000043600	0.000077800	0.000100300	0.000063600	0.000075200	0.000071300	0.000047400	0.000063800	0.000033200	0.000041900	0.000046100	0.000052700	0.000056800	0.000053400	0.000087600	0.000086000	0.000058000	0.000049100	0.000066600	0.000076000	0.000077300	0.000082100	0.000064800	0.000086800	0.000064600	0.000072100	0.000116100	0.000111300	0.000032200	0.000024900	0.000112700	0.000108800	0.000031000	0.000036300
C9H14O5S2	266.028249	1.556	0.556	0.00	0.2222	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000019300	0.000000000	0.000039100	0.000033200	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000033100	0.000029900	0.000020700	0.000000000	0.000029600	0.000032300	0.000041500	0.000037200	0.000000000	0.000027300	0.000019600	0.000027100	0.000029200	0.000032300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H10O7	266.042666	0.833	0.583	0.00	0.0000	0.0000	0.53	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000158300	0.000109900	0.000089300	0.000084400	0.000096800	0.000112900	0.000104200	0.000121200	0.000142600	0.000123700	0.000110500	0.000119000	0.000137200	0.000069900	0.000053400	0.000069200	0.000065200	0.000112200	0.000096500	0.000127400	0.000130300	0.000061300	0.000071200	0.000124500	0.000149300	0.000102700	0.000098000	0.000105800	0.000108800	0.000217000	0.000196100	0.000155400	0.000171000	0.000339500	0.000331000
C13H14O2S2	266.043529	1.077	0.154	0.00	0.1538	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000024900	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000026400	0.000000000	0.000000000	0.000021700	0.000000000	0.000029400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028100	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C9H14O7S	266.046002	1.556	0.778	0.00	0.1111	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000022000	0.000023800	0.000000000	0.000000000	0.000000000	0.000020600	0.000019900	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000020500	0.000021900	0.000000000	0.000022200	0.000021000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000025300	0.000000000	0.000024800	0.000019600	0.000026800	0.000025400	0.000021100	0.000000000	0.000020500	0.000000000
C11H10N2O6	266.053904	0.909	0.545	0.18	0.0000	0.0000	0.50	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000018800	0.000019200	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000021600	0.000027300	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000018400	0.000025000	0.000000000	0.000018900	0.000000000	0.000000000	0.000032300	0.000031300	0.000020200	0.000023100	0.000020200	0.000028200
C16H10O4	266.057963	0.625	0.250	0.00	0.0000	0.0000	0.71	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000082100	0.000057100	0.000036500	0.000045300	0.000041300	0.000048500	0.000051500	0.000067800	0.000075700	0.000062000	0.000052100	0.000060900	0.000054500	0.000033800	0.000032900	0.000041400	0.000042200	0.000045900	0.000035600	0.000059400	0.000054300	0.000035400	0.000035400	0.000061800	0.000073600	0.000042000	0.000041400	0.000053700	0.000058400	0.000081500	0.000081400	0.000089800	0.000083400	0.000127000	0.000127400
C13H14O4S	266.061326	1.077	0.308	0.00	0.0769	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000122600	0.000052700	0.000152400	0.000151900	0.000105000	0.000112900	0.000122100	0.000079200	0.000070900	0.000049200	0.000046700	0.000069300	0.000055900	0.000091500	0.000106300	0.000168400	0.000151700	0.000084300	0.000091400	0.000134800	0.000137700	0.000190000	0.000178500	0.000087500	0.000085400	0.000119400	0.000121800	0.000143400	0.000148800	0.000022300	0.000029700	0.000120000	0.000112600	0.000029300	0.000032400
C15H10N2O3	266.069143	0.667	0.200	0.13	0.0000	0.0000	0.74	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000018800	0.000019700	0.000000000	0.000000000	0.000021100	0.000000000
C13H14O6	266.079086	1.077	0.462	0.00	0.0000	0.0000	0.40	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000649800	0.000632600	0.000583800	0.000635300	0.000627400	0.000680100	0.000633100	0.000642500	0.000699500	0.000667500	0.000633500	0.000674000	0.000663600	0.000676100	0.000589100	0.000662900	0.000636700	0.000720300	0.000722900	0.000605500	0.000634700	0.000586900	0.000578300	0.000684100	0.000712300	0.000688800	0.000677200	0.000648800	0.000669600	0.000810100	0.000816500	0.000690000	0.000632900	0.000747900	0.000790900
C10H18O6S	266.082468	1.800	0.600	0.00	0.1000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000068600	0.000055500	0.000066500	0.000072700	0.000057600	0.000055300	0.000065100	0.000042300	0.000044600	0.000034200	0.000024900	0.000051800	0.000044000	0.000079400	0.000065400	0.000100000	0.000098900	0.000080200	0.000069700	0.000055200	0.000059100	0.000064100	0.000073600	0.000069600	0.000077400	0.000075300	0.000056800	0.000069400	0.000064100	0.000191500	0.000189000	0.000068900	0.000060100	0.000073600	0.000085700
C12H14N2O5	266.090265	1.167	0.417	0.17	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000082100	0.000059700	0.000061300	0.000076300	0.000056400	0.000050900	0.000060400	0.000056900	0.000054900	0.000044400	0.000042800	0.000048200	0.000058900	0.000060400	0.000062000	0.000083900	0.000077500	0.000062500	0.000067800	0.000064600	0.000059500	0.000080000	0.000081100	0.000071200	0.000084500	0.000065100	0.000075800	0.000080300	0.000079300	0.000104600	0.000114200	0.000092100	0.000095800	0.000077600	0.000077200
C17H14O3	266.094284	0.824	0.176	0.00	0.0000	0.0000	0.61	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000084700	0.000063500	0.000060600	0.000068200	0.000075000	0.000070000	0.000080800	0.000088600	0.000091900	0.000083400	0.000073300	0.000081100	0.000066500	0.000072700	0.000080900	0.000064100	0.000076900	0.000070300	0.000068200	0.000078600	0.000085300	0.000067300	0.000058200	0.000074900	0.000097300	0.000064200	0.000052300	0.000088800	0.000085200	0.000081800	0.000084800	0.000101900	0.000105200	0.000109300	0.000109400
C14H18O3S	266.097686	1.286	0.214	0.00	0.0714	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000049400	0.000035500	0.000069700	0.000072200	0.000065900	0.000066900	0.000057400	0.000059100	0.000035500	0.000031100	0.000026400	0.000054900	0.000027500	0.000053400	0.000073900	0.000087600	0.000077400	0.000045300	0.000073100	0.000075200	0.000061900	0.000092500	0.000083900	0.000043200	0.000047600	0.000049700	0.000066100	0.000066900	0.000076200	0.000020000	0.000020100	0.000065300	0.000062500	0.000023100	0.000020700
C14H18O5	266.115412	1.286	0.357	0.00	0.0000	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001431800	0.001740800	0.001822000	0.001635200	0.001991200	0.001968400	0.001875300	0.002088400	0.001806600	0.001880100	0.001648700	0.001847900	0.001655700	0.002068400	0.002300700	0.002178100	0.001966300	0.002105200	0.002374600	0.001828000	0.001787800	0.001969200	0.001918300	0.001621600	0.001685200	0.001880000	0.001802200	0.001790400	0.001799300	0.001753600	0.001738000	0.001681400	0.001728700	0.001555300	0.001703300
C13H18N2O4	266.126710	1.385	0.308	0.15	0.0000	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000042100	0.000037200	0.000058000	0.000047400	0.000055000	0.000049700	0.000048300	0.000039400	0.000031700	0.000032700	0.000033000	0.000042200	0.000028200	0.000059300	0.000055900	0.000056600	0.000057800	0.000048800	0.000055000	0.000054000	0.000049500	0.000073800	0.000073600	0.000043800	0.000038800	0.000056800	0.000058300	0.000049000	0.000055800	0.000064100	0.000067300	0.000060700	0.000046100	0.000040800	0.000043300
C18H18O2	266.130696	1.000	0.111	0.00	0.0000	0.0000	0.53	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024100	0.000031600	0.000025900	0.000026400	0.000027200	0.000030400	0.000022500	0.000044200	0.000031400	0.000026100	0.000030600	0.000028500	0.000025900	0.000030900	0.000036300	0.000023500	0.000024600	0.000029200	0.000028100	0.000022700	0.000025300	0.000000000	0.000020000	0.000020100	0.000029700	0.000000000	0.000030000	0.000030000	0.000025000	0.000026800	0.000027700	0.000038300	0.000030600	0.000026400	0.000031400
C15H22O2S	266.134041	1.467	0.133	0.00	0.0667	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000032200	0.000025600	0.000000000	0.000000000	0.000000000	0.000022300	0.000024800	0.000025400	0.000018500	0.000000000	0.000000000	0.000000000	0.000018500	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H22O4	266.151836	1.467	0.267	0.00	0.0000	0.0000	0.23	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000379000	0.000531000	0.000569000	0.000506100	0.000657200	0.000631200	0.000613700	0.000650700	0.000545200	0.000548500	0.000502700	0.000614200	0.000486300	0.000693400	0.000859700	0.000767000	0.000676600	0.000664900	0.000847700	0.000532300	0.000559200	0.000673700	0.000636300	0.000517300	0.000469000	0.000598200	0.000585000	0.000504000	0.000546000	0.000512900	0.000502400	0.000512800	0.000459400	0.000417200	0.000470900
C16H26O3	266.188235	1.625	0.188	0.00	0.0000	0.0000	0.17	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000022300	0.000031900	0.000035900	0.000030600	0.000038600	0.000047400	0.000046200	0.000040900	0.000033700	0.000034900	0.000035100	0.000046600	0.000033300	0.000052500	0.000057200	0.000041000	0.000053500	0.000046200	0.000062800	0.000029100	0.000023700	0.000050500	0.000056100	0.000033800	0.000039500	0.000031800	0.000038700	0.000032000	0.000034000	0.000029400	0.000025400	0.000035500	0.000032000	0.000028000	0.000027800
C11H9NO5S	267.020133	0.818	0.455	0.09	0.0909	0.0000	0.54	8	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029500	0.000000000	0.000000000	0.000029800	0.000018100	0.000018100	0.000025900	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000026900	0.000020800	0.000024100	0.000034500	0.000026600	0.000000000	0.000000000	0.000022400	0.000018800	0.000027400	0.000027000	0.000021300	0.000023700	0.000024500	0.000019300	0.000033200	0.000036600	0.000020700	0.000026900	0.000031500	0.000038600	0.000000000	0.000000000
C11H9NO7	267.037898	0.818	0.636	0.09	0.0000	0.0000	0.54	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000020800	0.000022600	0.000000000	0.000034200	0.000037800	0.000019100	0.000019100	0.000034200	0.000037100
C15H9NO4	267.053217	0.600	0.267	0.07	0.0000	0.0000	0.75	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021900	0.000019500	0.000000000	0.000022700	0.000018600	0.000000000	0.000019300	0.000000000	0.000025500	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000018200	0.000000000	0.000019900	0.000000000	0.000000000	0.000028700	0.000034100	0.000000000	0.000000000	0.000028500	0.000000000	0.000025800	0.000027900	0.000030900	0.000026400	0.000036600	0.000039800
C12H13NO4S	267.056550	1.083	0.333	0.08	0.0833	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061000	0.000027900	0.000056600	0.000062700	0.000037100	0.000041600	0.000046700	0.000030400	0.000031400	0.000000000	0.000021300	0.000022400	0.000030800	0.000035400	0.000034300	0.000059500	0.000060100	0.000030400	0.000034800	0.000049400	0.000059400	0.000076700	0.000077200	0.000041700	0.000036100	0.000042200	0.000035000	0.000063400	0.000066200	0.000000000	0.000000000	0.000065900	0.000058100	0.000000000	0.000000000
C12H13NO6	267.074340	1.083	0.500	0.08	0.0000	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000110100	0.000083800	0.000085600	0.000104200	0.000081300	0.000094500	0.000097100	0.000074800	0.000087400	0.000072500	0.000076500	0.000076200	0.000086100	0.000083700	0.000072500	0.000100800	0.000093800	0.000096100	0.000096600	0.000091600	0.000094500	0.000092500	0.000097400	0.000106300	0.000111200	0.000093000	0.000090900	0.000117000	0.000123400	0.000141200	0.000137500	0.000130200	0.000112200	0.000110500	0.000108100
C16H13NO3	267.089550	0.812	0.188	0.06	0.0000	0.0000	0.63	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000048900	0.000000000	0.000026300	0.000042600	0.000024100	0.000039300	0.000038700	0.000025800	0.000023200	0.000025800	0.000024700	0.000025700	0.000035300	0.000035700	0.000039200	0.000039000	0.000037800	0.000034500	0.000035600	0.000030600	0.000039200	0.000040300	0.000042700	0.000025500	0.000042900	0.000027800	0.000029800	0.000045500	0.000045400	0.000024100	0.000027000	0.000051300	0.000051600	0.000034300	0.000033100
C13H17NO3S	267.092957	1.308	0.231	0.08	0.0769	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027000	0.000000000	0.000030500	0.000039300	0.000020800	0.000020900	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000018200	0.000022200	0.000033100	0.000039500	0.000021800	0.000024000	0.000036100	0.000025500	0.000047100	0.000046300	0.000027600	0.000000000	0.000000000	0.000000000	0.000034600	0.000029600	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000
C13H17NO5	267.110668	1.308	0.385	0.08	0.0000	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000181600	0.000135000	0.000218100	0.000210400	0.000198400	0.000195600	0.000197200	0.000148900	0.000149100	0.000113300	0.000108000	0.000132700	0.000132500	0.000214200	0.000221700	0.000255000	0.000239100	0.000195400	0.000212800	0.000196800	0.000214600	0.000286500	0.000289300	0.000176400	0.000171700	0.000221900	0.000212100	0.000209000	0.000230500	0.000212300	0.000219700	0.000203000	0.000196300	0.000141700	0.000133300
C17H17NO2	267.125921	1.000	0.118	0.06	0.0000	0.0000	0.53	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000
C14H21NO4	267.147062	1.500	0.286	0.07	0.0000	0.0000	0.18	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000038700	0.000028200	0.000066700	0.000046600	0.000050000	0.000048100	0.000057400	0.000039300	0.000027400	0.000027900	0.000024900	0.000032900	0.000027300	0.000062400	0.000065000	0.000070200	0.000068300	0.000055100	0.000048700	0.000057800	0.000054700	0.000076200	0.000075200	0.000030700	0.000030600	0.000041200	0.000051400	0.000037500	0.000052900	0.000046100	0.000031600	0.000053200	0.000038800	0.000030200	0.000022900
C11H8O6S	268.004160	0.727	0.545	0.00	0.0909	0.0000	0.57	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020600	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000022200	0.000020800	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000018200	0.000000000	0.000019200	0.000024700	0.000000000	0.000026200	0.000000000	0.000023100	0.000021400	0.000021500	0.000025700	0.000000000	0.000020000	0.000020700	0.000021400	0.000000000	0.000000000	0.000021800	0.000026200	0.000022000	0.000023200
C11H8O8	268.021904	0.727	0.727	0.00	0.0000	0.0000	0.57	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000027200	0.000018200	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000018600	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000029400	0.000032500	0.000000000	0.000000000	0.000022000	0.000028800	0.000000000	0.000000000	0.000000000	0.000000000	0.000041200	0.000032600	0.000023000	0.000036600	0.000106100	0.000093800
C12H12O3S2	268.022768	1.000	0.250	0.00	0.1667	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000042400	0.000000000	0.000038300	0.000062300	0.000036000	0.000028000	0.000036400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000023600	0.000054600	0.000051200	0.000026700	0.000000000	0.000041000	0.000038300	0.000064300	0.000053600	0.000025400	0.000000000	0.000029300	0.000028600	0.000060500	0.000065300	0.000000000	0.000000000	0.000051100	0.000044200	0.000000000	0.000000000
C15H8O5	268.037202	0.533	0.333	0.00	0.0000	0.0000	0.76	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000077800	0.000078400	0.000060600	0.000058900	0.000053500	0.000045500	0.000060300	0.000076200	0.000093000	0.000075900	0.000062000	0.000098300	0.000066600	0.000036300	0.000055200	0.000055700	0.000036900	0.000062500	0.000036900	0.000076900	0.000056300	0.000091100	0.000036600	0.000064800	0.000066800	0.000058100	0.000045600	0.000052000	0.000037600	0.000163500	0.000112100	0.000091500	0.000076500	0.000156700	0.000150400
C12H12O5S	268.040542	1.000	0.417	0.00	0.0833	0.0000	0.41	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000141500	0.000069900	0.000147000	0.000173500	0.000129100	0.000136500	0.000128000	0.000085000	0.000086800	0.000063900	0.000060900	0.000070800	0.000068700	0.000124100	0.000113700	0.000179500	0.000183900	0.000116000	0.000115800	0.000149100	0.000139200	0.000182800	0.000186600	0.000114600	0.000121300	0.000129700	0.000128500	0.000200900	0.000195400	0.000048200	0.000039700	0.000157100	0.000169700	0.000036200	0.000041200
C9H16O5S2	268.043891	1.778	0.556	0.00	0.2222	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000019400	0.000000000	0.000031400	0.000028500	0.000019000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000030800	0.000000000	0.000000000	0.000019700	0.000021400	0.000024100	0.000028600	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000022300	0.000000000	0.000000000	0.000022700	0.000020800	0.000000000	0.000000000
C12H12O7	268.058346	1.000	0.583	0.00	0.0000	0.0000	0.41	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000260000	0.000217200	0.000167700	0.000203700	0.000179000	0.000207300	0.000205100	0.000215100	0.000269400	0.000238400	0.000220100	0.000217100	0.000246500	0.000188900	0.000138600	0.000171000	0.000171700	0.000247800	0.000208600	0.000210200	0.000208900	0.000145600	0.000153400	0.000266600	0.000303300	0.000212800	0.000222200	0.000239700	0.000241500	0.000476200	0.000420500	0.000291400	0.000287900	0.000439900	0.000443700
C13H16O2S2	268.059195	1.231	0.154	0.00	0.1538	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020800	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H12N2O6	268.069531	1.091	0.545	0.18	0.0000	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000039300	0.000018000	0.000027300	0.000023900	0.000024200	0.000028600	0.000025400	0.000022700	0.000029500	0.000000000	0.000020400	0.000023200	0.000026700	0.000018800	0.000000000	0.000024500	0.000035600	0.000030400	0.000025400	0.000018400	0.000026400	0.000026600	0.000032400	0.000028600	0.000026000	0.000027800	0.000032600	0.000040500	0.000033400	0.000062000	0.000056000	0.000034000	0.000040500	0.000042000	0.000042300
C16H12O4	268.073588	0.750	0.250	0.00	0.0000	0.0000	0.64	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000141100	0.000119200	0.000100400	0.000122000	0.000106300	0.000108900	0.000112100	0.000130300	0.000147600	0.000118800	0.000115500	0.000122200	0.000121300	0.000101100	0.000095800	0.000100800	0.000106300	0.000103600	0.000098900	0.000114600	0.000125300	0.000105500	0.000086400	0.000143100	0.000157600	0.000103200	0.000099200	0.000124500	0.000126900	0.000133500	0.000128900	0.000179900	0.000159300	0.000178200	0.000191100
C13H16O4S	268.076983	1.231	0.308	0.00	0.0769	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000089700	0.000055100	0.000128700	0.000136400	0.000103000	0.000098700	0.000093400	0.000059500	0.000057900	0.000047900	0.000055100	0.000053600	0.000049400	0.000095700	0.000095200	0.000149300	0.000124200	0.000080200	0.000083800	0.000103200	0.000108100	0.000160100	0.000156800	0.000089800	0.000064600	0.000108000	0.000113900	0.000115500	0.000119000	0.000026400	0.000037100	0.000099900	0.000090600	0.000021600	0.000029600
C15H12N2O3	268.084792	0.800	0.200	0.13	0.0000	0.0000	0.65	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000039700	0.000021500	0.000000000	0.000018500	0.000025400	0.000000000	0.000021600	0.000019600	0.000024500	0.000021400	0.000019100	0.000023000	0.000020000	0.000025200	0.000020400	0.000027900	0.000031700	0.000018400	0.000026100	0.000000000	0.000000000	0.000027200	0.000018300	0.000027200	0.000031600	0.000026300	0.000028400	0.000032600	0.000034700	0.000029100	0.000025800	0.000034700	0.000031700	0.000025000	0.000028900
C13H16O6	268.094705	1.231	0.462	0.00	0.0000	0.0000	0.30	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001354300	0.001471200	0.001497900	0.001530100	0.001659300	0.001719200	0.001628900	0.001595300	0.001601900	0.001504300	0.001348900	0.001515500	0.001426500	0.001844900	0.001823400	0.001899500	0.001783600	0.001868500	0.002000600	0.001536600	0.001561300	0.001610000	0.001603200	0.001564400	0.001655400	0.001657000	0.001625200	0.001652200	0.001652700	0.002027300	0.001976400	0.001578900	0.001577000	0.001523800	0.001585900
C10H20O6S	268.098101	2.000	0.600	0.00	0.1000	0.0000	0.00	1	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000025500	0.000000000	0.000027800	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000038000	0.000025100	0.000000000	0.000000000	0.000000000	0.000022000
C12H16N2O5	268.105937	1.333	0.417	0.17	0.0000	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000056400	0.000040000	0.000069200	0.000061500	0.000056000	0.000054700	0.000052000	0.000038100	0.000041700	0.000032300	0.000029500	0.000044900	0.000037500	0.000060500	0.000056400	0.000070500	0.000079400	0.000064900	0.000063900	0.000058900	0.000063900	0.000094700	0.000081400	0.000054200	0.000060000	0.000076700	0.000057700	0.000071200	0.000066400	0.000083800	0.000080000	0.000061300	0.000061300	0.000041300	0.000050900
C17H16O3	268.109932	0.941	0.176	0.00	0.0000	0.0000	0.55	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000090000	0.000088000	0.000085700	0.000099700	0.000109900	0.000103300	0.000110000	0.000117700	0.000105000	0.000109500	0.000105500	0.000089900	0.000103100	0.000088300	0.000125300	0.000094000	0.000100100	0.000095400	0.000107300	0.000102600	0.000120600	0.000101400	0.000093700	0.000096800	0.000113000	0.000091600	0.000087200	0.000116300	0.000110100	0.000081100	0.000090800	0.000114300	0.000131700	0.000107800	0.000119600
C14H20O3S	268.113303	1.429	0.214	0.00	0.0714	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000043900	0.000027900	0.000060800	0.000066900	0.000054100	0.000049200	0.000051100	0.000026900	0.000029800	0.000025000	0.000020900	0.000034100	0.000019300	0.000041400	0.000050400	0.000069800	0.000063600	0.000047500	0.000050300	0.000057400	0.000055300	0.000076500	0.000071100	0.000025100	0.000041100	0.000043400	0.000047500	0.000057000	0.000064100	0.000000000	0.000000000	0.000052600	0.000050000	0.000000000	0.000020000
C14H20O5	268.131067	1.429	0.357	0.00	0.0000	0.0000	0.22	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001205100	0.001519800	0.001890200	0.001549600	0.002073100	0.002002900	0.001958900	0.001850500	0.001630900	0.001521200	0.001379200	0.001645600	0.001396400	0.002127300	0.002519400	0.002364200	0.002071300	0.002050900	0.002522900	0.001850600	0.001812500	0.002176800	0.002125100	0.001451400	0.001488900	0.001836000	0.001726800	0.001682000	0.001720000	0.001666900	0.001614100	0.001529900	0.001545500	0.001274400	0.001464800
C13H20N2O4	268.142357	1.538	0.308	0.15	0.0000	0.0000	0.11	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000020100	0.000000000	0.000000000	0.000000000	0.000019100	0.000024000	0.000000000	0.000000000	0.000017900	0.000000000	0.000018200	0.000000000	0.000000000	0.000028500	0.000019300	0.000026600	0.000025700	0.000019400	0.000018600	0.000020100	0.000027400	0.000038200	0.000035900	0.000000000	0.000000000	0.000028200	0.000019900	0.000022500	0.000020100	0.000000000	0.000021400	0.000020900	0.000000000	0.000024500	0.000000000
C18H20O2	268.146388	1.111	0.111	0.00	0.0000	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000028900	0.000032200	0.000029300	0.000025700	0.000028500	0.000026000	0.000035900	0.000043600	0.000038900	0.000044900	0.000032500	0.000031200	0.000028500	0.000039000	0.000043100	0.000040100	0.000024400	0.000033900	0.000044300	0.000033100	0.000035400	0.000031900	0.000029200	0.000024500	0.000023500	0.000028200	0.000021900	0.000030100	0.000035800	0.000027800	0.000024500	0.000033200	0.000031500	0.000027000	0.000031700
C15H24O4	268.167514	1.600	0.267	0.00	0.0000	0.0000	0.15	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000119200	0.000163800	0.000213500	0.000169800	0.000246500	0.000229400	0.000244700	0.000210300	0.000177900	0.000146600	0.000149200	0.000196800	0.000147300	0.000247000	0.000317600	0.000272800	0.000263400	0.000233200	0.000309900	0.000199900	0.000200200	0.000271600	0.000246000	0.000173300	0.000159900	0.000200200	0.000214200	0.000168700	0.000178400	0.000176400	0.000179600	0.000175200	0.000145000	0.000149600	0.000156600
C16H28O3	268.203835	1.750	0.188	0.00	0.0000	0.0000	0.10	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000033100	0.000019700	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000032800	0.000019700	0.000000000	0.000034100	0.000029600	0.000000000	0.000000000	0.000022500	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H7NO5	269.032421	0.500	0.357	0.07	0.0000	0.0000	0.81	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000023000	0.000000000	0.000026600	0.000032400
C11H11NO5S	269.035785	1.000	0.455	0.09	0.0909	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000053600	0.000019500	0.000053000	0.000057900	0.000043100	0.000047900	0.000032700	0.000018900	0.000021800	0.000000000	0.000018600	0.000021600	0.000018200	0.000041900	0.000035600	0.000048100	0.000056100	0.000039300	0.000030300	0.000052900	0.000048000	0.000063000	0.000066000	0.000035700	0.000041200	0.000043000	0.000049700	0.000065900	0.000060600	0.000018900	0.000000000	0.000056100	0.000058800	0.000019200	0.000000000
C11H11NO7	269.053568	1.000	0.636	0.09	0.0000	0.0000	0.38	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029300	0.000000000	0.000000000	0.000020200	0.000000000	0.000020900	0.000022200	0.000021000	0.000027400	0.000025700	0.000018200	0.000022800	0.000023400	0.000000000	0.000000000	0.000020300	0.000018800	0.000020200	0.000021000	0.000020300	0.000000000	0.000000000	0.000000000	0.000036900	0.000034000	0.000000000	0.000000000	0.000018900	0.000028100	0.000065400	0.000050300	0.000038200	0.000030700	0.000051900	0.000040500
C15H11NO4	269.068858	0.733	0.267	0.07	0.0000	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000061000	0.000036200	0.000038300	0.000052800	0.000036400	0.000046100	0.000046300	0.000035400	0.000047200	0.000030400	0.000027500	0.000042400	0.000031100	0.000042100	0.000039900	0.000040600	0.000036600	0.000034800	0.000033600	0.000032300	0.000035400	0.000051100	0.000038800	0.000049900	0.000045200	0.000039700	0.000033900	0.000043700	0.000049300	0.000040900	0.000045900	0.000060100	0.000060600	0.000042200	0.000043900
C12H15NO4S	269.072229	1.250	0.333	0.08	0.0833	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033900	0.000000000	0.000061200	0.000054500	0.000031600	0.000033500	0.000035000	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000038900	0.000035300	0.000057900	0.000048300	0.000031600	0.000039900	0.000045000	0.000050400	0.000071400	0.000069700	0.000018700	0.000029800	0.000045200	0.000038700	0.000054600	0.000056800	0.000019700	0.000000000	0.000042900	0.000038100	0.000000000	0.000000000
C12H15NO6	269.089980	1.250	0.500	0.08	0.0000	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000138000	0.000103500	0.000141600	0.000149100	0.000132300	0.000144500	0.000136000	0.000108600	0.000122000	0.000091700	0.000077200	0.000107400	0.000106700	0.000172900	0.000137200	0.000175300	0.000177400	0.000141200	0.000151500	0.000134300	0.000141800	0.000182100	0.000182100	0.000130300	0.000156900	0.000159300	0.000160400	0.000177400	0.000179300	0.000200500	0.000197600	0.000152200	0.000142800	0.000137500	0.000119800
C16H15NO3	269.105184	0.938	0.188	0.06	0.0000	0.0000	0.56	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000052400	0.000029400	0.000049100	0.000050900	0.000048700	0.000041600	0.000044300	0.000042000	0.000041700	0.000030200	0.000023700	0.000037500	0.000033300	0.000045100	0.000051200	0.000058400	0.000060500	0.000045600	0.000044000	0.000044500	0.000045100	0.000055200	0.000049700	0.000034200	0.000044600	0.000034600	0.000048600	0.000070900	0.000062200	0.000032300	0.000030300	0.000059000	0.000059200	0.000035500	0.000038000
C13H19NO3S	269.108562	1.462	0.231	0.08	0.0769	0.0000	0.16	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000033800	0.000024100	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024300	0.000000000	0.000000000	0.000020400	0.000021900	0.000030200	0.000039400	0.000031900	0.000000000	0.000000000	0.000027600	0.000000000	0.000025500	0.000019200	0.000000000	0.000000000	0.000023300	0.000020100	0.000000000	0.000000000
C13H19NO5	269.126312	1.462	0.385	0.08	0.0000	0.0000	0.16	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000095900	0.000067100	0.000177400	0.000127700	0.000152300	0.000144300	0.000141900	0.000090000	0.000096300	0.000061800	0.000070700	0.000084000	0.000072600	0.000143400	0.000172900	0.000182400	0.000169300	0.000136200	0.000164700	0.000157700	0.000157300	0.000219500	0.000232900	0.000101500	0.000108500	0.000136300	0.000130900	0.000133500	0.000137900	0.000113100	0.000134300	0.000122300	0.000120700	0.000073300	0.000084100
C14H23NO4	269.162755	1.643	0.286	0.07	0.0000	0.0000	0.09	4	0	0	0	0	0	0	1	0	1	1	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000024800	0.000000000	0.000000000	0.000023600	0.000000000	0.000024400	0.000022100	0.000024800	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H10O4S2	270.002102	0.909	0.364	0.00	0.1818	0.0000	0.43	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000029300	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000021300	0.000020600	0.000000000	0.000000000	0.000018900	0.000000000	0.000022900	0.000000000	0.000021500	0.000000000	0.000020100	0.000021900	0.000030300	0.000000000	0.000000000	0.000029100	0.000020200	0.000000000	0.000000000
C14H6O6	270.016426	0.429	0.429	0.00	0.0000	0.0000	0.82	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031500	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025900	0.000024800	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000018500	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000029000	0.000022300	0.000023900	0.000032300	0.000066200	0.000067500
C11H10O6S	270.019802	0.909	0.545	0.00	0.0909	0.0000	0.43	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000059900	0.000030500	0.000056300	0.000059800	0.000059400	0.000057800	0.000054600	0.000038700	0.000043700	0.000036500	0.000034900	0.000039500	0.000047500	0.000045100	0.000029500	0.000056400	0.000054600	0.000057200	0.000043900	0.000064200	0.000057800	0.000062100	0.000062400	0.000054000	0.000062300	0.000061400	0.000067900	0.000077000	0.000066200	0.000046300	0.000049700	0.000068200	0.000072100	0.000035800	0.000037300
C15H10O3S	270.035081	0.667	0.200	0.00	0.0667	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000027900	0.000000000	0.000000000	0.000030400	0.000024000	0.000019600	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000025800	0.000027300	0.000000000	0.000000000	0.000022000	0.000024000	0.000000000	0.000000000	0.000026400	0.000032000	0.000000000	0.000000000
C11H10O8	270.037558	0.909	0.727	0.00	0.0000	0.0000	0.43	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000051300	0.000030400	0.000022100	0.000028700	0.000024400	0.000029200	0.000026000	0.000042200	0.000047600	0.000032400	0.000035400	0.000032000	0.000050100	0.000019900	0.000000000	0.000020600	0.000000000	0.000023400	0.000020700	0.000036200	0.000037500	0.000000000	0.000000000	0.000044400	0.000057300	0.000023300	0.000032300	0.000028700	0.000034500	0.000116000	0.000104000	0.000055200	0.000059300	0.000131800	0.000119200
C12H14O3S2	270.038425	1.167	0.250	0.00	0.1667	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000038300	0.000020500	0.000063700	0.000046400	0.000031100	0.000032800	0.000027300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000034200	0.000033000	0.000054400	0.000045000	0.000023500	0.000019200	0.000049600	0.000051400	0.000083600	0.000074900	0.000024600	0.000021600	0.000028100	0.000033100	0.000057000	0.000049100	0.000000000	0.000000000	0.000041400	0.000043100	0.000000000	0.000000000
C15H10O5	270.052876	0.667	0.333	0.00	0.0000	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000143500	0.000127800	0.000104500	0.000106800	0.000096000	0.000106200	0.000111900	0.000128000	0.000143000	0.000129700	0.000113500	0.000127400	0.000122300	0.000077500	0.000077500	0.000093600	0.000084000	0.000103600	0.000083900	0.000121600	0.000127000	0.000101000	0.000079700	0.000137200	0.000146300	0.000098100	0.000107900	0.000116300	0.000115400	0.000156600	0.000121900	0.000154700	0.000151400	0.000226400	0.000221500
C12H14O5S	270.056220	1.167	0.417	0.00	0.0833	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000164500	0.000082700	0.000208500	0.000218100	0.000156200	0.000162000	0.000151200	0.000092600	0.000105000	0.000082200	0.000071500	0.000092900	0.000097800	0.000165400	0.000149500	0.000238000	0.000217300	0.000143800	0.000153200	0.000186800	0.000206500	0.000238000	0.000240900	0.000148900	0.000137700	0.000163100	0.000165400	0.000234900	0.000229100	0.000106400	0.000083600	0.000170200	0.000176000	0.000061800	0.000063000
C16H15PS	270.063313	0.938	0.000	0.00	0.0625	0.0625	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000021400
C14H10N2O4	270.064038	0.714	0.286	0.14	0.0000	0.0000	0.70	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034900	0.000021600	0.000024000	0.000026000	0.000023000	0.000023200	0.000026600	0.000000000	0.000019600	0.000023300	0.000024200	0.000000000	0.000032600	0.000025100	0.000019900	0.000000000	0.000026100	0.000021300	0.000000000	0.000000000	0.000022500	0.000026600	0.000000000	0.000028600	0.000033700	0.000022200	0.000000000	0.000026600	0.000035400	0.000043300	0.000040700	0.000037400	0.000040400	0.000034000	0.000038700
C16H14O2S	270.071510	0.875	0.125	0.00	0.0625	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000	0.000000000	0.000000000	0.000031600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H14O7	270.074010	1.167	0.583	0.00	0.0000	0.0000	0.29	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000545600	0.000514100	0.000448900	0.000532000	0.000508600	0.000595100	0.000535300	0.000518500	0.000651000	0.000565100	0.000484700	0.000505800	0.000569800	0.000631200	0.000490000	0.000569400	0.000580100	0.000686500	0.000640000	0.000513400	0.000524900	0.000468500	0.000479700	0.000630700	0.000704800	0.000600000	0.000587900	0.000632900	0.000642500	0.001115100	0.000990800	0.000663000	0.000609300	0.000723300	0.000737200
C11H14N2O6	270.085173	1.273	0.545	0.18	0.0000	0.0000	0.17	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000042000	0.000029300	0.000030400	0.000035900	0.000033200	0.000027800	0.000027000	0.000029400	0.000030500	0.000021000	0.000023300	0.000000000	0.000028800	0.000031600	0.000025000	0.000041200	0.000034100	0.000035700	0.000045000	0.000036100	0.000036500	0.000046800	0.000042100	0.000025100	0.000036500	0.000039400	0.000030400	0.000048900	0.000041500	0.000060600	0.000065000	0.000047500	0.000050900	0.000038900	0.000035000
C16H14O4	270.089206	0.875	0.250	0.00	0.0000	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000211600	0.000179100	0.000196800	0.000217200	0.000209200	0.000214600	0.000202400	0.000224700	0.000219200	0.000198300	0.000207500	0.000206500	0.000199600	0.000209100	0.000196300	0.000206900	0.000213700	0.000187400	0.000198100	0.000214600	0.000219000	0.000212500	0.000217600	0.000209700	0.000234300	0.000184800	0.000188200	0.000228200	0.000236800	0.000172100	0.000180900	0.000263300	0.000269300	0.000230000	0.000258500
C13H18O4S	270.092607	1.385	0.308	0.00	0.0769	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000079800	0.000042900	0.000111300	0.000111500	0.000081700	0.000096000	0.000093000	0.000049100	0.000046600	0.000047800	0.000039400	0.000053900	0.000045200	0.000069500	0.000092800	0.000129900	0.000104500	0.000074300	0.000085200	0.000094300	0.000102100	0.000140300	0.000127200	0.000074000	0.000066200	0.000098900	0.000093200	0.000105100	0.000108600	0.000023800	0.000019900	0.000077500	0.000084900	0.000024500	0.000037700
C15H14N2O3	270.100479	0.933	0.200	0.13	0.0000	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000033100	0.000025400	0.000029200	0.000042600	0.000021800	0.000029300	0.000028000	0.000028200	0.000030100	0.000028300	0.000024000	0.000026800	0.000023300	0.000035000	0.000032100	0.000025400	0.000035000	0.000023500	0.000028600	0.000027300	0.000023600	0.000035400	0.000035200	0.000026200	0.000026600	0.000026000	0.000023100	0.000039000	0.000036600	0.000024400	0.000026700	0.000047400	0.000043500	0.000029300	0.000034300
C13H18O6	270.110328	1.385	0.462	0.00	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001757200	0.001966200	0.002447300	0.002186400	0.002614800	0.002626600	0.002447200	0.002212700	0.002116600	0.001971900	0.001700600	0.002002100	0.001824700	0.002701100	0.002877400	0.003057700	0.002743600	0.002818200	0.003242500	0.002464400	0.002349100	0.002616600	0.002730200	0.002115400	0.002220100	0.002418300	0.002305300	0.002450400	0.002444100	0.002837700	0.002688500	0.002195400	0.002291000	0.001915600	0.002071800
C12H18N2O5	270.121623	1.500	0.417	0.17	0.0000	0.0000	0.07	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000022200	0.000025600	0.000028900	0.000038900	0.000033400	0.000025000	0.000025500	0.000000000	0.000021800	0.000000000	0.000018600	0.000000000	0.000022600	0.000035500	0.000031200	0.000032800	0.000042700	0.000034100	0.000028100	0.000033000	0.000030200	0.000048500	0.000039700	0.000028400	0.000027600	0.000032000	0.000038100	0.000036300	0.000035800	0.000035600	0.000034100	0.000000000	0.000021400	0.000025300	0.000028400
C17H18O3	270.125618	1.059	0.176	0.00	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000094600	0.000129500	0.000101200	0.000098500	0.000134200	0.000123700	0.000123700	0.000143200	0.000133600	0.000157600	0.000139200	0.000144600	0.000124900	0.000126400	0.000153700	0.000124700	0.000122400	0.000124200	0.000156000	0.000125300	0.000108100	0.000108900	0.000108000	0.000107000	0.000119800	0.000114700	0.000133500	0.000116900	0.000114400	0.000096900	0.000083200	0.000116100	0.000114500	0.000113400	0.000118000
C14H22O3S	270.128958	1.571	0.214	0.00	0.0714	0.0000	0.13	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000023700	0.000036800	0.000035900	0.000025900	0.000026300	0.000024200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000033000	0.000044200	0.000035300	0.000020900	0.000027200	0.000025600	0.000035800	0.000044900	0.000038600	0.000021900	0.000000000	0.000034100	0.000020300	0.000033000	0.000040400	0.000000000	0.000000000	0.000032700	0.000030700	0.000000000	0.000000000
C16H18N2O2	270.136842	1.125	0.125	0.13	0.0000	0.0000	0.46	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000021100	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000
C14H23O3P	270.138500	1.643	0.214	0.00	0.0000	0.0714	0.13	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000063900	0.000018400	0.000108900	0.000085500	0.000078300	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000072200	0.000090100	0.000033100	0.000000000	0.000105200	0.000110300	0.000061000	0.000061400	0.000190700	0.000218200	0.000000000	0.000000000	0.000064400	0.000113900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H22O5	270.146765	1.571	0.357	0.00	0.0000	0.0000	0.13	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000347700	0.000488300	0.000696600	0.000513600	0.000759300	0.000732100	0.000729900	0.000574700	0.000517000	0.000448500	0.000415500	0.000550400	0.000406800	0.000766700	0.000922900	0.000870700	0.000770400	0.000767600	0.000913700	0.000668000	0.000638500	0.000845800	0.000812100	0.000482900	0.000464100	0.000638400	0.000657900	0.000543200	0.000544400	0.000568600	0.000539300	0.000504200	0.000425000	0.000387300	0.000421500
C18H22O2	270.162015	1.222	0.111	0.00	0.0000	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034900	0.000053200	0.000039900	0.000039100	0.000037500	0.000045900	0.000049200	0.000067300	0.000057000	0.000053600	0.000053100	0.000052800	0.000046700	0.000056900	0.000056700	0.000047500	0.000046200	0.000048100	0.000060000	0.000038000	0.000045100	0.000033500	0.000038700	0.000041700	0.000044600	0.000043500	0.000039500	0.000034800	0.000040900	0.000039500	0.000036500	0.000043100	0.000037000	0.000042600	0.000050400
C15H26O4	270.183121	1.733	0.267	0.00	0.0000	0.0000	0.08	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000025700	0.000018100	0.000046300	0.000042200	0.000052800	0.000055800	0.000047600	0.000037300	0.000028500	0.000023500	0.000031400	0.000036400	0.000026500	0.000044000	0.000069000	0.000050900	0.000044200	0.000054100	0.000073900	0.000048100	0.000053600	0.000056100	0.000061400	0.000020000	0.000033200	0.000038100	0.000044200	0.000031600	0.000036100	0.000023600	0.000033700	0.000036300	0.000030300	0.000026800	0.000032300
C10H9NO6S	271.015078	0.900	0.600	0.10	0.1000	0.0000	0.40	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000
C14H9NO3S	271.030295	0.643	0.214	0.07	0.0714	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000024200	0.000018400	0.000000000	0.000023800	0.000020700	0.000000000	0.000000000
C14H9NO5	271.048098	0.643	0.357	0.07	0.0000	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000055200	0.000030400	0.000029100	0.000038600	0.000028800	0.000035800	0.000033900	0.000031400	0.000032700	0.000027100	0.000025800	0.000031900	0.000034800	0.000027900	0.000000000	0.000022800	0.000032400	0.000019800	0.000024400	0.000027400	0.000022300	0.000036700	0.000023900	0.000045400	0.000048900	0.000025700	0.000032100	0.000045300	0.000042700	0.000044200	0.000040700	0.000055200	0.000055800	0.000047300	0.000052900
C11H13NO5S	271.051441	1.182	0.455	0.09	0.0909	0.0000	0.23	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000060800	0.000023800	0.000085300	0.000090600	0.000046300	0.000061400	0.000056900	0.000035500	0.000034700	0.000019500	0.000027900	0.000029800	0.000025900	0.000056100	0.000045200	0.000082300	0.000074000	0.000055900	0.000047500	0.000071300	0.000073300	0.000109900	0.000116400	0.000045500	0.000050600	0.000061400	0.000055400	0.000089000	0.000091900	0.000033600	0.000025400	0.000073000	0.000070700	0.000021600	0.000018500
C15H13NO2S	271.066766	0.867	0.133	0.07	0.0667	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000027700	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H13NO7	271.069250	1.182	0.636	0.09	0.0000	0.0000	0.23	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037000	0.000024200	0.000028400	0.000036900	0.000029400	0.000030700	0.000035100	0.000020100	0.000021000	0.000023000	0.000027800	0.000022500	0.000030600	0.000045000	0.000035600	0.000034200	0.000027600	0.000036400	0.000035300	0.000025400	0.000031900	0.000020600	0.000034800	0.000038100	0.000055700	0.000034300	0.000028900	0.000048600	0.000044800	0.000079900	0.000073000	0.000048900	0.000040700	0.000055500	0.000049800
C15H13NO4	271.084482	0.867	0.267	0.07	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000089400	0.000053300	0.000082500	0.000096100	0.000067400	0.000070900	0.000088700	0.000063400	0.000065100	0.000051900	0.000050800	0.000051600	0.000059000	0.000070200	0.000074800	0.000095400	0.000087800	0.000064900	0.000059000	0.000060200	0.000072700	0.000101100	0.000092200	0.000083500	0.000084600	0.000069100	0.000067700	0.000103300	0.000108300	0.000052900	0.000055100	0.000113400	0.000101600	0.000062200	0.000058700
C12H17NO4S	271.087885	1.417	0.333	0.08	0.0833	0.0000	0.12	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026900	0.000000000	0.000047700	0.000034500	0.000036600	0.000025600	0.000027300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033000	0.000032100	0.000037500	0.000042400	0.000000000	0.000020400	0.000034600	0.000036600	0.000054400	0.000059300	0.000018600	0.000019500	0.000032900	0.000030800	0.000028700	0.000040300	0.000000000	0.000000000	0.000034600	0.000027700	0.000000000	0.000000000
C12H17NO6	271.105593	1.417	0.500	0.08	0.0000	0.0000	0.12	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000109500	0.000087200	0.000154600	0.000142000	0.000138900	0.000140700	0.000138000	0.000088600	0.000097200	0.000066400	0.000058500	0.000084500	0.000077500	0.000146600	0.000149600	0.000184900	0.000171700	0.000143600	0.000155400	0.000144100	0.000141100	0.000202300	0.000207000	0.000115700	0.000119000	0.000157200	0.000146700	0.000146000	0.000148100	0.000175500	0.000169800	0.000126000	0.000121500	0.000089400	0.000103000
C16H17NO3	271.120841	1.062	0.188	0.06	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000050700	0.000028000	0.000048500	0.000049400	0.000047700	0.000045200	0.000050000	0.000038700	0.000037500	0.000025500	0.000023100	0.000029200	0.000028800	0.000048600	0.000045800	0.000054200	0.000049000	0.000033400	0.000034300	0.000042100	0.000045800	0.000070700	0.000062400	0.000040100	0.000043700	0.000044800	0.000036000	0.000056500	0.000050400	0.000032700	0.000033200	0.000050100	0.000048600	0.000027800	0.000032800
C13H21NO5	271.141969	1.615	0.385	0.08	0.0000	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000031300	0.000023500	0.000053700	0.000048300	0.000043600	0.000040100	0.000041600	0.000027200	0.000025800	0.000023100	0.000024400	0.000000000	0.000000000	0.000043600	0.000048400	0.000048800	0.000042300	0.000041500	0.000048200	0.000056900	0.000039400	0.000075800	0.000065900	0.000036900	0.000030800	0.000037100	0.000040500	0.000040600	0.000037500	0.000040700	0.000037200	0.000036400	0.000024900	0.000019600	0.000021900
C10H8O7S	271.999171	0.800	0.700	0.00	0.1000	0.0000	0.45	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000024800	0.000000000	0.000000000	0.000000000	0.000000000
C14H8O4S	272.014345	0.571	0.286	0.00	0.0714	0.0000	0.73	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000026500	0.000000000	0.000000000	0.000030800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000025500	0.000000000	0.000021300	0.000000000	0.000024500	0.000000000	0.000000000	0.000023900	0.000029600	0.000000000	0.000000000	0.000031000	0.000032800	0.000018400	0.000000000	0.000038400	0.000029200	0.000018400	0.000021200
C11H12O4S2	272.017729	1.091	0.364	0.00	0.1818	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000038100	0.000000000	0.000061100	0.000050200	0.000032900	0.000020000	0.000028700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000025300	0.000055800	0.000047600	0.000025600	0.000027300	0.000033600	0.000037200	0.000061200	0.000058700	0.000026700	0.000020500	0.000032300	0.000031100	0.000041400	0.000047100	0.000000000	0.000000000	0.000035600	0.000037000	0.000000000	0.000000000
C14H8O6	272.032074	0.571	0.429	0.00	0.0000	0.0000	0.73	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000108900	0.000075000	0.000062800	0.000056000	0.000058500	0.000061000	0.000064000	0.000092600	0.000106100	0.000080600	0.000083700	0.000075800	0.000086000	0.000027900	0.000051200	0.000035600	0.000040600	0.000051100	0.000042800	0.000087100	0.000086400	0.000030400	0.000041300	0.000081700	0.000093000	0.000051300	0.000046300	0.000062300	0.000059900	0.000113800	0.000097400	0.000114600	0.000121800	0.000236700	0.000236400
C11H12O6S	272.035446	1.091	0.545	0.00	0.0909	0.0000	0.29	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000092100	0.000064000	0.000093800	0.000111600	0.000093000	0.000104900	0.000086400	0.000068400	0.000078100	0.000058600	0.000056500	0.000062700	0.000066800	0.000082200	0.000065600	0.000104900	0.000119100	0.000103300	0.000084800	0.000096600	0.000109900	0.000112400	0.000114700	0.000083800	0.000095400	0.000106800	0.000105900	0.000144500	0.000126000	0.000065000	0.000051300	0.000104300	0.000114800	0.000043900	0.000043500
C13H8N2O5	272.043391	0.615	0.385	0.15	0.0000	0.0000	0.76	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022400	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000019400	0.000020000
C15H12O3S	272.050738	0.800	0.200	0.00	0.0667	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000042300	0.000000000	0.000024300	0.000057400	0.000019700	0.000031200	0.000024500	0.000031000	0.000020900	0.000000000	0.000023300	0.000000000	0.000000000	0.000024200	0.000028000	0.000048900	0.000043100	0.000026600	0.000023300	0.000025700	0.000027200	0.000037600	0.000037800	0.000036600	0.000035600	0.000027100	0.000026300	0.000050800	0.000054200	0.000000000	0.000000000	0.000045400	0.000044400	0.000000000	0.000000000
C11H12O8	272.053223	1.091	0.727	0.00	0.0000	0.0000	0.29	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000108300	0.000080900	0.000052800	0.000070000	0.000065700	0.000083100	0.000074600	0.000072500	0.000119100	0.000087200	0.000080500	0.000075400	0.000100200	0.000068000	0.000038500	0.000053400	0.000060500	0.000094100	0.000070300	0.000078300	0.000082700	0.000051600	0.000047500	0.000110500	0.000137400	0.000077100	0.000058200	0.000096400	0.000101500	0.000323200	0.000270500	0.000122000	0.000131800	0.000212400	0.000223700
C12H16O3S2	272.054081	1.333	0.250	0.00	0.1667	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020500	0.000000000	0.000036100	0.000038000	0.000030800	0.000018800	0.000025800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000022400	0.000037700	0.000030800	0.000000000	0.000000000	0.000033700	0.000036700	0.000054000	0.000047500	0.000018000	0.000000000	0.000020400	0.000024100	0.000041500	0.000039500	0.000000000	0.000000000	0.000027900	0.000024900	0.000000000	0.000000000
C15H12O5	272.068528	0.800	0.333	0.00	0.0000	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000257100	0.000201400	0.000201500	0.000225300	0.000207400	0.000205600	0.000206000	0.000217100	0.000234100	0.000215100	0.000209900	0.000213100	0.000215600	0.000185700	0.000176300	0.000180100	0.000193000	0.000206400	0.000188500	0.000215800	0.000238300	0.000193100	0.000181700	0.000237400	0.000249100	0.000203400	0.000192000	0.000231200	0.000224600	0.000220200	0.000208300	0.000271900	0.000259300	0.000294300	0.000303000
C12H16O5S	272.071892	1.333	0.417	0.00	0.0833	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000160700	0.000107900	0.000232000	0.000230200	0.000195300	0.000172800	0.000156700	0.000096000	0.000102600	0.000077200	0.000071200	0.000103300	0.000086600	0.000182300	0.000177000	0.000277400	0.000277900	0.000155600	0.000178200	0.000257900	0.000273600	0.000324900	0.000274000	0.000154600	0.000148800	0.000176500	0.000170100	0.000232900	0.000243100	0.000135000	0.000143500	0.000178300	0.000165700	0.000085500	0.000101500
C14H12N2O4	272.079692	0.857	0.286	0.14	0.0000	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000071100	0.000037500	0.000051500	0.000059200	0.000045000	0.000048300	0.000043100	0.000039300	0.000035400	0.000045100	0.000042400	0.000041800	0.000048800	0.000046900	0.000035400	0.000047800	0.000043000	0.000039200	0.000036800	0.000044300	0.000041000	0.000056400	0.000050700	0.000055200	0.000062800	0.000041000	0.000056500	0.000068100	0.000070400	0.000048200	0.000045900	0.000067700	0.000076100	0.000053000	0.000051900
C19H12O2	272.083715	0.632	0.105	0.00	0.0000	0.0000	0.72	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000019200
C16H16O2S	272.087102	1.000	0.125	0.00	0.0625	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000
C12H16O7	272.089649	1.333	0.583	0.00	0.0000	0.0000	0.18	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000786800	0.000784000	0.000767500	0.000869200	0.000879500	0.000948900	0.000877300	0.000789600	0.000932100	0.000798600	0.000672500	0.000782800	0.000773200	0.001016600	0.000876700	0.001020600	0.001005500	0.001165900	0.001145700	0.000863500	0.000847100	0.000853300	0.000889700	0.000942200	0.001013800	0.000974600	0.000938600	0.001032600	0.001021100	0.001690800	0.001514900	0.000930800	0.000921400	0.000972100	0.001004500
C11H16N2O6	272.100827	1.455	0.545	0.18	0.0000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000027200	0.000020400	0.000031300	0.000026500	0.000000000	0.000018500	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000024700	0.000034000	0.000021900	0.000028100	0.000026100	0.000026300	0.000023500	0.000021000	0.000021600	0.000032300	0.000037200	0.000018500	0.000025500	0.000020100	0.000035300	0.000030200	0.000021700	0.000030700	0.000032900	0.000028000	0.000019100	0.000000000	0.000021700
C16H16O4	272.104848	1.000	0.250	0.00	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000310200	0.000315900	0.000348500	0.000321200	0.000341000	0.000351400	0.000334900	0.000369800	0.000337500	0.000340100	0.000325000	0.000333800	0.000318500	0.000351100	0.000364700	0.000334300	0.000318900	0.000326500	0.000336600	0.000336800	0.000340300	0.000370800	0.000347600	0.000309300	0.000324800	0.000310800	0.000312600	0.000326600	0.000328000	0.000256100	0.000274100	0.000335100	0.000354400	0.000309200	0.000348500
C13H20O4S	272.108231	1.538	0.308	0.00	0.0769	0.0000	0.10	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000054300	0.000033900	0.000092200	0.000085500	0.000067000	0.000064000	0.000071800	0.000043600	0.000037100	0.000033500	0.000028400	0.000033100	0.000026900	0.000055300	0.000066500	0.000091400	0.000073100	0.000065000	0.000076900	0.000087800	0.000082500	0.000115100	0.000106100	0.000043500	0.000039700	0.000067700	0.000071100	0.000086200	0.000079900	0.000000000	0.000021600	0.000063400	0.000063400	0.000000000	0.000019200
C15H16N2O3	272.116146	1.067	0.200	0.13	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036100	0.000026600	0.000033400	0.000047800	0.000032200	0.000037500	0.000000000	0.000031100	0.000036000	0.000031200	0.000030500	0.000034100	0.000035200	0.000036500	0.000038800	0.000048900	0.000035600	0.000034200	0.000036100	0.000041000	0.000033900	0.000043700	0.000038500	0.000041800	0.000046000	0.000030600	0.000025400	0.000050600	0.000043600	0.000036900	0.000037800	0.000046600	0.000049100	0.000030600	0.000036300
C13H20O6	272.125983	1.538	0.462	0.00	0.0000	0.0000	0.10	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000759000	0.000874600	0.001173900	0.000984900	0.001216300	0.001180900	0.001137600	0.000957500	0.000871800	0.000801400	0.000695900	0.000920500	0.000769600	0.001179700	0.001335500	0.001416400	0.001290800	0.001300300	0.001536700	0.001128400	0.001070100	0.001272600	0.001328400	0.000947600	0.000891500	0.001140800	0.001104100	0.001048800	0.001048800	0.001327500	0.001280000	0.000919900	0.000900400	0.000824700	0.000892100
C12H20N2O5	272.137268	1.667	0.417	0.17	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H20O3	272.141304	1.176	0.176	0.00	0.0000	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000102400	0.000168400	0.000136900	0.000131100	0.000162600	0.000154000	0.000167400	0.000201900	0.000179300	0.000202400	0.000194000	0.000193300	0.000158400	0.000171100	0.000207000	0.000161600	0.000164300	0.000167600	0.000192100	0.000139200	0.000144300	0.000157900	0.000144300	0.000143800	0.000142800	0.000156600	0.000148900	0.000126900	0.000129200	0.000111800	0.000106900	0.000140300	0.000113400	0.000123400	0.000136500
C16H20N2O2	272.152471	1.250	0.125	0.13	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000018200	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000
C14H24O5	272.162432	1.714	0.357	0.00	0.0000	0.0000	0.04	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000048400	0.000067800	0.000111900	0.000083800	0.000119700	0.000114200	0.000120900	0.000088400	0.000079000	0.000060800	0.000054300	0.000063700	0.000058100	0.000104700	0.000136500	0.000134500	0.000126300	0.000120900	0.000152200	0.000106900	0.000105000	0.000137800	0.000125500	0.000072900	0.000066700	0.000100900	0.000109000	0.000084700	0.000081600	0.000090100	0.000072500	0.000070800	0.000054300	0.000061500	0.000059500
C18H24O2	272.177624	1.333	0.111	0.00	0.0000	0.0000	0.35	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041500	0.000051700	0.000042700	0.000049300	0.000049700	0.000049300	0.000048800	0.000074300	0.000061400	0.000072200	0.000056400	0.000079700	0.000056900	0.000060700	0.000080000	0.000052200	0.000051700	0.000055200	0.000070700	0.000047000	0.000043200	0.000038800	0.000045600	0.000047500	0.000039100	0.000048600	0.000052100	0.000046600	0.000050300	0.000042900	0.000039600	0.000046000	0.000050000	0.000043500	0.000048800
C13H7NO6	273.027331	0.538	0.462	0.08	0.0000	0.0000	0.78	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000020300	0.000018500	0.000023400	0.000027000	0.000034900
C10H11NO6S	273.030720	1.100	0.600	0.10	0.1000	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025500	0.000000000	0.000024400	0.000026400	0.000000000	0.000000000	0.000021600	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000020600	0.000028900	0.000023100	0.000000000	0.000030700	0.000000000	0.000022500	0.000023500	0.000000000	0.000019400	0.000000000	0.000000000	0.000021500	0.000023800	0.000000000	0.000000000	0.000028200	0.000026800	0.000000000	0.000000000
C14H11NO3S	273.045957	0.786	0.214	0.07	0.0714	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000036300	0.000018700	0.000021700	0.000041400	0.000000000	0.000020200	0.000019700	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000031400	0.000020700	0.000000000	0.000000000	0.000022200	0.000024500	0.000024000	0.000019300	0.000027200	0.000029200	0.000000000	0.000000000	0.000042100	0.000038500	0.000000000	0.000000000	0.000033400	0.000041700	0.000000000	0.000000000
C14H11NO5	273.063759	0.786	0.357	0.07	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000101800	0.000052300	0.000065200	0.000083600	0.000059900	0.000062900	0.000077100	0.000052200	0.000059400	0.000046900	0.000062900	0.000058600	0.000062900	0.000072800	0.000067400	0.000074400	0.000066000	0.000064000	0.000054200	0.000066900	0.000076600	0.000071300	0.000076400	0.000073600	0.000081200	0.000064200	0.000069900	0.000078600	0.000095500	0.000066000	0.000068400	0.000100200	0.000099200	0.000070500	0.000085800
C11H15NO5S	273.067097	1.364	0.455	0.09	0.0909	0.0000	0.08	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000068800	0.000000000	0.000107700	0.000091900	0.000060000	0.000073900	0.000062700	0.000033000	0.000027500	0.000020500	0.000023700	0.000026300	0.000024600	0.000052100	0.000050400	0.000092000	0.000083700	0.000044500	0.000059300	0.000104100	0.000095400	0.000134300	0.000150300	0.000037300	0.000041000	0.000076000	0.000073400	0.000097900	0.000085600	0.000019100	0.000023700	0.000077400	0.000076200	0.000000000	0.000000000
C15H15NO2S	273.082422	1.000	0.133	0.07	0.0667	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000
C11H15NO7	273.084909	1.364	0.636	0.09	0.0000	0.0000	0.08	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000032500	0.000024900	0.000024900	0.000041600	0.000028600	0.000033700	0.000036900	0.000020900	0.000032300	0.000019300	0.000019900	0.000034600	0.000026700	0.000045500	0.000024200	0.000038500	0.000050100	0.000045000	0.000038300	0.000032700	0.000038000	0.000039700	0.000046700	0.000030000	0.000051600	0.000039400	0.000036700	0.000047600	0.000041100	0.000076100	0.000061700	0.000047200	0.000036700	0.000030100	0.000029900
C15H15NO4	273.100110	1.000	0.267	0.07	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000118500	0.000070300	0.000135100	0.000148200	0.000119300	0.000105000	0.000112300	0.000081600	0.000085700	0.000065500	0.000071700	0.000080600	0.000072000	0.000113000	0.000119000	0.000145400	0.000145600	0.000098900	0.000092900	0.000130600	0.000125700	0.000170400	0.000175200	0.000101000	0.000114000	0.000122900	0.000120000	0.000150000	0.000146400	0.000069700	0.000087800	0.000137100	0.000139800	0.000076500	0.000084200
C12H19NO4S	273.103508	1.583	0.333	0.08	0.0833	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000025800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000022300	0.000000000	0.000000000	0.000023600	0.000000000	0.000034500	0.000024200	0.000000000	0.000000000	0.000018400	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H19NO6	273.121215	1.583	0.500	0.08	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000040400	0.000032700	0.000065600	0.000055000	0.000045100	0.000040500	0.000052200	0.000039300	0.000020900	0.000021600	0.000024100	0.000022800	0.000028000	0.000043800	0.000043700	0.000062300	0.000063700	0.000057900	0.000056400	0.000067300	0.000048800	0.000079400	0.000077700	0.000036200	0.000038500	0.000054800	0.000062900	0.000043200	0.000056400	0.000058800	0.000051800	0.000048300	0.000048100	0.000029300	0.000029400
C16H19NO3	273.136515	1.188	0.188	0.06	0.0000	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000033700	0.000034000	0.000042000	0.000038400	0.000049100	0.000034400	0.000035400	0.000032400	0.000034800	0.000030000	0.000024100	0.000032600	0.000026600	0.000041900	0.000062000	0.000045500	0.000048500	0.000032500	0.000037600	0.000039400	0.000040300	0.000047500	0.000043300	0.000039000	0.000030300	0.000037200	0.000042800	0.000051900	0.000047200	0.000025500	0.000036100	0.000041400	0.000042000	0.000026900	0.000025500
C10H10O5S2	273.996987	1.000	0.500	0.00	0.2000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000024100	0.000018400	0.000027900	0.000026000	0.000018200	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000026300	0.000000000	0.000000000	0.000028500	0.000024200	0.000034800	0.000034400	0.000019400	0.000021100	0.000022700	0.000018900	0.000030200	0.000032600	0.000000000	0.000000000	0.000027100	0.000027300	0.000000000	0.000000000
C13H6O7	274.011406	0.462	0.538	0.00	0.0000	0.0000	0.79	11	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000029700	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000026800	0.000025600	0.000024700	0.000067200	0.000062200
C10H10O7S	274.014776	1.000	0.700	0.00	0.1000	0.0000	0.27	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000023500	0.000000000	0.000018300	0.000024700	0.000000000	0.000025900	0.000020000	0.000000000	0.000026200	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000018000	0.000023100	0.000022100	0.000021800	0.000022000	0.000022800	0.000000000	0.000000000	0.000024800	0.000029000	0.000000000	0.000028800	0.000021400	0.000022000	0.000000000	0.000000000	0.000027400	0.000023800	0.000000000
C14H10O4S	274.029980	0.714	0.286	0.00	0.0714	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000068600	0.000032200	0.000038700	0.000085300	0.000045900	0.000059200	0.000052200	0.000031400	0.000036600	0.000020400	0.000029900	0.000030800	0.000037500	0.000041300	0.000036000	0.000079700	0.000075600	0.000040500	0.000038800	0.000046200	0.000053000	0.000058200	0.000057400	0.000057900	0.000058700	0.000036700	0.000038800	0.000087400	0.000081800	0.000000000	0.000000000	0.000078400	0.000074700	0.000000000	0.000025500
C11H14O4S2	274.033382	1.273	0.364	0.00	0.1818	0.0000	0.14	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037100	0.000000000	0.000056600	0.000064800	0.000029800	0.000029500	0.000030300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028400	0.000028600	0.000059400	0.000057100	0.000022300	0.000030700	0.000053900	0.000052900	0.000067900	0.000063700	0.000023500	0.000024600	0.000045900	0.000032300	0.000052300	0.000045900	0.000000000	0.000000000	0.000043100	0.000039200	0.000000000	0.000000000
C14H10O6	274.047725	0.714	0.429	0.00	0.0000	0.0000	0.64	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000274400	0.000203600	0.000177400	0.000165200	0.000169100	0.000184700	0.000183100	0.000205200	0.000240700	0.000226600	0.000204300	0.000187300	0.000215000	0.000124400	0.000112500	0.000122400	0.000142700	0.000170700	0.000145700	0.000220900	0.000220100	0.000129400	0.000126300	0.000225400	0.000256400	0.000169400	0.000167000	0.000195500	0.000194100	0.000254600	0.000249700	0.000279200	0.000306800	0.000442800	0.000433400
C11H14O6S	274.051093	1.273	0.545	0.00	0.0909	0.0000	0.14	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000137000	0.000075300	0.000153200	0.000193600	0.000138500	0.000137400	0.000128800	0.000095300	0.000104300	0.000080300	0.000074100	0.000080000	0.000094300	0.000134700	0.000114500	0.000182100	0.000175900	0.000141300	0.000133800	0.000156400	0.000154100	0.000177900	0.000183100	0.000125100	0.000136300	0.000153500	0.000131200	0.000210000	0.000206100	0.000071600	0.000060100	0.000160800	0.000175000	0.000050000	0.000056800
C13H10N2O5	274.059021	0.769	0.385	0.15	0.0000	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033100	0.000024700	0.000019200	0.000027200	0.000023400	0.000020100	0.000031300	0.000024800	0.000027800	0.000021400	0.000024200	0.000024300	0.000022600	0.000024600	0.000019300	0.000021300	0.000000000	0.000024900	0.000021700	0.000027900	0.000018700	0.000027000	0.000019200	0.000026200	0.000029500	0.000030800	0.000027400	0.000027100	0.000036200	0.000035200	0.000029100	0.000030800	0.000033200	0.000032200	0.000025200
C18H10O3	274.063055	0.556	0.167	0.00	0.0000	0.0000	0.76	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000018500	0.000023000	0.000018500	0.000030300	0.000026000
C15H14O3S	274.066393	0.933	0.200	0.00	0.0667	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000056500	0.000022900	0.000055400	0.000081600	0.000051300	0.000051600	0.000043600	0.000029800	0.000033800	0.000020400	0.000025900	0.000019100	0.000026100	0.000051300	0.000051900	0.000074300	0.000061000	0.000046400	0.000035800	0.000049800	0.000045500	0.000084400	0.000066700	0.000043400	0.000045400	0.000035100	0.000041400	0.000076500	0.000076900	0.000000000	0.000000000	0.000064800	0.000068000	0.000000000	0.000000000
C11H14O8	274.068870	1.273	0.727	0.00	0.0000	0.0000	0.14	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000139300	0.000120000	0.000078200	0.000111000	0.000099500	0.000130900	0.000122400	0.000109000	0.000160500	0.000122500	0.000096100	0.000100700	0.000129600	0.000116200	0.000074500	0.000097200	0.000112200	0.000168000	0.000130200	0.000111600	0.000109200	0.000090100	0.000095300	0.000149100	0.000190200	0.000144000	0.000133200	0.000156400	0.000151800	0.000464700	0.000385000	0.000161700	0.000180100	0.000250400	0.000252800
C12H18O3S2	274.069728	1.500	0.250	0.00	0.1667	0.0000	0.06	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000024800	0.000018200	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000031000	0.000000000	0.000021800	0.000027500	0.000024900	0.000032300	0.000033100	0.000000000	0.000000000	0.000000000	0.000021000	0.000024500	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000
C15H14O5	274.084181	0.933	0.333	0.00	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000414500	0.000367000	0.000401300	0.000398000	0.000406600	0.000404800	0.000391200	0.000377100	0.000394800	0.000376900	0.000371000	0.000389800	0.000388200	0.000400100	0.000368900	0.000396800	0.000381000	0.000386400	0.000376400	0.000378300	0.000403100	0.000399500	0.000376900	0.000404000	0.000405000	0.000394100	0.000400200	0.000390700	0.000399400	0.000319400	0.000345200	0.000433400	0.000397500	0.000382900	0.000425000
C12H18O5S	274.087545	1.500	0.417	0.00	0.0833	0.0000	0.06	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000086000	0.000067800	0.000140100	0.000138200	0.000110900	0.000121900	0.000115700	0.000073500	0.000071100	0.000055800	0.000057000	0.000068900	0.000057100	0.000116200	0.000117500	0.000169000	0.000146000	0.000114000	0.000121700	0.000133400	0.000139900	0.000181000	0.000181100	0.000082500	0.000088000	0.000117100	0.000116800	0.000134600	0.000126400	0.000050300	0.000046200	0.000107900	0.000096600	0.000029300	0.000030900
C14H14N2O4	274.095345	1.000	0.286	0.14	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000106100	0.000065600	0.000082100	0.000092400	0.000076600	0.000083500	0.000074300	0.000064200	0.000076500	0.000061800	0.000066900	0.000062900	0.000065800	0.000067600	0.000084900	0.000089900	0.000088600	0.000073800	0.000066000	0.000078500	0.000078700	0.000111300	0.000093400	0.000080200	0.000080000	0.000083900	0.000085900	0.000102600	0.000106800	0.000079700	0.000094000	0.000107200	0.000114900	0.000087900	0.000083900
C19H14O2	274.099357	0.737	0.105	0.00	0.0000	0.0000	0.67	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000024400	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000030800	0.000000000	0.000029500	0.000021200	0.000027200	0.000024900
C16H18O2S	274.102771	1.125	0.125	0.00	0.0625	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H18O7	274.105291	1.500	0.583	0.00	0.0000	0.0000	0.06	4	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000336100	0.000378200	0.000406400	0.000428000	0.000437800	0.000458100	0.000421600	0.000365500	0.000389900	0.000346700	0.000297100	0.000381800	0.000351500	0.000491900	0.000446700	0.000539600	0.000531600	0.000582100	0.000624700	0.000432200	0.000443600	0.000440500	0.000472100	0.000420600	0.000444900	0.000498500	0.000499800	0.000452000	0.000456200	0.000755100	0.000689100	0.000414700	0.000372800	0.000417300	0.000425600
C16H18O4	274.120499	1.125	0.250	0.00	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000399700	0.000500800	0.000504400	0.000433700	0.000557300	0.000526600	0.000515500	0.000591600	0.000510500	0.000550300	0.000521500	0.000552000	0.000483100	0.000529300	0.000604400	0.000524700	0.000511000	0.000517300	0.000578400	0.000508400	0.000491000	0.000537800	0.000520000	0.000441900	0.000453400	0.000483200	0.000483400	0.000459500	0.000462500	0.000351600	0.000357500	0.000442800	0.000462300	0.000430200	0.000480200
C13H22O4S	274.123870	1.692	0.308	0.00	0.0769	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000034600	0.000000000	0.000042400	0.000034700	0.000035800	0.000034700	0.000040700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029100	0.000035000	0.000045700	0.000058800	0.000034300	0.000039000	0.000051400	0.000050600	0.000060400	0.000064400	0.000000000	0.000000000	0.000035200	0.000037000	0.000037700	0.000040300	0.000019100	0.000000000	0.000029500	0.000023800	0.000000000	0.000000000
C15H18N2O3	274.131791	1.200	0.200	0.13	0.0000	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044800	0.000024600	0.000041200	0.000043200	0.000026200	0.000033000	0.000035900	0.000030700	0.000035900	0.000025200	0.000030500	0.000037000	0.000030900	0.000038600	0.000042900	0.000048500	0.000045800	0.000037800	0.000036300	0.000034800	0.000038900	0.000040100	0.000038800	0.000033100	0.000042700	0.000031200	0.000041600	0.000051600	0.000042200	0.000036800	0.000038600	0.000051100	0.000039000	0.000029300	0.000028700
C13H22O6	274.141641	1.692	0.462	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000107500	0.000132100	0.000191100	0.000164100	0.000180200	0.000171900	0.000194900	0.000122400	0.000134900	0.000107000	0.000104500	0.000126400	0.000110000	0.000165600	0.000194400	0.000237800	0.000201200	0.000200200	0.000239100	0.000177200	0.000176000	0.000211500	0.000214900	0.000142400	0.000126900	0.000184100	0.000192000	0.000148300	0.000148600	0.000200700	0.000204400	0.000138000	0.000117600	0.000135900	0.000138500
C17H22O3	274.156957	1.294	0.176	0.00	0.0000	0.0000	0.35	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000123400	0.000200500	0.000151300	0.000164400	0.000195000	0.000181800	0.000185200	0.000238000	0.000205200	0.000236100	0.000218200	0.000227800	0.000184200	0.000207800	0.000260400	0.000199300	0.000192200	0.000201600	0.000241100	0.000162800	0.000166700	0.000169300	0.000162000	0.000156300	0.000168500	0.000177400	0.000175700	0.000152200	0.000156100	0.000132000	0.000131300	0.000169300	0.000143800	0.000141500	0.000157900
C18H26O2	274.193263	1.444	0.111	0.00	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025100	0.000041900	0.000031100	0.000030800	0.000032500	0.000039100	0.000030000	0.000044600	0.000042200	0.000043700	0.000032000	0.000041500	0.000039400	0.000036400	0.000054000	0.000041500	0.000035200	0.000043800	0.000053500	0.000030500	0.000031000	0.000035400	0.000026400	0.000037100	0.000036100	0.000026500	0.000041000	0.000037600	0.000034100	0.000034000	0.000032100	0.000036900	0.000030500	0.000032400	0.000036300
C13H9NO4S	275.025280	0.692	0.308	0.08	0.0769	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000023200	0.000000000	0.000020100	0.000023000	0.000000000	0.000018300	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000018500	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000019600	0.000023000	0.000000000	0.000000000	0.000029600	0.000034900	0.000018600	0.000000000	0.000032600	0.000029100	0.000000000	0.000000000
C13H9NO6	275.042995	0.692	0.462	0.08	0.0000	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000048700	0.000035500	0.000034100	0.000040500	0.000036200	0.000038300	0.000035900	0.000025700	0.000035500	0.000034500	0.000042000	0.000029900	0.000037000	0.000027600	0.000021700	0.000020700	0.000024900	0.000036400	0.000030200	0.000035900	0.000041900	0.000034400	0.000030100	0.000039400	0.000049200	0.000037200	0.000035300	0.000039000	0.000040400	0.000054200	0.000061300	0.000053100	0.000057500	0.000070600	0.000060000
C10H13NO6S	275.046400	1.300	0.600	0.10	0.1000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000031900	0.000000000	0.000022600	0.000028500	0.000022500	0.000000000	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000034800	0.000038900	0.000022700	0.000021100	0.000039000	0.000037700	0.000041100	0.000041500	0.000028600	0.000028500	0.000031500	0.000033200	0.000040800	0.000044300	0.000025700	0.000020900	0.000025400	0.000031100	0.000000000	0.000000000
C14H13NO3S	275.061597	0.929	0.214	0.07	0.0714	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000044400	0.000018700	0.000029500	0.000050800	0.000029900	0.000034600	0.000029300	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031500	0.000028700	0.000053500	0.000043900	0.000026800	0.000021200	0.000026800	0.000024900	0.000046300	0.000035200	0.000026000	0.000035300	0.000024000	0.000025200	0.000052600	0.000050900	0.000000000	0.000000000	0.000043400	0.000049500	0.000000000	0.000000000
C14H13NO5	275.079394	0.929	0.357	0.07	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000167700	0.000088800	0.000141500	0.000166300	0.000136200	0.000128300	0.000134000	0.000106300	0.000112400	0.000095700	0.000092200	0.000098200	0.000108300	0.000129000	0.000125100	0.000145900	0.000155300	0.000121100	0.000122500	0.000132600	0.000136500	0.000166600	0.000166100	0.000141800	0.000130300	0.000125900	0.000141200	0.000170100	0.000176200	0.000108800	0.000110900	0.000167900	0.000173800	0.000114600	0.000114500
C11H17NO5S	275.082731	1.545	0.455	0.09	0.0909	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000026700	0.000000000	0.000048600	0.000042000	0.000026500	0.000021000	0.000027100	0.000000000	0.000018500	0.000019600	0.000000000	0.000021400	0.000000000	0.000020100	0.000028100	0.000038800	0.000041400	0.000023400	0.000028400	0.000045700	0.000040400	0.000054500	0.000062200	0.000029900	0.000000000	0.000041100	0.000035900	0.000040400	0.000037000	0.000000000	0.000000000	0.000023800	0.000029800	0.000000000	0.000000000
C13H13N3O4	275.090566	1.000	0.308	0.23	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000018400	0.000000000	0.000021800	0.000000000	0.000000000	0.000019700	0.000020600	0.000000000
C15H17NO2S	275.098065	1.133	0.133	0.07	0.0667	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000000000	0.000000000	0.000000000	0.000025400	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H17NO7	275.100570	1.545	0.636	0.09	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029100	0.000023000	0.000018900	0.000000000	0.000000000	0.000000000
C15H17NO4	275.115766	1.133	0.267	0.07	0.0000	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000123400	0.000092700	0.000145400	0.000144400	0.000135300	0.000136200	0.000133300	0.000095000	0.000090400	0.000075800	0.000084100	0.000099700	0.000088100	0.000131500	0.000136000	0.000154600	0.000162000	0.000115700	0.000118300	0.000133800	0.000138300	0.000190000	0.000180700	0.000118400	0.000111700	0.000139400	0.000123500	0.000137800	0.000155000	0.000091300	0.000093800	0.000140700	0.000129000	0.000087900	0.000077900
C16H21NO3	275.152164	1.312	0.188	0.06	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025100	0.000020400	0.000031800	0.000023500	0.000032000	0.000029400	0.000039500	0.000036800	0.000023800	0.000025700	0.000000000	0.000021400	0.000000000	0.000036500	0.000042500	0.000036900	0.000035100	0.000026400	0.000037900	0.000028500	0.000031700	0.000036500	0.000033700	0.000022400	0.000021200	0.000030600	0.000000000	0.000033500	0.000030200	0.000027500	0.000029900	0.000035400	0.000032800	0.000025900	0.000022200
C13H8O5S	276.009241	0.615	0.385	0.00	0.0769	0.0000	0.68	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000047700	0.000020300	0.000019800	0.000029300	0.000028900	0.000025300	0.000029700	0.000019700	0.000033300	0.000000000	0.000019100	0.000024200	0.000026300	0.000028100	0.000000000	0.000030000	0.000024700	0.000000000	0.000000000	0.000024000	0.000022700	0.000000000	0.000020000	0.000030400	0.000038700	0.000025000	0.000026000	0.000045600	0.000057700	0.000000000	0.000000000	0.000050600	0.000052600	0.000021800	0.000023200
C10H12O5S2	276.012598	1.200	0.500	0.00	0.2000	0.0000	0.09	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000038500	0.000000000	0.000069100	0.000059900	0.000036600	0.000039800	0.000044800	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000033100	0.000029100	0.000046000	0.000057000	0.000032600	0.000027000	0.000058000	0.000063900	0.000072300	0.000083400	0.000025000	0.000028400	0.000048200	0.000046900	0.000064600	0.000069100	0.000000000	0.000000000	0.000049700	0.000045100	0.000000000	0.000000000
C13H8O7	276.027057	0.615	0.538	0.00	0.0000	0.0000	0.68	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000077300	0.000052800	0.000042900	0.000040200	0.000038200	0.000037400	0.000050800	0.000053000	0.000073400	0.000067400	0.000058100	0.000048300	0.000067900	0.000023100	0.000019800	0.000000000	0.000000000	0.000035000	0.000040600	0.000058000	0.000060600	0.000023000	0.000000000	0.000056900	0.000071100	0.000039000	0.000036000	0.000039100	0.000041200	0.000092500	0.000086200	0.000068900	0.000076400	0.000191300	0.000179200
C14H12O2S2	276.027890	0.857	0.143	0.00	0.1429	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H12O7S	276.030397	1.200	0.700	0.00	0.1000	0.0000	0.09	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000027800	0.000021800	0.000018300	0.000037200	0.000024700	0.000031300	0.000028100	0.000023500	0.000029600	0.000000000	0.000000000	0.000024300	0.000025500	0.000024900	0.000000000	0.000031700	0.000023800	0.000035900	0.000022700	0.000019200	0.000034800	0.000020800	0.000032000	0.000031800	0.000037400	0.000033500	0.000033500	0.000043500	0.000039200	0.000032600	0.000031700	0.000047100	0.000042500	0.000024300	0.000020600
C17H8O4	276.042286	0.471	0.235	0.00	0.0000	0.0000	0.80	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000018600	0.000027900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000018100	0.000020500	0.000000000	0.000036100	0.000037000
C14H12O4S	276.045673	0.857	0.286	0.00	0.0714	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000096100	0.000035800	0.000080400	0.000118400	0.000066600	0.000069600	0.000064500	0.000048600	0.000045600	0.000041600	0.000043200	0.000034700	0.000029300	0.000063500	0.000060300	0.000097800	0.000101300	0.000056100	0.000054700	0.000069300	0.000073300	0.000095300	0.000086400	0.000062500	0.000079300	0.000061200	0.000076900	0.000119300	0.000115100	0.000023800	0.000000000	0.000101200	0.000096200	0.000023700	0.000031900
C10H12O9	276.048160	1.200	0.900	0.00	0.0000	0.0000	0.09	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000019400	0.000000000	0.000000000	0.000000000	0.000019100
C11H16O4S2	276.049059	1.455	0.364	0.00	0.1818	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028700	0.000000000	0.000045400	0.000044200	0.000030300	0.000027100	0.000035000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031500	0.000022700	0.000054400	0.000044400	0.000023100	0.000029200	0.000041300	0.000041900	0.000070300	0.000063400	0.000029400	0.000000000	0.000019900	0.000044400	0.000050200	0.000044600	0.000000000	0.000000000	0.000033200	0.000033500	0.000000000	0.000000000
C14H12O6	276.063375	0.857	0.429	0.00	0.0000	0.0000	0.55	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000523000	0.000408000	0.000386300	0.000386000	0.000380200	0.000400300	0.000399300	0.000415800	0.000450200	0.000406200	0.000418800	0.000389800	0.000441200	0.000336700	0.000299700	0.000353500	0.000352500	0.000410500	0.000387000	0.000430700	0.000430600	0.000342500	0.000333800	0.000468600	0.000496400	0.000411500	0.000394900	0.000445200	0.000445600	0.000474400	0.000461100	0.000514300	0.000539900	0.000622600	0.000627300
C11H16O6S	276.066768	1.455	0.545	0.00	0.0909	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000120600	0.000095500	0.000179900	0.000181700	0.000159400	0.000162600	0.000162700	0.000097700	0.000111200	0.000088400	0.000074800	0.000084700	0.000106400	0.000136300	0.000136000	0.000202300	0.000199100	0.000160600	0.000156200	0.000172400	0.000177200	0.000205600	0.000222000	0.000126300	0.000124100	0.000175000	0.000161800	0.000176500	0.000183200	0.000106800	0.000106100	0.000140100	0.000126100	0.000057600	0.000068400
C13H12N2O5	276.074678	0.923	0.385	0.15	0.0000	0.0000	0.53	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061200	0.000040400	0.000050300	0.000062500	0.000051500	0.000056600	0.000046900	0.000037100	0.000050800	0.000042800	0.000049000	0.000045000	0.000045100	0.000043700	0.000037500	0.000058700	0.000046600	0.000042900	0.000040800	0.000049000	0.000043900	0.000059200	0.000059800	0.000064600	0.000057800	0.000040400	0.000056000	0.000053300	0.000058000	0.000056700	0.000059400	0.000067600	0.000061600	0.000053000	0.000053700
C18H12O3	276.078670	0.667	0.167	0.00	0.0000	0.0000	0.70	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000036200	0.000028500	0.000020400	0.000019600	0.000020600	0.000018200	0.000024800	0.000037400	0.000031300	0.000030500	0.000028800	0.000030700	0.000033500	0.000000000	0.000000000	0.000018100	0.000023600	0.000000000	0.000023800	0.000028200	0.000023400	0.000026200	0.000000000	0.000030000	0.000030800	0.000000000	0.000022800	0.000030400	0.000029300	0.000033500	0.000040300	0.000038200	0.000044300	0.000048400	0.000056400
C15H16O3S	276.082011	1.067	0.200	0.00	0.0667	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000059000	0.000032400	0.000066500	0.000088000	0.000068500	0.000061500	0.000057800	0.000048100	0.000039400	0.000035200	0.000029500	0.000036300	0.000026400	0.000053100	0.000061500	0.000091300	0.000073200	0.000039800	0.000046600	0.000061600	0.000067300	0.000092500	0.000089000	0.000050400	0.000048800	0.000060600	0.000056200	0.000080400	0.000083900	0.000000000	0.000000000	0.000067400	0.000060600	0.000000000	0.000000000
C11H16O8	276.084505	1.455	0.727	0.00	0.0000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000054400	0.000045100	0.000039300	0.000046800	0.000049100	0.000049000	0.000055200	0.000051200	0.000073300	0.000053100	0.000040300	0.000058900	0.000047500	0.000058700	0.000035300	0.000054000	0.000052000	0.000081200	0.000067000	0.000048900	0.000046700	0.000043400	0.000051900	0.000057200	0.000068600	0.000067500	0.000061100	0.000070200	0.000066700	0.000175000	0.000162300	0.000068500	0.000073400	0.000096400	0.000099000
C12H20O3S2	276.085386	1.667	0.250	0.00	0.1667	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H16O5	276.099830	1.067	0.333	0.00	0.0000	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000588500	0.000659900	0.000678500	0.000633800	0.000718400	0.000712800	0.000699500	0.000706300	0.000672800	0.000675000	0.000666700	0.000709800	0.000644700	0.000717700	0.000721900	0.000708700	0.000685200	0.000696300	0.000724700	0.000675100	0.000687200	0.000724900	0.000691200	0.000644600	0.000626600	0.000709100	0.000697300	0.000610800	0.000637900	0.000514800	0.000546500	0.000625100	0.000589200	0.000597100	0.000624500
C12H20O5S	276.103180	1.667	0.417	0.00	0.0833	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000048500	0.000042700	0.000088600	0.000082300	0.000080900	0.000082300	0.000076000	0.000041200	0.000049500	0.000051200	0.000040900	0.000048600	0.000037400	0.000072400	0.000076300	0.000101400	0.000099600	0.000069300	0.000080000	0.000091600	0.000088100	0.000106900	0.000101200	0.000053600	0.000056000	0.000081700	0.000073000	0.000069000	0.000081900	0.000044200	0.000039900	0.000061500	0.000048800	0.000029500	0.000032800
C14H16N2O4	276.110989	1.143	0.286	0.14	0.0000	0.0000	0.40	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000111000	0.000072400	0.000096500	0.000118100	0.000087500	0.000096900	0.000092800	0.000084000	0.000080200	0.000064400	0.000062200	0.000076900	0.000075300	0.000088600	0.000099500	0.000103800	0.000109100	0.000095100	0.000103500	0.000092900	0.000092100	0.000131700	0.000115800	0.000097200	0.000105300	0.000102100	0.000097600	0.000115300	0.000126900	0.000112200	0.000109900	0.000118100	0.000132300	0.000099400	0.000105500
C19H16O2	276.115035	0.842	0.105	0.00	0.0000	0.0000	0.61	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000020100	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000021400	0.000021600	0.000018600	0.000000000	0.000020100	0.000021500	0.000023800	0.000021100
C12H20O7	276.120962	1.667	0.583	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000050500	0.000064600	0.000057700	0.000073400	0.000058500	0.000059900	0.000060400	0.000043100	0.000059900	0.000044600	0.000052500	0.000055600	0.000061400	0.000062800	0.000051200	0.000075700	0.000076800	0.000081500	0.000082800	0.000062300	0.000064300	0.000062300	0.000076900	0.000065600	0.000058100	0.000070700	0.000066500	0.000062800	0.000070500	0.000114000	0.000100800	0.000052200	0.000051100	0.000070800	0.000071300
C16H20O4	276.136144	1.250	0.250	0.00	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000526900	0.000706000	0.000665100	0.000600000	0.000740600	0.000717000	0.000707200	0.000843100	0.000716000	0.000776000	0.000740600	0.000782400	0.000685100	0.000762200	0.000903000	0.000774100	0.000703400	0.000741900	0.000879100	0.000679900	0.000681000	0.000694900	0.000705000	0.000605600	0.000610900	0.000705500	0.000680100	0.000619900	0.000605500	0.000498300	0.000526600	0.000598000	0.000609300	0.000592400	0.000653600
C13H24O4S	276.139533	1.846	0.308	0.00	0.0769	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H20N2O3	276.147456	1.333	0.200	0.13	0.0000	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021400	0.000020000	0.000025300	0.000028900	0.000027300	0.000000000	0.000000000	0.000021500	0.000018300	0.000000000	0.000000000	0.000019000	0.000019200	0.000021300	0.000028200	0.000032600	0.000032500	0.000023800	0.000025100	0.000022700	0.000000000	0.000033600	0.000031200	0.000000000	0.000025900	0.000028000	0.000021200	0.000027900	0.000028600	0.000019600	0.000000000	0.000023300	0.000024600	0.000000000	0.000000000
C13H24O6	276.157275	1.846	0.462	0.00	0.0000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H24O3	276.172602	1.412	0.176	0.00	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000101000	0.000168300	0.000127400	0.000129200	0.000157400	0.000158300	0.000160800	0.000204900	0.000170400	0.000175700	0.000181400	0.000182800	0.000144400	0.000176700	0.000229700	0.000178200	0.000163500	0.000175500	0.000220900	0.000136100	0.000143400	0.000160000	0.000155100	0.000154400	0.000141200	0.000153300	0.000163100	0.000143700	0.000145000	0.000137900	0.000128800	0.000141800	0.000120100	0.000131200	0.000135400
C18H28O2	276.208920	1.556	0.111	0.00	0.0000	0.0000	0.24	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000019600	0.000019700	0.000000000	0.000022500	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000
C12H7NO7	277.022221	0.583	0.583	0.08	0.0000	0.0000	0.73	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000023400	0.000025700
C13H11NO4S	277.040905	0.846	0.308	0.08	0.0769	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044200	0.000019200	0.000030500	0.000062900	0.000032700	0.000034900	0.000033300	0.000000000	0.000024600	0.000000000	0.000000000	0.000022400	0.000020100	0.000026300	0.000032900	0.000052300	0.000040700	0.000025400	0.000020200	0.000030500	0.000031600	0.000039000	0.000039900	0.000034900	0.000032300	0.000031100	0.000029500	0.000055000	0.000058900	0.000000000	0.000000000	0.000062800	0.000054100	0.000000000	0.000018500
C13H11NO6	277.058697	0.846	0.462	0.08	0.0000	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000081100	0.000057600	0.000050300	0.000068400	0.000052200	0.000068500	0.000056800	0.000051400	0.000058500	0.000053600	0.000060500	0.000059100	0.000054900	0.000064500	0.000039300	0.000058600	0.000059700	0.000061800	0.000059400	0.000065900	0.000062600	0.000049400	0.000062800	0.000066200	0.000081200	0.000066500	0.000063100	0.000073900	0.000075500	0.000071900	0.000072400	0.000084600	0.000079400	0.000074900	0.000070800
C10H15NO6S	277.062070	1.500	0.600	0.10	0.1000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000019900	0.000018400	0.000025700	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000019900	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H11NO3	277.073881	0.647	0.176	0.06	0.0000	0.0000	0.72	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000027000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000020900	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000027200	0.000000000	0.000000000	0.000022400	0.000022100	0.000000000	0.000000000	0.000000000	0.000032100	0.000000000	0.000030000
C14H15NO3S	277.077276	1.071	0.214	0.07	0.0714	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000037600	0.000000000	0.000041700	0.000053500	0.000028600	0.000026900	0.000031600	0.000000000	0.000021900	0.000020500	0.000000000	0.000000000	0.000000000	0.000023900	0.000033300	0.000045500	0.000047400	0.000019900	0.000021000	0.000031800	0.000041400	0.000051100	0.000048400	0.000033900	0.000020100	0.000020000	0.000043700	0.000052300	0.000052600	0.000000000	0.000000000	0.000045800	0.000040800	0.000000000	0.000000000
C14H15NO5	277.095010	1.071	0.357	0.07	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000233600	0.000147000	0.000238200	0.000251200	0.000214200	0.000206000	0.000216300	0.000165800	0.000164200	0.000137900	0.000139800	0.000145600	0.000157200	0.000211200	0.000216800	0.000251200	0.000254700	0.000192000	0.000197400	0.000221000	0.000234300	0.000293200	0.000291700	0.000198100	0.000203600	0.000216100	0.000214300	0.000254700	0.000258000	0.000173500	0.000188200	0.000248900	0.000247400	0.000156200	0.000161300
C11H19NO5S	277.098383	1.727	0.455	0.09	0.0909	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H15N3O4	277.106288	1.154	0.308	0.23	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000
C15H19NO4	277.131460	1.267	0.267	0.07	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000074500	0.000065000	0.000105100	0.000101700	0.000091600	0.000100000	0.000093300	0.000079400	0.000075800	0.000064300	0.000055200	0.000080900	0.000070600	0.000108300	0.000113400	0.000125400	0.000116400	0.000083000	0.000095900	0.000091300	0.000104000	0.000144400	0.000127300	0.000075400	0.000079800	0.000094000	0.000099100	0.000094400	0.000097800	0.000074900	0.000081800	0.000098800	0.000080300	0.000058000	0.000058700
C16H23NO3	277.167784	1.438	0.188	0.06	0.0000	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021400	0.000000000	0.000023500	0.000018700	0.000021500	0.000000000	0.000024700	0.000018500	0.000019800	0.000000000	0.000021100	0.000000000	0.000000000	0.000021100	0.000024800	0.000030300	0.000000000	0.000026200	0.000000000	0.000022200	0.000021800	0.000000000	0.000026800	0.000019800	0.000000000	0.000021300	0.000021100	0.000000000	0.000020000	0.000000000	0.000019500	0.000026200	0.000018800	0.000000000	0.000000000
C9H10O6S2	277.991866	1.111	0.667	0.00	0.2222	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000019000	0.000000000	0.000000000	0.000031000	0.000000000	0.000026900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000031000	0.000021300	0.000000000	0.000026200	0.000021000	0.000000000	0.000028200	0.000000000	0.000019600	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000000000	0.000000000
C12H6O8	278.006405	0.500	0.667	0.00	0.0000	0.0000	0.75	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000018100	0.000020500	0.000000000	0.000046200	0.000049600
C13H10O3S2	278.007202	0.769	0.231	0.00	0.1538	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034600	0.000000000	0.000026300	0.000040700	0.000025400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000034100	0.000027000	0.000000000	0.000000000	0.000025400	0.000018300	0.000043800	0.000033700	0.000000000	0.000020200	0.000019700	0.000000000	0.000032500	0.000031400	0.000000000	0.000000000	0.000031400	0.000026500	0.000000000	0.000000000
C13H10O5S	278.024923	0.769	0.385	0.00	0.0769	0.0000	0.58	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000088900	0.000047400	0.000060100	0.000095100	0.000053100	0.000054800	0.000056700	0.000041300	0.000046900	0.000034100	0.000033400	0.000042700	0.000037100	0.000050700	0.000042000	0.000065300	0.000073200	0.000043500	0.000047200	0.000056100	0.000053500	0.000070700	0.000066400	0.000054700	0.000068000	0.000049600	0.000058900	0.000089100	0.000103900	0.000018500	0.000018600	0.000093200	0.000089400	0.000019700	0.000029400
C10H14O5S2	278.028314	1.400	0.500	0.00	0.2000	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000038300	0.000000000	0.000065800	0.000053600	0.000031000	0.000043500	0.000027400	0.000019500	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000031800	0.000028600	0.000051900	0.000067600	0.000035500	0.000029700	0.000063800	0.000071100	0.000082700	0.000094300	0.000023300	0.000026300	0.000047800	0.000044600	0.000051700	0.000051700	0.000000000	0.000000000	0.000037800	0.000027500	0.000000000	0.000000000
C13H10O7	278.042644	0.769	0.538	0.00	0.0000	0.0000	0.58	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000212900	0.000155300	0.000136300	0.000118100	0.000123900	0.000132500	0.000142500	0.000159400	0.000179100	0.000169300	0.000157300	0.000142700	0.000187500	0.000089100	0.000065000	0.000088800	0.000092400	0.000150100	0.000112500	0.000184600	0.000187200	0.000076800	0.000079600	0.000180900	0.000205700	0.000130300	0.000142000	0.000157400	0.000152800	0.000261900	0.000244300	0.000207900	0.000223300	0.000418200	0.000410000
C14H14O2S2	278.043482	1.000	0.143	0.00	0.1429	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000
C10H14O7S	278.046020	1.400	0.700	0.00	0.1000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000044600	0.000037500	0.000040300	0.000056300	0.000034700	0.000047500	0.000043800	0.000036500	0.000046800	0.000040000	0.000030400	0.000026200	0.000034700	0.000041600	0.000041300	0.000056200	0.000070000	0.000055300	0.000052400	0.000040800	0.000033600	0.000046600	0.000048200	0.000043400	0.000063500	0.000047400	0.000050200	0.000058100	0.000052400	0.000074600	0.000051400	0.000049700	0.000050600	0.000031200	0.000037300
C12H10N2O6	278.053944	0.833	0.500	0.17	0.0000	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028400	0.000020100	0.000000000	0.000025300	0.000024500	0.000020500	0.000019000	0.000000000	0.000022600	0.000019600	0.000000000	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000023100	0.000019300	0.000022900	0.000021500	0.000018400	0.000021500	0.000000000	0.000000000	0.000027600	0.000019200	0.000025200	0.000026900	0.000021900	0.000034700	0.000031200	0.000032200	0.000025700	0.000028200	0.000034300
C17H10O4	278.057968	0.588	0.235	0.00	0.0000	0.0000	0.73	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000052000	0.000039900	0.000031000	0.000032400	0.000032100	0.000034100	0.000034900	0.000048300	0.000047300	0.000039200	0.000049500	0.000030300	0.000047900	0.000018400	0.000000000	0.000000000	0.000000000	0.000019400	0.000018700	0.000031200	0.000047800	0.000018200	0.000000000	0.000045200	0.000049900	0.000000000	0.000000000	0.000026900	0.000032500	0.000057000	0.000056400	0.000053300	0.000048800	0.000091300	0.000088500
C14H14O4S	278.061311	1.000	0.286	0.00	0.0714	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000117400	0.000050500	0.000134000	0.000166400	0.000113900	0.000102100	0.000092800	0.000062700	0.000049400	0.000046800	0.000043600	0.000053900	0.000049800	0.000103600	0.000096100	0.000155200	0.000153300	0.000088300	0.000089900	0.000113200	0.000115800	0.000166600	0.000170000	0.000084900	0.000082100	0.000100900	0.000110500	0.000155400	0.000148600	0.000021200	0.000022400	0.000124100	0.000121600	0.000025100	0.000029900
C11H18O4S2	278.064654	1.636	0.364	0.00	0.1818	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000037300	0.000029200	0.000000000	0.000028100	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000024000	0.000030500	0.000000000	0.000000000	0.000026900	0.000026400	0.000049900	0.000037700	0.000000000	0.000000000	0.000023400	0.000024500	0.000023200	0.000029700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H10N2O3	278.069136	0.625	0.188	0.13	0.0000	0.0000	0.76	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H14O6	278.079098	1.000	0.429	0.00	0.0000	0.0000	0.45	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000626300	0.000623100	0.000610200	0.000636800	0.000613500	0.000646800	0.000627300	0.000603900	0.000648400	0.000639000	0.000619100	0.000638300	0.000634600	0.000623700	0.000561400	0.000639100	0.000622600	0.000650300	0.000652900	0.000610000	0.000630300	0.000601300	0.000583100	0.000677900	0.000678900	0.000668900	0.000639900	0.000617700	0.000637900	0.000652300	0.000674600	0.000651100	0.000600600	0.000676100	0.000691700
C11H18O6S	278.082479	1.636	0.545	0.00	0.0909	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000066600	0.000067900	0.000116600	0.000109100	0.000113800	0.000109700	0.000116500	0.000055900	0.000064600	0.000044100	0.000048700	0.000066600	0.000067000	0.000087600	0.000095200	0.000134700	0.000134400	0.000103200	0.000108200	0.000106400	0.000117900	0.000135000	0.000154500	0.000085800	0.000073300	0.000117700	0.000105100	0.000091200	0.000092600	0.000102300	0.000088700	0.000080200	0.000056500	0.000048200	0.000045800
C13H14N2O5	278.090263	1.077	0.385	0.15	0.0000	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000112100	0.000061100	0.000096800	0.000104100	0.000093500	0.000084300	0.000088200	0.000067400	0.000076800	0.000066400	0.000072100	0.000074500	0.000078000	0.000080300	0.000083400	0.000108300	0.000108700	0.000089800	0.000081200	0.000085500	0.000087200	0.000109200	0.000109700	0.000099200	0.000095300	0.000094000	0.000092500	0.000106900	0.000114000	0.000134900	0.000133100	0.000122300	0.000118000	0.000101500	0.000104100
C18H14O3	278.094277	0.778	0.167	0.00	0.0000	0.0000	0.64	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000059900	0.000047300	0.000037400	0.000050500	0.000049600	0.000046100	0.000048900	0.000057100	0.000064600	0.000056200	0.000056800	0.000049300	0.000049400	0.000047000	0.000051500	0.000041500	0.000045600	0.000042000	0.000041600	0.000045100	0.000055900	0.000036900	0.000040000	0.000059300	0.000067400	0.000037300	0.000045800	0.000054300	0.000061000	0.000058100	0.000050500	0.000076300	0.000082000	0.000069600	0.000081200
C15H18O3S	278.097665	1.200	0.200	0.00	0.0667	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000046900	0.000031600	0.000061700	0.000074200	0.000062600	0.000053300	0.000055300	0.000037200	0.000034300	0.000034600	0.000027400	0.000038800	0.000032800	0.000053500	0.000061800	0.000084400	0.000081100	0.000062000	0.000055100	0.000055600	0.000058000	0.000098100	0.000088300	0.000035100	0.000044400	0.000054400	0.000067900	0.000064200	0.000071900	0.000018400	0.000000000	0.000060300	0.000063500	0.000000000	0.000020400
C11H18O8	278.100191	1.636	0.727	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000020400	0.000000000	0.000000000	0.000000000	0.000028100	0.000021900	0.000018500	0.000000000	0.000000000	0.000000000
C15H18O5	278.115417	1.200	0.333	0.00	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001109600	0.001437400	0.001421700	0.001250000	0.001521800	0.001454900	0.001439800	0.001641600	0.001466000	0.001541100	0.001431100	0.001544400	0.001347700	0.001541400	0.001719800	0.001592600	0.001451600	0.001560800	0.001736700	0.001427600	0.001380200	0.001462500	0.001448200	0.001305200	0.001279900	0.001469600	0.001449100	0.001323400	0.001322400	0.001127100	0.001180200	0.001254200	0.001298200	0.001192600	0.001319900
C12H22O5S	278.118782	1.833	0.417	0.00	0.0833	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000025200	0.000036700	0.000028500	0.000037300	0.000033600	0.000039900	0.000020900	0.000000000	0.000023600	0.000020600	0.000000000	0.000023100	0.000018400	0.000024800	0.000042700	0.000040900	0.000026900	0.000027100	0.000033300	0.000037300	0.000043600	0.000045200	0.000031900	0.000000000	0.000026800	0.000000000	0.000030400	0.000025000	0.000026900	0.000027900	0.000024000	0.000019200	0.000000000	0.000022600
C14H18N2O4	278.126696	1.286	0.286	0.14	0.0000	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000068000	0.000045100	0.000078200	0.000082100	0.000059100	0.000067800	0.000049400	0.000058300	0.000059100	0.000030600	0.000040000	0.000050100	0.000049400	0.000074400	0.000080700	0.000097400	0.000088800	0.000071400	0.000065500	0.000064500	0.000077600	0.000089600	0.000087300	0.000059900	0.000070700	0.000066800	0.000072900	0.000074600	0.000082400	0.000083800	0.000084000	0.000080000	0.000068300	0.000053600	0.000052700
C19H18O2	278.130741	0.947	0.105	0.00	0.0000	0.0000	0.56	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000023300	0.000018200	0.000000000	0.000021600	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000020000	0.000019500	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000026500	0.000000000	0.000019200	0.000000000
C16H22O4	278.151842	1.375	0.250	0.00	0.0000	0.0000	0.29	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000395500	0.000558700	0.000517900	0.000485500	0.000619100	0.000608200	0.000602400	0.000667300	0.000573600	0.000603300	0.000561500	0.000660400	0.000514700	0.000673100	0.000804300	0.000668200	0.000625000	0.000635000	0.000760700	0.000528800	0.000519400	0.000620500	0.000563800	0.000489100	0.000487200	0.000562400	0.000560000	0.000487200	0.000490200	0.000462100	0.000427000	0.000507100	0.000439300	0.000443100	0.000504600
C15H22N2O3	278.163037	1.467	0.200	0.13	0.0000	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H26O3	278.188203	1.529	0.176	0.00	0.0000	0.0000	0.23	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000056000	0.000077900	0.000075000	0.000078300	0.000093900	0.000100800	0.000087000	0.000112100	0.000099900	0.000091700	0.000083700	0.000115300	0.000074300	0.000114200	0.000157700	0.000116200	0.000102300	0.000127000	0.000180100	0.000093600	0.000088500	0.000088900	0.000104700	0.000077300	0.000080800	0.000085800	0.000082800	0.000097100	0.000097400	0.000092600	0.000071800	0.000084300	0.000079700	0.000068100	0.000076700
C12H9NO5S	279.020145	0.750	0.417	0.08	0.0833	0.0000	0.60	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028200	0.000000000	0.000000000	0.000028700	0.000000000	0.000019400	0.000028800	0.000018200	0.000000000	0.000019600	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000022700	0.000000000	0.000000000	0.000000000	0.000021100	0.000022500	0.000032100	0.000000000	0.000030100	0.000020600	0.000028100	0.000030800	0.000022700	0.000000000	0.000000000	0.000030500	0.000030600	0.000000000	0.000000000
C12H9NO7	279.037970	0.750	0.583	0.08	0.0000	0.0000	0.60	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020800	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000018800	0.000022700	0.000036400	0.000024300	0.000024000	0.000020700	0.000029000	0.000036200
C16H9NO4	279.053149	0.562	0.250	0.06	0.0000	0.0000	0.77	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000020200	0.000023800	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000022300	0.000024600	0.000000000	0.000024300	0.000000000	0.000000000	0.000018300	0.000022600	0.000024700	0.000021700	0.000028000	0.000025600
C13H13NO4S	279.056545	1.000	0.308	0.08	0.0769	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000073400	0.000024300	0.000068200	0.000087000	0.000052100	0.000054100	0.000044000	0.000029900	0.000027200	0.000000000	0.000019100	0.000000000	0.000000000	0.000051200	0.000043000	0.000063600	0.000072000	0.000042900	0.000047100	0.000053400	0.000058600	0.000086300	0.000082700	0.000043800	0.000039900	0.000044500	0.000048400	0.000084500	0.000082900	0.000000000	0.000000000	0.000073600	0.000067400	0.000000000	0.000000000
C13H13NO6	279.074279	1.000	0.462	0.08	0.0000	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000186600	0.000122500	0.000149500	0.000173000	0.000144600	0.000150700	0.000143100	0.000114400	0.000131300	0.000112100	0.000108500	0.000122500	0.000136400	0.000140700	0.000133000	0.000161600	0.000148000	0.000151900	0.000136000	0.000146700	0.000143700	0.000174300	0.000179500	0.000159600	0.000173800	0.000151000	0.000163900	0.000199600	0.000202500	0.000174600	0.000163800	0.000192000	0.000209700	0.000161100	0.000162100
C10H17NO6S	279.077662	1.700	0.600	0.10	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	1	0	0	0	1	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H13NO3	279.089602	0.765	0.176	0.06	0.0000	0.0000	0.66	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000024100	0.000020800	0.000000000	0.000019900	0.000021600	0.000019300	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000018500	0.000020700	0.000030200	0.000023900	0.000019300	0.000000000	0.000000000	0.000019400	0.000000000	0.000028900	0.000000000	0.000000000	0.000021100	0.000020000	0.000033000	0.000021900	0.000019800	0.000027100	0.000026000	0.000024400	0.000022500
C14H17NO3S	279.092961	1.214	0.214	0.07	0.0714	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000034700	0.000000000	0.000035000	0.000040600	0.000024900	0.000024100	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029200	0.000024300	0.000035100	0.000048300	0.000000000	0.000000000	0.000026700	0.000023600	0.000042900	0.000046700	0.000022300	0.000000000	0.000025000	0.000038800	0.000023300	0.000035700	0.000000000	0.000000000	0.000026100	0.000026600	0.000000000	0.000000000
C14H17NO5	279.110727	1.214	0.357	0.07	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000162100	0.000130500	0.000204000	0.000205200	0.000174600	0.000175600	0.000180300	0.000133600	0.000135600	0.000114500	0.000101700	0.000142700	0.000123500	0.000192700	0.000194800	0.000217400	0.000223200	0.000162800	0.000171600	0.000166400	0.000190900	0.000246200	0.000234800	0.000159700	0.000148700	0.000183800	0.000180800	0.000199100	0.000198600	0.000169200	0.000164700	0.000192400	0.000154400	0.000129300	0.000126900
C13H17N3O4	279.121915	1.308	0.308	0.23	0.0000	0.0000	0.25	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000023900	0.000000000	0.000000000	0.000024100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000020800	0.000018600	0.000000000	0.000000000	0.000000000
C18H17NO2	279.125920	0.944	0.111	0.06	0.0000	0.0000	0.56	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000018300	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H21NO4	279.147061	1.400	0.267	0.07	0.0000	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000060000	0.000052400	0.000090100	0.000081200	0.000079400	0.000070900	0.000070300	0.000058300	0.000059700	0.000043500	0.000039800	0.000051500	0.000049100	0.000079600	0.000099600	0.000101300	0.000094000	0.000067200	0.000081800	0.000083400	0.000077000	0.000114600	0.000098400	0.000064300	0.000047000	0.000072400	0.000074500	0.000069400	0.000070600	0.000051500	0.000056400	0.000074100	0.000063000	0.000040200	0.000045400
C12H8O4S2	279.986384	0.667	0.333	0.00	0.1667	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000
C12H8O6S	280.004224	0.667	0.500	0.00	0.0833	0.0000	0.62	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026600	0.000022000	0.000000000	0.000018300	0.000000000	0.000020900	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000032000	0.000023400	0.000000000	0.000000000	0.000019000	0.000026100	0.000000000	0.000000000	0.000022600	0.000022400	0.000000000	0.000000000
C9H12O6S2	280.007582	1.333	0.667	0.00	0.2222	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000020000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000024400	0.000026300	0.000019200	0.000000000	0.000023500	0.000021800	0.000027800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H8O8	280.021930	0.667	0.667	0.00	0.0000	0.0000	0.62	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000042800	0.000000000	0.000025300	0.000000000	0.000026400	0.000030100	0.000020700	0.000032800	0.000033200	0.000025000	0.000027200	0.000021100	0.000032400	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000034800	0.000037800	0.000000000	0.000000000	0.000027000	0.000032600	0.000018600	0.000000000	0.000020200	0.000019800	0.000055000	0.000052400	0.000043500	0.000038700	0.000133600	0.000117000
C13H12O3S2	280.022800	0.923	0.231	0.00	0.1538	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037700	0.000000000	0.000040400	0.000051400	0.000030000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027200	0.000000000	0.000037400	0.000054600	0.000021700	0.000000000	0.000032400	0.000025700	0.000043300	0.000043700	0.000018300	0.000000000	0.000024600	0.000020200	0.000041700	0.000053900	0.000000000	0.000000000	0.000031900	0.000033100	0.000000000	0.000000000
C16H8O5	280.037182	0.500	0.312	0.00	0.0000	0.0000	0.78	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000042200	0.000038200	0.000000000	0.000022500	0.000024100	0.000028200	0.000026900	0.000038700	0.000057800	0.000035300	0.000025400	0.000032700	0.000035500	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000038100	0.000029100	0.000026200	0.000000000	0.000042700	0.000044500	0.000000000	0.000000000	0.000027800	0.000024500	0.000058000	0.000043800	0.000045800	0.000052800	0.000104600	0.000098300
C13H12O5S	280.040537	0.923	0.385	0.00	0.0769	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000173200	0.000071400	0.000156600	0.000201300	0.000132100	0.000141000	0.000131800	0.000077900	0.000079000	0.000065900	0.000065900	0.000071200	0.000063300	0.000132300	0.000107900	0.000190400	0.000184600	0.000119600	0.000109600	0.000158100	0.000148100	0.000194700	0.000192300	0.000120800	0.000123700	0.000139500	0.000131100	0.000213000	0.000215400	0.000034500	0.000035100	0.000177600	0.000187300	0.000033400	0.000030800
C10H16O5S2	280.043895	1.600	0.500	0.00	0.2000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000023100	0.000000000	0.000036700	0.000044000	0.000029400	0.000028700	0.000028800	0.000018600	0.000019400	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000037900	0.000039800	0.000000000	0.000023600	0.000048500	0.000037000	0.000050200	0.000046800	0.000019000	0.000020500	0.000030600	0.000035300	0.000025500	0.000042500	0.000000000	0.000000000	0.000030300	0.000024700	0.000000000	0.000000000
C13H12O7	280.058355	0.923	0.538	0.00	0.0000	0.0000	0.47	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000332500	0.000293500	0.000237500	0.000260000	0.000236300	0.000273700	0.000259800	0.000268100	0.000323100	0.000299900	0.000293200	0.000279200	0.000313400	0.000243700	0.000174700	0.000217800	0.000229500	0.000314000	0.000257300	0.000287100	0.000271400	0.000189500	0.000200100	0.000340500	0.000375900	0.000284100	0.000285800	0.000288900	0.000292900	0.000434800	0.000401200	0.000350300	0.000338900	0.000498800	0.000481800
C14H16O2S2	280.059171	1.143	0.143	0.00	0.1429	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000000000	0.000022500	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C10H16O7S	280.061700	1.600	0.700	0.00	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000038200	0.000030600	0.000044900	0.000049100	0.000044400	0.000052500	0.000049100	0.000029400	0.000049100	0.000032800	0.000021900	0.000037000	0.000040800	0.000046200	0.000040100	0.000057900	0.000062300	0.000051500	0.000049900	0.000033200	0.000041400	0.000046000	0.000043400	0.000041400	0.000048100	0.000051500	0.000051600	0.000052200	0.000047300	0.000082900	0.000056000	0.000043000	0.000039400	0.000030300	0.000036500
C12H12N2O6	280.069519	1.000	0.500	0.17	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000057800	0.000035600	0.000035000	0.000049300	0.000027500	0.000030400	0.000036600	0.000032100	0.000040500	0.000033200	0.000023700	0.000038400	0.000040900	0.000033800	0.000030200	0.000037800	0.000044000	0.000049400	0.000028100	0.000040400	0.000031300	0.000043600	0.000049200	0.000057500	0.000048700	0.000043100	0.000035900	0.000049100	0.000058500	0.000065200	0.000073700	0.000061600	0.000064100	0.000065600	0.000053000
C17H12O4	280.073558	0.706	0.235	0.00	0.0000	0.0000	0.67	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000115200	0.000087000	0.000066900	0.000085400	0.000067700	0.000079100	0.000084700	0.000098500	0.000103400	0.000087900	0.000085900	0.000096400	0.000091400	0.000057500	0.000054400	0.000057200	0.000064500	0.000061500	0.000067500	0.000086600	0.000091400	0.000059900	0.000052200	0.000101100	0.000123000	0.000062400	0.000072100	0.000090700	0.000090500	0.000111400	0.000103800	0.000123500	0.000126300	0.000146300	0.000151200
C14H16O4S	280.076962	1.143	0.286	0.00	0.0714	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000105100	0.000064000	0.000176800	0.000157300	0.000110400	0.000115900	0.000108400	0.000074000	0.000065800	0.000051900	0.000053600	0.000062400	0.000060300	0.000101100	0.000115400	0.000154400	0.000152000	0.000099900	0.000106500	0.000129900	0.000127700	0.000206600	0.000192300	0.000075000	0.000084000	0.000128100	0.000125300	0.000142700	0.000141200	0.000028800	0.000028500	0.000127200	0.000109300	0.000023600	0.000029700
C16H12N2O3	280.084846	0.750	0.188	0.13	0.0000	0.0000	0.68	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000019400	0.000021500	0.000020000	0.000018600	0.000000000
C14H16O6	280.094674	1.143	0.429	0.00	0.0000	0.0000	0.36	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001483500	0.001581700	0.001602400	0.001504600	0.001651000	0.001665600	0.001596700	0.001689200	0.001646200	0.001635700	0.001521900	0.001581400	0.001538300	0.001689400	0.001664400	0.001717700	0.001631800	0.001785000	0.001848300	0.001632600	0.001551800	0.001575900	0.001614600	0.001555100	0.001615600	0.001682700	0.001584300	0.001623600	0.001611700	0.001650500	0.001691300	0.001551600	0.001714700	0.001594400	0.001650900
C11H20O6S	280.098054	1.818	0.545	0.00	0.0909	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000103200	0.000050500	0.000095200	0.000109300	0.000073900	0.000079300	0.000083600	0.000048300	0.000051100	0.000032600	0.000038600	0.000052700	0.000074500	0.000059400	0.000077300	0.000103600	0.000104700	0.000074500	0.000086100	0.000084000	0.000084300	0.000099300	0.000102600	0.000087800	0.000074900	0.000084200	0.000095400	0.000103900	0.000099300	0.000191200	0.000152200	0.000068300	0.000080500	0.000099400	0.000069400
C13H16N2O5	280.105979	1.231	0.385	0.15	0.0000	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000079700	0.000061800	0.000073700	0.000091000	0.000076500	0.000077600	0.000079800	0.000063400	0.000070900	0.000055000	0.000053300	0.000064500	0.000060600	0.000088300	0.000091400	0.000102900	0.000105700	0.000090900	0.000083200	0.000070800	0.000065500	0.000100600	0.000104400	0.000080800	0.000079300	0.000088300	0.000087400	0.000091700	0.000091200	0.000113600	0.000119900	0.000100400	0.000080400	0.000079400	0.000075000
C18H16O3	280.109996	0.889	0.167	0.00	0.0000	0.0000	0.58	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000041300	0.000047800	0.000037500	0.000047800	0.000055600	0.000057200	0.000054400	0.000058400	0.000052500	0.000051700	0.000062400	0.000051000	0.000049700	0.000051800	0.000060100	0.000049600	0.000042700	0.000044600	0.000045500	0.000042000	0.000044100	0.000050300	0.000040900	0.000039800	0.000048300	0.000033900	0.000037300	0.000054900	0.000055000	0.000047400	0.000038400	0.000061100	0.000056500	0.000054200	0.000065000
C15H20O3S	280.113337	1.333	0.200	0.00	0.0667	0.0000	0.28	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036800	0.000022700	0.000051300	0.000057400	0.000037300	0.000038500	0.000037700	0.000035800	0.000031200	0.000027500	0.000032800	0.000035000	0.000035400	0.000045100	0.000054100	0.000057800	0.000056200	0.000035200	0.000038700	0.000041800	0.000043600	0.000059100	0.000065300	0.000036300	0.000038300	0.000034600	0.000037200	0.000056500	0.000056700	0.000000000	0.000000000	0.000047800	0.000039600	0.000000000	0.000020800
C15H20O5	280.131136	1.333	0.333	0.00	0.0000	0.0000	0.28	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001134200	0.001608200	0.001585000	0.001462500	0.001798200	0.001764700	0.001689100	0.001861100	0.001647800	0.001682300	0.001487300	0.001738700	0.001442300	0.001980900	0.002307900	0.002046000	0.001888700	0.001882400	0.002210100	0.001547300	0.001544900	0.001779400	0.001733100	0.001415100	0.001395100	0.001689800	0.001684300	0.001429300	0.001443900	0.001426900	0.001389600	0.001437500	0.001231700	0.001230400	0.001321200
C14H20N2O4	280.142299	1.429	0.286	0.14	0.0000	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044500	0.000024600	0.000052400	0.000048300	0.000047600	0.000037000	0.000038100	0.000030900	0.000028000	0.000000000	0.000025100	0.000045400	0.000025700	0.000045200	0.000051400	0.000054200	0.000044700	0.000053800	0.000043800	0.000044900	0.000057400	0.000080600	0.000064700	0.000041700	0.000038500	0.000047000	0.000042800	0.000046900	0.000048500	0.000053400	0.000053300	0.000048700	0.000043200	0.000036300	0.000037900
C19H20O2	280.146314	1.053	0.105	0.00	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000022800	0.000018800	0.000019900	0.000022600	0.000021900	0.000027400	0.000029500	0.000034600	0.000028100	0.000024300	0.000026100	0.000023400	0.000020000	0.000030800	0.000021300	0.000000000	0.000000000	0.000024900	0.000000000	0.000033600	0.000024800	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000	0.000000000	0.000022600	0.000000000	0.000000000	0.000020300	0.000026500	0.000027300	0.000020100
C16H24O4	280.167456	1.500	0.250	0.00	0.0000	0.0000	0.21	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000246000	0.000328100	0.000373600	0.000326900	0.000442000	0.000404800	0.000413200	0.000417800	0.000352800	0.000340300	0.000325300	0.000393000	0.000312800	0.000451100	0.000584900	0.000479300	0.000439200	0.000423400	0.000531200	0.000370900	0.000365700	0.000446300	0.000438400	0.000314400	0.000309800	0.000355400	0.000363600	0.000340900	0.000346900	0.000297800	0.000287700	0.000324300	0.000298400	0.000265500	0.000298900
C13H28O4S	280.170815	2.154	0.308	0.00	0.0769	0.0000	0.00	0	0	0	0	0	0	0	0	0	0	0	1	1	0	1	0	0	0	0	0	0.000020500	0.000000000	0.000000000	0.000041000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000221400	0.000000000	0.000022900	0.000019300	0.000054300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000056000	0.000043500
C17H28O3	280.203865	1.647	0.176	0.00	0.0000	0.0000	0.16	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000026200	0.000022900	0.000027200	0.000019300	0.000025100	0.000018600	0.000023600	0.000023800	0.000037200	0.000018400	0.000018100	0.000027300	0.000029700	0.000021200	0.000021700	0.000026400	0.000028300	0.000022600	0.000020500	0.000000000	0.000027600	0.000000000	0.000019300	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000
C12H11NO5S	281.035850	0.917	0.417	0.08	0.0833	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047000	0.000000000	0.000044900	0.000052400	0.000028000	0.000034100	0.000031500	0.000022900	0.000028100	0.000019800	0.000000000	0.000022200	0.000000000	0.000030700	0.000032200	0.000036700	0.000050200	0.000030800	0.000025900	0.000032300	0.000041100	0.000051600	0.000049200	0.000041000	0.000035200	0.000028900	0.000039500	0.000051400	0.000048500	0.000000000	0.000021700	0.000044100	0.000038100	0.000000000	0.000021900
C12H11NO7	281.053588	0.917	0.583	0.08	0.0000	0.0000	0.47	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000051700	0.000030700	0.000031500	0.000039400	0.000030100	0.000040300	0.000025700	0.000038600	0.000045500	0.000040400	0.000027800	0.000031400	0.000036500	0.000029700	0.000020800	0.000000000	0.000029900	0.000040300	0.000032000	0.000034400	0.000035300	0.000023100	0.000026500	0.000046900	0.000044000	0.000024700	0.000030500	0.000043900	0.000049400	0.000074400	0.000052200	0.000052600	0.000048900	0.000060200	0.000053700
C16H11NO4	281.068794	0.688	0.250	0.06	0.0000	0.0000	0.69	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000046300	0.000036700	0.000025500	0.000048200	0.000031100	0.000040700	0.000042400	0.000027000	0.000036500	0.000027600	0.000023700	0.000025100	0.000026500	0.000028000	0.000032400	0.000035300	0.000036100	0.000028400	0.000024800	0.000042100	0.000038700	0.000043900	0.000033400	0.000040300	0.000044700	0.000030600	0.000031700	0.000047400	0.000047100	0.000036500	0.000044700	0.000049000	0.000050800	0.000042700	0.000044800
C13H15NO4S	281.072168	1.154	0.308	0.08	0.0769	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000069600	0.000020900	0.000095400	0.000097600	0.000066300	0.000053200	0.000048600	0.000031100	0.000032900	0.000027500	0.000000000	0.000027100	0.000027800	0.000052700	0.000058400	0.000079000	0.000085800	0.000048000	0.000040800	0.000078500	0.000083700	0.000121400	0.000108800	0.000041300	0.000047600	0.000063700	0.000066400	0.000084200	0.000090000	0.000018900	0.000000000	0.000077500	0.000072400	0.000000000	0.000000000
C13H15NO6	281.089970	1.154	0.462	0.08	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000188400	0.000135600	0.000181600	0.000203700	0.000171900	0.000180700	0.000178300	0.000134600	0.000148900	0.000123900	0.000123200	0.000141700	0.000141600	0.000194200	0.000171300	0.000202300	0.000221800	0.000183100	0.000187100	0.000181300	0.000178300	0.000219400	0.000226600	0.000185900	0.000183900	0.000192800	0.000200500	0.000209100	0.000204500	0.000234600	0.000232000	0.000199200	0.000198100	0.000157700	0.000170100
C12H15N3O5	281.101145	1.250	0.417	0.25	0.0000	0.0000	0.23	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000019800	0.000000000	0.000000000	0.000018300	0.000025800	0.000000000	0.000000000	0.000000000	0.000022600	0.000000000	0.000020000	0.000019500	0.000000000	0.000023900	0.000021900	0.000000000	0.000000000	0.000000000
C17H15NO3	281.105216	0.882	0.176	0.06	0.0000	0.0000	0.59	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000039800	0.000027100	0.000031100	0.000043200	0.000029300	0.000034000	0.000025900	0.000021000	0.000022500	0.000021200	0.000019500	0.000021600	0.000019100	0.000032000	0.000026400	0.000043100	0.000035700	0.000028200	0.000026400	0.000018400	0.000021500	0.000038900	0.000039500	0.000032600	0.000031100	0.000029300	0.000000000	0.000034900	0.000041100	0.000019700	0.000020500	0.000034400	0.000039200	0.000000000	0.000024900
C14H19NO3S	281.108612	1.357	0.214	0.07	0.0714	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020700	0.000026100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000024700	0.000021700	0.000000000	0.000000000	0.000000000	0.000018200	0.000031000	0.000027400	0.000000000	0.000000000	0.000019500	0.000000000	0.000021700	0.000031400	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000
C14H19NO5	281.126307	1.357	0.357	0.07	0.0000	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000164200	0.000131000	0.000232700	0.000199800	0.000195200	0.000194500	0.000194100	0.000141000	0.000131900	0.000111400	0.000107400	0.000132400	0.000122900	0.000197100	0.000228700	0.000256900	0.000239800	0.000186300	0.000223600	0.000210400	0.000203300	0.000289800	0.000289300	0.000151600	0.000154900	0.000198300	0.000192800	0.000206900	0.000194600	0.000174800	0.000182700	0.000182100	0.000184700	0.000124000	0.000132700
C15H23NO4	281.162769	1.533	0.267	0.07	0.0000	0.0000	0.17	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000020000	0.000029800	0.000000000	0.000026700	0.000026500	0.000020600	0.000023200	0.000020600	0.000000000	0.000000000	0.000000000	0.000018200	0.000031600	0.000030800	0.000034500	0.000028900	0.000025900	0.000027300	0.000025900	0.000033300	0.000045000	0.000030000	0.000018900	0.000020800	0.000023900	0.000023200	0.000021100	0.000024900	0.000019200	0.000023700	0.000023100	0.000020000	0.000000000	0.000000000
C12H10O4S2	282.002071	0.833	0.333	0.00	0.1667	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033400	0.000000000	0.000021100	0.000040400	0.000019200	0.000020500	0.000029400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000021200	0.000019500	0.000032800	0.000000000	0.000000000	0.000018700	0.000020700	0.000029900	0.000032500	0.000027100	0.000019400	0.000000000	0.000000000	0.000035100	0.000036900	0.000000000	0.000000000	0.000024300	0.000029400	0.000000000	0.000000000
C15H6O6	282.016472	0.400	0.400	0.00	0.0000	0.0000	0.83	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000028800	0.000018400	0.000023800	0.000025000	0.000051800	0.000046600
C12H10O6S	282.019870	0.833	0.500	0.00	0.0833	0.0000	0.50	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000057700	0.000033200	0.000043300	0.000060300	0.000041900	0.000047000	0.000052100	0.000038300	0.000044100	0.000030300	0.000027600	0.000038400	0.000051000	0.000038300	0.000025100	0.000049000	0.000048200	0.000037700	0.000035500	0.000034900	0.000049900	0.000038000	0.000051000	0.000046100	0.000054300	0.000042000	0.000040400	0.000058800	0.000059500	0.000027000	0.000000000	0.000053100	0.000054900	0.000033500	0.000033100
C9H14O6S2	282.023271	1.556	0.667	0.00	0.2222	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000018500	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000021400	0.000020100	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H10O3S	282.035067	0.625	0.188	0.00	0.0625	0.0000	0.70	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000025000	0.000000000	0.000000000	0.000000000	0.000027400	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000
C12H10O8	282.037561	0.833	0.667	0.00	0.0000	0.0000	0.50	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000089000	0.000059300	0.000046500	0.000038200	0.000052100	0.000056200	0.000055000	0.000070400	0.000079600	0.000075400	0.000071300	0.000057400	0.000078100	0.000030300	0.000023300	0.000027000	0.000028400	0.000059100	0.000037100	0.000072800	0.000074300	0.000023500	0.000021400	0.000078600	0.000082300	0.000050300	0.000051400	0.000048100	0.000056100	0.000153700	0.000129700	0.000084700	0.000094400	0.000226300	0.000217400
C13H14O3S2	282.038429	1.077	0.231	0.00	0.1538	0.0000	0.37	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000043200	0.000000000	0.000055300	0.000060900	0.000030600	0.000031200	0.000029100	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000034000	0.000039400	0.000061300	0.000062200	0.000026800	0.000019300	0.000043900	0.000041000	0.000080900	0.000072000	0.000019100	0.000023000	0.000038900	0.000037600	0.000052900	0.000051700	0.000000000	0.000000000	0.000044000	0.000046600	0.000000000	0.000000000
C16H10O5	282.052857	0.625	0.312	0.00	0.0000	0.0000	0.70	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000117600	0.000096400	0.000071400	0.000077400	0.000074400	0.000073900	0.000086300	0.000097800	0.000099800	0.000100000	0.000090100	0.000093800	0.000085300	0.000067000	0.000052700	0.000055600	0.000067400	0.000077000	0.000067000	0.000092800	0.000089100	0.000065300	0.000050700	0.000102400	0.000115300	0.000072800	0.000079400	0.000082600	0.000077700	0.000141500	0.000124600	0.000124100	0.000119700	0.000173100	0.000184000
C13H14O5S	282.056194	1.077	0.385	0.00	0.0769	0.0000	0.37	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000216700	0.000088700	0.000275000	0.000289000	0.000208200	0.000203400	0.000194300	0.000114500	0.000113600	0.000074500	0.000078300	0.000086700	0.000084700	0.000192000	0.000184800	0.000279600	0.000279800	0.000154200	0.000164100	0.000260900	0.000259600	0.000342900	0.000354000	0.000150100	0.000156700	0.000219100	0.000197100	0.000275400	0.000274500	0.000053200	0.000050300	0.000234400	0.000225100	0.000048100	0.000053100
C10H18O5S2	282.059549	1.800	0.500	0.00	0.2000	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000024400	0.000027500	0.000020500	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000024400	0.000029800	0.000000000	0.000018900	0.000023400	0.000000000	0.000029000	0.000030800	0.000000000	0.000019300	0.000025300	0.000023500	0.000025600	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H10N2O4	282.064046	0.667	0.267	0.13	0.0000	0.0000	0.73	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000023200	0.000000000	0.000000000	0.000023700	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000029700	0.000000000	0.000000000	0.000000000	0.000024400	0.000000000	0.000023000	0.000000000	0.000029400	0.000028500	0.000025900	0.000021200
C13H14O7	282.074015	1.077	0.538	0.00	0.0000	0.0000	0.37	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000680900	0.000634900	0.000535600	0.000625600	0.000619100	0.000681200	0.000612300	0.000625000	0.000751100	0.000663700	0.000613000	0.000633500	0.000670500	0.000702600	0.000545100	0.000599700	0.000612900	0.000735000	0.000653300	0.000600500	0.000612400	0.000515000	0.000537400	0.000734800	0.000811900	0.000664300	0.000644100	0.000696500	0.000695400	0.001011200	0.000961200	0.000739500	0.000684000	0.000823500	0.000834100
C10H18O7S	282.077372	1.800	0.700	0.00	0.1000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000023300	0.000019900	0.000020700	0.000000000	0.000023600	0.000020700	0.000018800	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000020500	0.000027900	0.000025500	0.000034700	0.000029700	0.000026500	0.000026800	0.000022100	0.000022900	0.000029600	0.000023000	0.000021900	0.000020700	0.000022100	0.000030800	0.000022900	0.000026200	0.000048200	0.000038600	0.000000000	0.000022100	0.000020800	0.000021300
C12H14N2O6	282.085175	1.167	0.500	0.17	0.0000	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000075600	0.000053500	0.000064600	0.000073300	0.000053600	0.000067400	0.000059000	0.000038300	0.000059500	0.000041300	0.000038100	0.000044600	0.000045400	0.000060000	0.000059500	0.000076600	0.000078200	0.000062300	0.000066200	0.000068700	0.000072600	0.000082000	0.000090600	0.000074400	0.000065100	0.000069800	0.000077300	0.000082300	0.000077300	0.000103300	0.000100000	0.000085000	0.000083600	0.000063500	0.000070000
C17H14O4	282.089201	0.824	0.235	0.00	0.0000	0.0000	0.60	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000155000	0.000127200	0.000123500	0.000148100	0.000144900	0.000134700	0.000137600	0.000159800	0.000153400	0.000149500	0.000140600	0.000136400	0.000132900	0.000145000	0.000135000	0.000142000	0.000138900	0.000120300	0.000134400	0.000153300	0.000148100	0.000145800	0.000133500	0.000154100	0.000171600	0.000122300	0.000114000	0.000153100	0.000165000	0.000141600	0.000135300	0.000186800	0.000186000	0.000177000	0.000174600
C14H18O4S	282.092592	1.286	0.286	0.00	0.0714	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000096200	0.000054100	0.000130800	0.000128500	0.000097000	0.000094900	0.000096400	0.000072500	0.000060600	0.000059000	0.000060600	0.000068600	0.000053800	0.000094700	0.000113200	0.000138000	0.000116000	0.000091300	0.000098900	0.000109100	0.000105800	0.000152200	0.000147100	0.000075000	0.000079500	0.000101500	0.000112000	0.000120800	0.000113300	0.000028300	0.000030700	0.000100300	0.000093900	0.000026100	0.000038600
C16H14N2O3	282.100500	0.875	0.188	0.13	0.0000	0.0000	0.60	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000022500	0.000000000	0.000000000	0.000021900	0.000000000	0.000023400	0.000022600	0.000018600	0.000000000	0.000018900	0.000026700	0.000000000	0.000028500	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000023600	0.000000000	0.000000000	0.000030400	0.000021900	0.000020100	0.000019900	0.000000000	0.000026800	0.000020600	0.000029600	0.000021600	0.000000000	0.000030400	0.000030700	0.000018700	0.000000000
C14H18O6	282.110330	1.286	0.429	0.00	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.002381000	0.002816200	0.002980200	0.002736200	0.003238400	0.003237900	0.003020700	0.003220200	0.002914000	0.002907300	0.002587200	0.002866100	0.002627100	0.003491000	0.003610400	0.003637500	0.003289900	0.003414300	0.003751300	0.002997600	0.002804700	0.003070100	0.003080700	0.002726800	0.002824700	0.003013500	0.002874100	0.003020800	0.003001800	0.003151800	0.003024700	0.002762800	0.002904700	0.002576900	0.002765000
C11H22O6S	282.113674	2.000	0.545	0.00	0.0909	0.0000	0.00	1	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000
C13H18N2O5	282.121610	1.385	0.385	0.15	0.0000	0.0000	0.18	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000064500	0.000047900	0.000092000	0.000072900	0.000066500	0.000064900	0.000054700	0.000048400	0.000055600	0.000035600	0.000037100	0.000063200	0.000042900	0.000079600	0.000077500	0.000083600	0.000094400	0.000076600	0.000072700	0.000070500	0.000077200	0.000109100	0.000104600	0.000058100	0.000064100	0.000082300	0.000077000	0.000068500	0.000073700	0.000089700	0.000085400	0.000074500	0.000060000	0.000052300	0.000056100
C18H18O3	282.125653	1.000	0.167	0.00	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000048100	0.000060100	0.000050600	0.000055100	0.000063900	0.000062100	0.000064500	0.000067700	0.000063100	0.000067700	0.000073100	0.000074800	0.000073300	0.000066000	0.000083100	0.000066700	0.000054900	0.000051900	0.000077800	0.000060500	0.000071700	0.000064000	0.000058600	0.000063700	0.000060100	0.000055100	0.000042500	0.000060700	0.000053600	0.000052400	0.000048700	0.000065800	0.000057400	0.000054700	0.000065600
C15H22O3S	282.129011	1.467	0.200	0.00	0.0667	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025700	0.000018000	0.000024300	0.000052200	0.000026800	0.000033100	0.000029300	0.000020800	0.000000000	0.000000000	0.000021800	0.000000000	0.000000000	0.000031000	0.000035100	0.000049800	0.000036000	0.000000000	0.000033600	0.000031400	0.000029000	0.000043700	0.000045900	0.000019000	0.000023500	0.000028100	0.000028400	0.000037000	0.000042300	0.000000000	0.000019700	0.000030300	0.000026700	0.000000000	0.000018800
C17H18N2O2	282.136807	1.059	0.118	0.12	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000
C15H22O5	282.146754	1.467	0.333	0.00	0.0000	0.0000	0.20	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000894600	0.001237800	0.001499300	0.001231200	0.001662100	0.001614700	0.001541000	0.001475100	0.001295700	0.001206200	0.001097400	0.001394300	0.001056200	0.001760400	0.002116100	0.001965000	0.001778900	0.001694500	0.001984300	0.001393200	0.001362400	0.001753400	0.001721700	0.001159700	0.001106300	0.001461100	0.001459800	0.001235000	0.001243100	0.001261000	0.001177500	0.001167600	0.001012400	0.000911700	0.001020200
C14H22N2O4	282.157974	1.571	0.286	0.14	0.0000	0.0000	0.10	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000019700	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C19H22O2	282.161970	1.158	0.105	0.00	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020000	0.000019300	0.000019500	0.000020800	0.000025600	0.000021800	0.000029400	0.000031100	0.000028400	0.000041400	0.000040600	0.000030900	0.000022400	0.000022400	0.000037900	0.000025300	0.000027900	0.000034300	0.000037500	0.000024700	0.000026800	0.000019800	0.000000000	0.000000000	0.000000000	0.000023200	0.000019700	0.000021800	0.000027100	0.000000000	0.000000000	0.000022100	0.000022500	0.000022500	0.000022700
C16H26O4	282.183149	1.625	0.250	0.00	0.0000	0.0000	0.14	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000051600	0.000077600	0.000098600	0.000083500	0.000120400	0.000112300	0.000121400	0.000090300	0.000091700	0.000070800	0.000067500	0.000090500	0.000068300	0.000115800	0.000154600	0.000131500	0.000120100	0.000112100	0.000143400	0.000107600	0.000096000	0.000133300	0.000126700	0.000084600	0.000068200	0.000088000	0.000097100	0.000084700	0.000078200	0.000082600	0.000074200	0.000080000	0.000071000	0.000061500	0.000069200
C18H34O2	282.255939	1.889	0.111	0.00	0.0000	0.0000	0.06	2	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000026900	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000034400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000026100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028200	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H9NO6S	283.015090	0.818	0.545	0.09	0.0909	0.0000	0.50	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000018500	0.000000000	0.000000000	0.000019500	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000
C15H9NO5	283.048131	0.600	0.333	0.07	0.0000	0.0000	0.74	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000033100	0.000022000	0.000021600	0.000024700	0.000000000	0.000000000	0.000022100	0.000020800	0.000039500	0.000000000	0.000000000	0.000020000	0.000018400	0.000000000	0.000000000	0.000024800	0.000025100	0.000019600	0.000021900	0.000021600	0.000000000	0.000018700	0.000000000	0.000032000	0.000024900	0.000021800	0.000000000	0.000031300	0.000021500	0.000032000	0.000044500	0.000040200	0.000037800	0.000046100	0.000043100
C12H13NO5S	283.051471	1.083	0.417	0.08	0.0833	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000066700	0.000022700	0.000083700	0.000090900	0.000048400	0.000059100	0.000067700	0.000029900	0.000034600	0.000021500	0.000021400	0.000000000	0.000027300	0.000064200	0.000054100	0.000088100	0.000082000	0.000049000	0.000038700	0.000082000	0.000078000	0.000104400	0.000116200	0.000051000	0.000043500	0.000073900	0.000065600	0.000093000	0.000092000	0.000018000	0.000000000	0.000083500	0.000072100	0.000000000	0.000019300
C12H13NO7	283.069245	1.083	0.583	0.08	0.0000	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000077100	0.000051300	0.000047400	0.000072100	0.000051400	0.000064600	0.000062100	0.000054700	0.000064600	0.000050000	0.000053800	0.000058300	0.000067500	0.000061000	0.000045800	0.000061500	0.000066200	0.000073500	0.000064500	0.000064100	0.000053900	0.000046200	0.000058200	0.000081800	0.000090800	0.000068300	0.000056600	0.000081300	0.000089400	0.000131900	0.000130500	0.000081000	0.000085800	0.000094600	0.000088700
C16H13NO4	283.084450	0.812	0.250	0.06	0.0000	0.0000	0.62	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000080200	0.000043400	0.000061500	0.000079700	0.000066100	0.000065200	0.000060800	0.000050100	0.000060900	0.000045400	0.000036300	0.000035300	0.000052100	0.000061200	0.000060400	0.000066600	0.000060500	0.000052300	0.000047600	0.000065800	0.000064600	0.000076400	0.000073600	0.000064300	0.000069600	0.000053100	0.000053000	0.000087800	0.000079000	0.000055000	0.000054200	0.000088900	0.000093200	0.000058700	0.000056800
C13H17NO4S	283.087811	1.308	0.308	0.08	0.0769	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000052900	0.000028100	0.000078000	0.000064000	0.000036700	0.000037800	0.000043000	0.000024200	0.000018200	0.000000000	0.000000000	0.000028300	0.000000000	0.000032300	0.000042200	0.000059500	0.000066600	0.000036300	0.000038400	0.000055800	0.000059200	0.000083600	0.000077500	0.000023900	0.000035500	0.000035200	0.000032600	0.000065700	0.000062600	0.000000000	0.000000000	0.000043300	0.000049500	0.000000000	0.000000000
C13H17NO6	283.105616	1.308	0.462	0.08	0.0000	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000186600	0.000152600	0.000242700	0.000225900	0.000213900	0.000225100	0.000222400	0.000160600	0.000153400	0.000129300	0.000124800	0.000151800	0.000147000	0.000247500	0.000237800	0.000283500	0.000277600	0.000231900	0.000223600	0.000223100	0.000216500	0.000302700	0.000299300	0.000193900	0.000197700	0.000229600	0.000228200	0.000236800	0.000225800	0.000244500	0.000255900	0.000214800	0.000196900	0.000158300	0.000152600
C12H17N3O5	283.116858	1.417	0.417	0.25	0.0000	0.0000	0.08	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C17H17NO3	283.120872	1.000	0.176	0.06	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023900	0.000000000	0.000026000	0.000028800	0.000022200	0.000024800	0.000029300	0.000000000	0.000027500	0.000025100	0.000000000	0.000020100	0.000000000	0.000035500	0.000033300	0.000031800	0.000024900	0.000018500	0.000020000	0.000026900	0.000027500	0.000036100	0.000024900	0.000037500	0.000031100	0.000025000	0.000024300	0.000030600	0.000033100	0.000000000	0.000026300	0.000034600	0.000029800	0.000020200	0.000024500
C14H21NO3S	283.124303	1.500	0.214	0.07	0.0714	0.0000	0.14	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H21NO5	283.141967	1.500	0.357	0.07	0.0000	0.0000	0.14	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000064000	0.000054600	0.000126300	0.000096300	0.000102200	0.000102900	0.000095300	0.000072100	0.000071500	0.000044600	0.000044200	0.000055100	0.000049400	0.000111000	0.000130700	0.000126700	0.000130300	0.000094300	0.000118800	0.000115700	0.000120500	0.000155200	0.000151900	0.000074700	0.000073500	0.000093800	0.000104400	0.000094200	0.000097700	0.000073600	0.000080900	0.000088700	0.000078000	0.000059100	0.000059100
C11H8O7S	283.999132	0.727	0.636	0.00	0.0909	0.0000	0.54	8	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000022500	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030800	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000018400	0.000000000	0.000021600	0.000024200	0.000026800	0.000000000
C15H8O4S	284.014321	0.533	0.267	0.00	0.0667	0.0000	0.75	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000023000	0.000025300	0.000000000	0.000000000
C12H12O4S2	284.017691	1.000	0.333	0.00	0.1667	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047100	0.000000000	0.000040600	0.000050000	0.000031500	0.000030800	0.000025000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000052000	0.000048300	0.000000000	0.000019300	0.000034800	0.000034000	0.000050800	0.000050000	0.000000000	0.000025800	0.000029200	0.000033000	0.000051400	0.000056900	0.000000000	0.000000000	0.000046800	0.000048900	0.000000000	0.000000000
C15H8O6	284.032145	0.533	0.400	0.00	0.0000	0.0000	0.75	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000067200	0.000076200	0.000048500	0.000039500	0.000045900	0.000046600	0.000052200	0.000067600	0.000085200	0.000067000	0.000060500	0.000084100	0.000057400	0.000035000	0.000066700	0.000047800	0.000029000	0.000051700	0.000030100	0.000071100	0.000056200	0.000072900	0.000033400	0.000057200	0.000067400	0.000056800	0.000040900	0.000035000	0.000037100	0.000129000	0.000082200	0.000070500	0.000063200	0.000152300	0.000140900
C12H12O6S	284.035489	1.000	0.500	0.00	0.0833	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000124000	0.000067100	0.000118700	0.000143300	0.000113900	0.000119900	0.000113400	0.000077600	0.000082100	0.000053900	0.000056600	0.000060300	0.000077000	0.000108100	0.000086000	0.000139200	0.000145600	0.000107300	0.000098400	0.000121400	0.000128800	0.000144400	0.000146400	0.000107300	0.000112100	0.000119900	0.000119700	0.000162900	0.000142000	0.000061500	0.000053300	0.000132000	0.000118900	0.000052000	0.000040500
C9H16O6S2	284.038789	1.778	0.667	0.00	0.2222	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H8N2O5	284.043314	0.571	0.357	0.14	0.0000	0.0000	0.79	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000018700
C16H12O3S	284.050750	0.750	0.188	0.00	0.0625	0.0000	0.63	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000027000	0.000019100	0.000000000	0.000032000	0.000030000	0.000000000	0.000000000	0.000018800	0.000000000	0.000021300	0.000000000	0.000023600	0.000000000	0.000023100	0.000000000	0.000018500	0.000032100	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000021700	0.000021100	0.000019800	0.000000000	0.000021800	0.000027700	0.000035900	0.000000000	0.000000000	0.000037000	0.000026100	0.000000000	0.000000000
C12H12O8	284.053279	1.000	0.667	0.00	0.0000	0.0000	0.38	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000170200	0.000131900	0.000082800	0.000109300	0.000104500	0.000119100	0.000121500	0.000128800	0.000174900	0.000151500	0.000126600	0.000141100	0.000162300	0.000119500	0.000071900	0.000083200	0.000093200	0.000143400	0.000101100	0.000128800	0.000131500	0.000065000	0.000076700	0.000172400	0.000217300	0.000112500	0.000118500	0.000152400	0.000142100	0.000398900	0.000324800	0.000204100	0.000187700	0.000304700	0.000283400
C13H16O3S2	284.054130	1.231	0.231	0.00	0.1538	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018600	0.000000000	0.000040300	0.000040000	0.000022000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000035400	0.000034400	0.000018700	0.000000000	0.000028700	0.000034400	0.000053100	0.000044700	0.000022900	0.000000000	0.000024300	0.000025000	0.000026600	0.000028200	0.000000000	0.000000000	0.000023100	0.000022400	0.000000000	0.000000000
C11H12N2O7	284.064418	1.091	0.636	0.18	0.0000	0.0000	0.27	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025200	0.000027600	0.000000000	0.000019600	0.000024500	0.000000000
C16H12O5	284.068457	0.750	0.312	0.00	0.0000	0.0000	0.63	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000268200	0.000179000	0.000196000	0.000217400	0.000185500	0.000197100	0.000194700	0.000213200	0.000232600	0.000196600	0.000193400	0.000203000	0.000203400	0.000166200	0.000162400	0.000171400	0.000156800	0.000175800	0.000157000	0.000216700	0.000202600	0.000192500	0.000168200	0.000222100	0.000241300	0.000178600	0.000164100	0.000237400	0.000226300	0.000206200	0.000200600	0.000275400	0.000293500	0.000299500	0.000313200
C13H16O5S	284.071838	1.231	0.385	0.00	0.0769	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000231700	0.000112900	0.000290300	0.000307000	0.000230900	0.000222200	0.000217400	0.000133800	0.000129600	0.000112100	0.000099800	0.000121100	0.000117400	0.000234800	0.000229400	0.000326900	0.000333700	0.000205800	0.000217800	0.000275000	0.000266100	0.000351100	0.000355500	0.000196600	0.000184600	0.000227400	0.000225800	0.000312600	0.000303600	0.000156400	0.000144400	0.000253900	0.000250600	0.000082200	0.000101300
C15H12N2O4	284.079764	0.800	0.267	0.13	0.0000	0.0000	0.64	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000037100	0.000020500	0.000018300	0.000039200	0.000027800	0.000029900	0.000028600	0.000000000	0.000028500	0.000027600	0.000024800	0.000000000	0.000022000	0.000027000	0.000019600	0.000022200	0.000030200	0.000026300	0.000021400	0.000023000	0.000031200	0.000030600	0.000024900	0.000035300	0.000033500	0.000026800	0.000029400	0.000024800	0.000042400	0.000022800	0.000026200	0.000035300	0.000035200	0.000027200	0.000026900
C13H16O7	284.089618	1.231	0.538	0.00	0.0000	0.0000	0.26	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001706900	0.001667200	0.001650600	0.001765900	0.001838500	0.001934100	0.001809400	0.001752700	0.001844800	0.001721900	0.001507500	0.001613500	0.001688700	0.002097200	0.001826300	0.001986300	0.001917900	0.002109500	0.002070000	0.001802000	0.001704100	0.001674200	0.001792300	0.001877100	0.002011000	0.001892900	0.001767900	0.002042000	0.001976400	0.002640400	0.002465400	0.001854800	0.001983100	0.001882900	0.001919400
C12H16N2O6	284.100841	1.333	0.500	0.17	0.0000	0.0000	0.14	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000058400	0.000041900	0.000068700	0.000071400	0.000053300	0.000064700	0.000067600	0.000038100	0.000043600	0.000038700	0.000025900	0.000043200	0.000039700	0.000058200	0.000068600	0.000076600	0.000086100	0.000069300	0.000069300	0.000067900	0.000073600	0.000090900	0.000092400	0.000056800	0.000057900	0.000080600	0.000066500	0.000070800	0.000078700	0.000097200	0.000086900	0.000070400	0.000076100	0.000054600	0.000056800
C17H16O4	284.104893	0.941	0.235	0.00	0.0000	0.0000	0.53	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000155600	0.000164300	0.000159800	0.000170700	0.000181500	0.000181800	0.000170800	0.000185800	0.000168400	0.000176700	0.000173500	0.000165000	0.000153200	0.000171300	0.000196600	0.000183200	0.000169600	0.000155900	0.000169400	0.000165800	0.000167700	0.000179000	0.000166000	0.000167100	0.000161700	0.000148100	0.000156000	0.000165000	0.000165300	0.000136100	0.000133000	0.000177100	0.000167300	0.000159600	0.000170700
C14H20O4S	284.108280	1.429	0.286	0.00	0.0714	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000049200	0.000041000	0.000084300	0.000097500	0.000074400	0.000076100	0.000073800	0.000051100	0.000044900	0.000038800	0.000037100	0.000052900	0.000042200	0.000065700	0.000075200	0.000103800	0.000104000	0.000068300	0.000077300	0.000078900	0.000087000	0.000111700	0.000104000	0.000057000	0.000048100	0.000078100	0.000076000	0.000088100	0.000081200	0.000021000	0.000023400	0.000078900	0.000062900	0.000019400	0.000021700
C16H16N2O3	284.116121	1.000	0.188	0.13	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000035800	0.000000000	0.000026600	0.000037700	0.000000000	0.000035500	0.000034000	0.000027400	0.000000000	0.000000000	0.000026900	0.000033800	0.000023100	0.000000000	0.000031600	0.000038900	0.000042500	0.000031100	0.000028700	0.000028200	0.000027100	0.000000000	0.000032900	0.000030000	0.000026200	0.000021600	0.000033800	0.000044800	0.000033700	0.000031200	0.000024600	0.000040500	0.000039100	0.000020000	0.000031400
C14H20O6	284.125980	1.429	0.429	0.00	0.0000	0.0000	0.18	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.002041400	0.002445000	0.003103400	0.002554400	0.003244000	0.003155300	0.003000200	0.002818300	0.002520000	0.002470700	0.002189400	0.002543300	0.002204400	0.003288600	0.003701300	0.003671700	0.003296300	0.003314100	0.003830200	0.002981000	0.002752600	0.003247700	0.003342900	0.002434300	0.002415000	0.002936800	0.002802000	0.002776700	0.002745500	0.002954400	0.002826400	0.002426400	0.002510400	0.002059200	0.002242900
C13H20N2O5	284.137274	1.538	0.385	0.15	0.0000	0.0000	0.06	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000035300	0.000000000	0.000025100	0.000026300	0.000026500	0.000021700	0.000019800	0.000000000	0.000021300	0.000000000	0.000000000	0.000021600	0.000019800	0.000026400	0.000027400	0.000047100	0.000037200	0.000029200	0.000032400	0.000026400	0.000033100	0.000038800	0.000046000	0.000000000	0.000000000	0.000023500	0.000023700	0.000028400	0.000025700	0.000037400	0.000027700	0.000020900	0.000000000	0.000019800	0.000000000
C18H20O3	284.141279	1.111	0.167	0.00	0.0000	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000063000	0.000098400	0.000079200	0.000093000	0.000100000	0.000094300	0.000096900	0.000125200	0.000120100	0.000129300	0.000121900	0.000105400	0.000099800	0.000094500	0.000127100	0.000103700	0.000095100	0.000098800	0.000118200	0.000092800	0.000100100	0.000090800	0.000092700	0.000086400	0.000091500	0.000094200	0.000093300	0.000083400	0.000077500	0.000056700	0.000067600	0.000088900	0.000072500	0.000082600	0.000093200
C15H24O3S	284.144617	1.600	0.200	0.00	0.0667	0.0000	0.12	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000000000	0.000021700	0.000018200	0.000021400	0.000023400	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024100	0.000018300	0.000026000	0.000023700	0.000019100	0.000032600	0.000025000	0.000019300	0.000021100	0.000027900	0.000020100	0.000025300	0.000000000	0.000000000	0.000026700	0.000025700	0.000000000	0.000000000	0.000000000	0.000025300	0.000000000	0.000000000
C17H20N2O2	284.152447	1.176	0.118	0.12	0.0000	0.0000	0.43	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000020400	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H24O5	284.162436	1.600	0.333	0.00	0.0000	0.0000	0.12	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000243900	0.000358300	0.000503800	0.000372300	0.000561100	0.000513900	0.000516600	0.000436000	0.000376900	0.000341700	0.000315200	0.000406700	0.000304600	0.000556500	0.000679300	0.000634900	0.000562800	0.000561900	0.000669300	0.000480500	0.000441600	0.000592500	0.000581800	0.000359700	0.000330200	0.000465200	0.000481800	0.000371800	0.000386200	0.000400000	0.000365800	0.000341800	0.000275400	0.000281300	0.000286800
C19H24O2	284.177624	1.263	0.105	0.00	0.0000	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000032500	0.000038300	0.000030200	0.000023900	0.000027600	0.000028700	0.000027600	0.000039300	0.000037700	0.000048400	0.000042000	0.000047600	0.000021600	0.000041300	0.000049600	0.000046200	0.000040400	0.000035400	0.000039700	0.000021500	0.000026800	0.000029700	0.000035000	0.000021000	0.000034800	0.000025900	0.000020400	0.000036600	0.000031300	0.000018800	0.000027000	0.000038200	0.000035500	0.000031400	0.000032900
C16H28O4	284.198764	1.750	0.250	0.00	0.0000	0.0000	0.07	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000029000	0.000025800	0.000029100	0.000036800	0.000031400	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000029200	0.000029200	0.000022600	0.000036700	0.000029000	0.000027000	0.000022600	0.000027800	0.000035800	0.000021600	0.000019000	0.000023600	0.000026300	0.000024300	0.000022100	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000024500
C18H36O2	284.271586	2.000	0.111	0.00	0.0000	0.0000	0.00	1	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000021400	0.000018300	0.000000000	0.000000000	0.000033400	0.000022200	0.000022000	0.000018300	0.000019900	0.000000000	0.000000000	0.000000000	0.000025000	0.000000000	0.000000000	0.000024300	0.000000000	0.000000000	0.000000000	0.000032200	0.000023000	0.000000000	0.000020300	0.000000000	0.000000000	0.000026900
C14H7NO6	285.027374	0.500	0.429	0.07	0.0000	0.0000	0.80	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000000000	0.000035400	0.000024300	0.000000000	0.000021300	0.000025100	0.000027300
C11H11NO6S	285.030720	1.000	0.545	0.09	0.0909	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000039600	0.000000000	0.000038800	0.000034500	0.000035600	0.000040700	0.000027200	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000036600	0.000020600	0.000032500	0.000037500	0.000030800	0.000021400	0.000032800	0.000036700	0.000042800	0.000045900	0.000025500	0.000028700	0.000031200	0.000044700	0.000038800	0.000040900	0.000000000	0.000000000	0.000030900	0.000036500	0.000020000	0.000020800
C15H11NO3S	285.046001	0.733	0.200	0.07	0.0667	0.0000	0.65	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000021100	0.000020900	0.000000000	0.000000000
C11H11NO8	285.048526	1.000	0.727	0.09	0.0000	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000021100	0.000000000	0.000000000	0.000019500	0.000023300
C15H11NO5	285.063707	0.733	0.333	0.07	0.0000	0.0000	0.65	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000097100	0.000050300	0.000065400	0.000081800	0.000064400	0.000075000	0.000061000	0.000048300	0.000064600	0.000050200	0.000050100	0.000051100	0.000058600	0.000069800	0.000060300	0.000068700	0.000065300	0.000049200	0.000059900	0.000061800	0.000064100	0.000082700	0.000072200	0.000075100	0.000087200	0.000063500	0.000063300	0.000094400	0.000091100	0.000059900	0.000058800	0.000104000	0.000104600	0.000075000	0.000068400
C12H15NO5S	285.067092	1.250	0.417	0.08	0.0833	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000085900	0.000018400	0.000110700	0.000109000	0.000065300	0.000068900	0.000071300	0.000034900	0.000034000	0.000025800	0.000020900	0.000030700	0.000026700	0.000069500	0.000062500	0.000098300	0.000105600	0.000054800	0.000052600	0.000102700	0.000094600	0.000141300	0.000156500	0.000052800	0.000058000	0.000075800	0.000075700	0.000108300	0.000107400	0.000019700	0.000028100	0.000089200	0.000081000	0.000000000	0.000000000
C12H15NO7	285.084860	1.250	0.583	0.08	0.0000	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000121300	0.000096000	0.000096000	0.000117800	0.000111600	0.000120100	0.000114200	0.000084800	0.000100800	0.000079900	0.000068600	0.000080800	0.000086700	0.000118300	0.000100300	0.000131200	0.000133400	0.000129700	0.000123000	0.000113700	0.000104400	0.000135900	0.000141300	0.000115400	0.000135600	0.000131000	0.000117900	0.000152900	0.000150200	0.000185600	0.000181900	0.000133200	0.000138700	0.000118400	0.000114900
C16H15NO4	285.100162	0.938	0.250	0.06	0.0000	0.0000	0.54	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000069300	0.000048300	0.000082600	0.000086100	0.000069200	0.000074500	0.000060700	0.000047200	0.000054300	0.000033800	0.000041000	0.000046300	0.000042100	0.000057400	0.000062600	0.000079100	0.000079600	0.000051100	0.000056900	0.000066200	0.000068600	0.000093400	0.000089800	0.000057400	0.000071700	0.000056800	0.000060500	0.000088500	0.000088800	0.000045800	0.000039300	0.000072300	0.000076100	0.000038100	0.000045200
C13H19NO4S	285.103560	1.462	0.308	0.08	0.0769	0.0000	0.11	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000040300	0.000021800	0.000019000	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000028300	0.000037400	0.000000000	0.000000000	0.000027500	0.000035200	0.000050200	0.000047700	0.000000000	0.000000000	0.000022200	0.000019200	0.000021100	0.000026300	0.000000000	0.000000000	0.000023100	0.000021900	0.000000000	0.000000000
C13H19NO6	285.121239	1.462	0.462	0.08	0.0000	0.0000	0.11	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000119500	0.000106400	0.000212900	0.000159600	0.000169500	0.000164700	0.000164700	0.000095700	0.000097300	0.000083400	0.000065300	0.000094400	0.000094900	0.000167000	0.000177400	0.000211200	0.000192100	0.000163000	0.000177400	0.000187000	0.000163700	0.000251400	0.000257700	0.000121500	0.000120100	0.000184300	0.000176600	0.000151000	0.000156000	0.000150100	0.000154800	0.000126900	0.000113800	0.000086100	0.000094200
C17H19NO3	285.136520	1.118	0.176	0.06	0.0000	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000023000	0.000029100	0.000025300	0.000032500	0.000021200	0.000030500	0.000028800	0.000019400	0.000023800	0.000000000	0.000024600	0.000023500	0.000000000	0.000027300	0.000036400	0.000028400	0.000028900	0.000024000	0.000023400	0.000024000	0.000027600	0.000043000	0.000031800	0.000022100	0.000018100	0.000023600	0.000033500	0.000029400	0.000028500	0.000029300	0.000024400	0.000030900	0.000024300	0.000000000	0.000000000
C14H23NO5	285.157681	1.643	0.357	0.07	0.0000	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000031300	0.000023900	0.000028100	0.000021800	0.000028000	0.000022100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000040300	0.000032400	0.000023600	0.000022000	0.000020600	0.000032300	0.000034700	0.000040700	0.000046500	0.000025300	0.000021400	0.000036100	0.000031000	0.000019700	0.000025400	0.000023700	0.000018200	0.000025800	0.000000000	0.000000000	0.000000000
C11H10O5S2	285.997021	0.909	0.455	0.00	0.1818	0.0000	0.38	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025500	0.000000000	0.000025100	0.000030800	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000018100	0.000000000	0.000020700	0.000022500	0.000026100	0.000029300	0.000024000	0.000000000	0.000000000	0.000000000	0.000029500	0.000029200	0.000000000	0.000000000	0.000020200	0.000023400	0.000000000	0.000000000
C14H6O7	286.011324	0.429	0.500	0.00	0.0000	0.0000	0.81	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000022200	0.000000000	0.000000000	0.000019800	0.000018400	0.000023300	0.000024400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000018200	0.000018200	0.000024200	0.000070400	0.000064400
C11H10O7S	286.014715	0.909	0.636	0.00	0.0909	0.0000	0.38	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000043500	0.000026100	0.000036800	0.000045800	0.000031200	0.000043400	0.000046600	0.000033500	0.000033700	0.000031400	0.000024300	0.000027800	0.000041400	0.000036900	0.000020200	0.000041800	0.000049000	0.000047100	0.000034800	0.000034300	0.000048800	0.000039800	0.000048500	0.000045600	0.000045300	0.000047800	0.000048100	0.000067400	0.000059800	0.000040100	0.000044600	0.000039800	0.000057800	0.000037500	0.000042500
C15H10O4S	286.030015	0.667	0.267	0.00	0.0667	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000032300	0.000000000	0.000021800	0.000033200	0.000019200	0.000020000	0.000000000	0.000022100	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000027100	0.000032100	0.000023400	0.000000000	0.000018900	0.000000000	0.000022100	0.000000000	0.000033600	0.000026900	0.000020900	0.000019300	0.000032400	0.000035800	0.000000000	0.000000000	0.000040100	0.000040900	0.000000000	0.000019100
C11H10O9	286.032527	0.909	0.818	0.00	0.0000	0.0000	0.38	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000039500	0.000030100	0.000000000	0.000000000	0.000046800	0.000038000
C12H14O4S2	286.033369	1.167	0.333	0.00	0.1667	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000042300	0.000000000	0.000066700	0.000069500	0.000033000	0.000030200	0.000038900	0.000019200	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000033600	0.000020500	0.000061900	0.000067900	0.000029300	0.000019600	0.000045300	0.000047900	0.000086600	0.000072900	0.000032200	0.000027200	0.000038300	0.000044100	0.000060600	0.000054800	0.000000000	0.000000000	0.000042400	0.000049700	0.000000000	0.000000000
C15H10O6	286.047771	0.667	0.400	0.00	0.0000	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000177600	0.000139800	0.000117900	0.000132700	0.000110400	0.000119600	0.000137500	0.000141800	0.000178500	0.000150200	0.000157100	0.000141000	0.000150700	0.000090600	0.000092900	0.000097100	0.000092200	0.000121200	0.000101100	0.000140400	0.000146400	0.000119100	0.000090700	0.000156500	0.000170000	0.000117600	0.000120900	0.000129900	0.000125700	0.000200200	0.000155700	0.000188100	0.000185600	0.000287100	0.000272600
C12H14O6S	286.051167	1.167	0.500	0.00	0.0833	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000135400	0.000082400	0.000156200	0.000194400	0.000137800	0.000153600	0.000144700	0.000090000	0.000097700	0.000076600	0.000071200	0.000079500	0.000083900	0.000128000	0.000116600	0.000207300	0.000210300	0.000132700	0.000132200	0.000150200	0.000155500	0.000188700	0.000195000	0.000139800	0.000129700	0.000158200	0.000146400	0.000200400	0.000196600	0.000063600	0.000067500	0.000157400	0.000136100	0.000053000	0.000043600
C14H10N2O5	286.059000	0.714	0.357	0.14	0.0000	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028400	0.000018200	0.000000000	0.000022200	0.000022900	0.000022700	0.000019100	0.000000000	0.000029300	0.000021400	0.000000000	0.000030300	0.000000000	0.000024700	0.000000000	0.000022700	0.000018100	0.000021900	0.000000000	0.000000000	0.000022200	0.000020100	0.000019000	0.000023000	0.000026100	0.000000000	0.000025300	0.000035100	0.000024600	0.000000000	0.000026300	0.000032200	0.000033900	0.000028600	0.000020500
C19H10O3	286.062970	0.526	0.158	0.00	0.0000	0.0000	0.77	15	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000022100	0.000025400
C16H14O3S	286.066346	0.875	0.188	0.00	0.0625	0.0000	0.56	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000047300	0.000021500	0.000032000	0.000050700	0.000033900	0.000031200	0.000026700	0.000000000	0.000028000	0.000030800	0.000000000	0.000019800	0.000000000	0.000035300	0.000027800	0.000040500	0.000044900	0.000031200	0.000025600	0.000034600	0.000030400	0.000039600	0.000044800	0.000027100	0.000039300	0.000030000	0.000021000	0.000055500	0.000057300	0.000000000	0.000000000	0.000061300	0.000051400	0.000000000	0.000000000
C12H14O8	286.068853	1.167	0.667	0.00	0.0000	0.0000	0.25	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000512400	0.000373400	0.000300800	0.000399900	0.000366700	0.000443000	0.000402600	0.000391700	0.000536900	0.000429200	0.000358600	0.000357300	0.000453100	0.000456100	0.000297100	0.000357800	0.000368100	0.000512900	0.000408800	0.000431700	0.000406900	0.000313200	0.000351100	0.000505000	0.000643700	0.000432100	0.000396600	0.000549500	0.000536800	0.001139100	0.000977000	0.000564500	0.000632700	0.000731600	0.000724800
C13H18O3S2	286.069672	1.385	0.231	0.00	0.1538	0.0000	0.16	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000029600	0.000025500	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028200	0.000022900	0.000000000	0.000000000	0.000000000	0.000030100	0.000027800	0.000034900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H14N2O7	286.080163	1.273	0.636	0.18	0.0000	0.0000	0.09	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400
C16H14O5	286.084170	0.875	0.312	0.00	0.0000	0.0000	0.56	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000285900	0.000251000	0.000266800	0.000292700	0.000268100	0.000255600	0.000282300	0.000251700	0.000265400	0.000250400	0.000261500	0.000260600	0.000254800	0.000262000	0.000257500	0.000257100	0.000252500	0.000247000	0.000233500	0.000265900	0.000264400	0.000273000	0.000259700	0.000270100	0.000279600	0.000256200	0.000253200	0.000280700	0.000278500	0.000234600	0.000221100	0.000298700	0.000295400	0.000284400	0.000290300
C13H18O5S	286.087512	1.385	0.385	0.00	0.0769	0.0000	0.16	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000181000	0.000116000	0.000265200	0.000261200	0.000224000	0.000187800	0.000181200	0.000122600	0.000114600	0.000100800	0.000095600	0.000119400	0.000123700	0.000203700	0.000213100	0.000298300	0.000291500	0.000178100	0.000195900	0.000308400	0.000306800	0.000411900	0.000307000	0.000169500	0.000157700	0.000208500	0.000200200	0.000253900	0.000243700	0.000168400	0.000171200	0.000199100	0.000190900	0.000096000	0.000128000
C15H14N2O4	286.095343	0.933	0.267	0.13	0.0000	0.0000	0.55	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000068900	0.000048800	0.000058600	0.000077500	0.000058100	0.000055500	0.000054500	0.000046600	0.000043400	0.000050800	0.000051200	0.000045800	0.000052600	0.000059200	0.000054400	0.000060800	0.000061300	0.000058900	0.000048500	0.000048000	0.000054700	0.000067800	0.000068700	0.000062500	0.000067000	0.000053400	0.000059100	0.000068800	0.000074000	0.000060300	0.000061100	0.000077100	0.000085900	0.000058000	0.000061600
C13H18O7	286.105310	1.385	0.538	0.00	0.0000	0.0000	0.16	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001364700	0.001475700	0.001570300	0.001620300	0.001710700	0.001766100	0.001675900	0.001542500	0.001620300	0.001495900	0.001276900	0.001505100	0.001359200	0.001935600	0.001802200	0.001996300	0.001950200	0.002049600	0.002133900	0.001657500	0.001582000	0.001692000	0.001786100	0.001637200	0.001683900	0.001789200	0.001748200	0.001755600	0.001737300	0.002389200	0.002223000	0.001590600	0.001526900	0.001450800	0.001516000
C12H18N2O6	286.116484	1.500	0.500	0.17	0.0000	0.0000	0.00	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000027600	0.000023600	0.000033600	0.000029100	0.000033000	0.000028800	0.000025100	0.000024000	0.000000000	0.000020600	0.000000000	0.000026900	0.000000000	0.000022400	0.000028500	0.000045100	0.000041600	0.000037300	0.000031200	0.000030600	0.000027600	0.000034700	0.000050000	0.000032400	0.000029400	0.000032900	0.000034800	0.000033100	0.000040600	0.000045900	0.000050200	0.000027800	0.000028200	0.000022900	0.000020500
C17H18O4	286.120492	1.059	0.235	0.00	0.0000	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000237500	0.000295000	0.000288800	0.000262700	0.000325700	0.000313300	0.000309800	0.000341100	0.000304200	0.000326400	0.000314800	0.000327200	0.000289800	0.000314100	0.000345900	0.000295100	0.000280600	0.000306900	0.000328500	0.000304600	0.000298700	0.000331600	0.000309500	0.000262600	0.000266600	0.000275900	0.000278600	0.000277900	0.000274400	0.000199900	0.000211700	0.000277600	0.000294300	0.000272900	0.000283400
C14H22O4S	286.123870	1.571	0.286	0.00	0.0714	0.0000	0.09	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000040100	0.000029900	0.000079300	0.000067600	0.000073000	0.000065200	0.000059300	0.000041100	0.000032600	0.000028600	0.000031300	0.000044100	0.000027000	0.000056300	0.000057700	0.000081800	0.000069300	0.000047500	0.000063800	0.000076900	0.000076200	0.000094900	0.000097600	0.000040000	0.000041800	0.000067200	0.000062400	0.000082800	0.000074000	0.000018700	0.000018500	0.000059000	0.000054000	0.000019800	0.000020000
C16H18N2O3	286.131787	1.125	0.188	0.13	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027300	0.000000000	0.000033100	0.000032000	0.000022300	0.000031400	0.000031900	0.000000000	0.000000000	0.000000000	0.000000000	0.000028300	0.000021900	0.000000000	0.000035300	0.000030200	0.000040200	0.000026400	0.000029700	0.000000000	0.000030000	0.000035200	0.000000000	0.000020600	0.000037500	0.000034400	0.000028100	0.000040400	0.000000000	0.000029700	0.000000000	0.000044100	0.000029700	0.000022400	0.000019400
C14H22O6	286.141659	1.571	0.429	0.00	0.0000	0.0000	0.09	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000587600	0.000756100	0.001024000	0.000822000	0.001029500	0.000984800	0.000983000	0.000809500	0.000722900	0.000677100	0.000614100	0.000812200	0.000650800	0.001021200	0.001177200	0.001199800	0.001092100	0.001092200	0.001255900	0.000977900	0.000909600	0.001121800	0.001133000	0.000763500	0.000723700	0.000945600	0.000951800	0.000831000	0.000813000	0.000952200	0.000931600	0.000743900	0.000689300	0.000642800	0.000673600
C18H22O3	286.156927	1.222	0.167	0.00	0.0000	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000084700	0.000151200	0.000118300	0.000107200	0.000135500	0.000143100	0.000130200	0.000172400	0.000160800	0.000173900	0.000152300	0.000175800	0.000133200	0.000145300	0.000169600	0.000133800	0.000136000	0.000139700	0.000163500	0.000121400	0.000127800	0.000124300	0.000115300	0.000119200	0.000116600	0.000130000	0.000122300	0.000114700	0.000109600	0.000088200	0.000088200	0.000118000	0.000094500	0.000098900	0.000111800
C15H26O5	286.178013	1.733	0.333	0.00	0.0000	0.0000	0.04	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000050400	0.000069600	0.000114900	0.000071200	0.000116700	0.000114400	0.000096600	0.000080900	0.000064900	0.000057200	0.000058300	0.000072400	0.000053100	0.000090700	0.000126500	0.000133600	0.000109400	0.000115100	0.000144300	0.000115900	0.000100500	0.000124000	0.000124400	0.000069800	0.000066300	0.000089300	0.000106900	0.000081300	0.000084400	0.000073800	0.000080200	0.000068200	0.000063500	0.000053600	0.000057800
C19H26O2	286.193336	1.368	0.105	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000028800	0.000020700	0.000021200	0.000021800	0.000027700	0.000019800	0.000031600	0.000022100	0.000031400	0.000033600	0.000021400	0.000023000	0.000000000	0.000033000	0.000032500	0.000020600	0.000026700	0.000021600	0.000018800	0.000019000	0.000000000	0.000022400	0.000023900	0.000000000	0.000019800	0.000022400	0.000020300	0.000021600	0.000020200	0.000021400	0.000024300	0.000000000	0.000019800	0.000023000
C14H9NO4S	287.025211	0.643	0.286	0.07	0.0714	0.0000	0.70	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000018700	0.000000000	0.000000000	0.000026700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000000000	0.000019200	0.000020900	0.000000000	0.000000000	0.000026500	0.000027000	0.000000000	0.000000000
C14H9NO6	287.043044	0.643	0.429	0.07	0.0000	0.0000	0.70	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034900	0.000021500	0.000023000	0.000032100	0.000028900	0.000025100	0.000023500	0.000022600	0.000026400	0.000026100	0.000024800	0.000029400	0.000025600	0.000024000	0.000000000	0.000023200	0.000018100	0.000027800	0.000022000	0.000019100	0.000029100	0.000022000	0.000025800	0.000029800	0.000039800	0.000031600	0.000028800	0.000032700	0.000027800	0.000036800	0.000031900	0.000040900	0.000032300	0.000040400	0.000044200
C11H13NO6S	287.046383	1.182	0.545	0.09	0.0909	0.0000	0.17	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044300	0.000022200	0.000053900	0.000049900	0.000037500	0.000032300	0.000035700	0.000021200	0.000000000	0.000024400	0.000000000	0.000023000	0.000023000	0.000038200	0.000028700	0.000042100	0.000061400	0.000036300	0.000035300	0.000057300	0.000048000	0.000063300	0.000074700	0.000040500	0.000043000	0.000048600	0.000035300	0.000057900	0.000057400	0.000024800	0.000018500	0.000039900	0.000049700	0.000000000	0.000000000
C15H13NO3S	287.061638	0.867	0.200	0.07	0.0667	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000028100	0.000000000	0.000020100	0.000028000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000018600	0.000024100	0.000036800	0.000000000	0.000000000	0.000000000	0.000000000	0.000030500	0.000024800	0.000022400	0.000021100	0.000022300	0.000000000	0.000030700	0.000028300	0.000000000	0.000000000	0.000032100	0.000028900	0.000000000	0.000000000
C11H13NO8	287.064166	1.182	0.727	0.09	0.0000	0.0000	0.17	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000026100	0.000022100	0.000020600	0.000019100	0.000018500
C15H13NO5	287.079362	0.867	0.333	0.07	0.0000	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000148100	0.000082100	0.000120900	0.000137900	0.000117600	0.000107300	0.000112500	0.000083400	0.000088500	0.000081800	0.000072600	0.000080600	0.000083300	0.000103500	0.000100900	0.000121900	0.000123400	0.000096400	0.000091100	0.000118600	0.000109100	0.000140400	0.000139000	0.000112700	0.000120000	0.000118600	0.000104400	0.000153200	0.000155100	0.000087500	0.000088400	0.000158300	0.000162200	0.000103400	0.000104600
C12H17NO5S	287.082730	1.417	0.417	0.08	0.0833	0.0000	0.07	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000067000	0.000000000	0.000115300	0.000094100	0.000061700	0.000057800	0.000060300	0.000024300	0.000026400	0.000000000	0.000000000	0.000000000	0.000026200	0.000058400	0.000059900	0.000092900	0.000095200	0.000040000	0.000057900	0.000100300	0.000096900	0.000157000	0.000157000	0.000041700	0.000038300	0.000076100	0.000070200	0.000085500	0.000086000	0.000000000	0.000000000	0.000062700	0.000062700	0.000000000	0.000000000
C12H17NO7	287.100531	1.417	0.583	0.08	0.0000	0.0000	0.07	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061200	0.000056100	0.000080400	0.000083400	0.000065500	0.000078200	0.000079900	0.000050000	0.000063600	0.000045600	0.000045200	0.000048100	0.000056800	0.000080700	0.000065000	0.000090300	0.000097200	0.000079100	0.000085200	0.000081500	0.000084400	0.000110100	0.000116400	0.000068800	0.000070400	0.000087400	0.000072400	0.000093600	0.000085200	0.000109400	0.000112100	0.000068100	0.000063900	0.000055800	0.000056300
C16H17NO4	287.115773	1.062	0.250	0.06	0.0000	0.0000	0.46	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000076800	0.000063900	0.000105700	0.000104300	0.000089600	0.000090500	0.000096600	0.000067600	0.000060300	0.000056000	0.000049500	0.000057500	0.000050400	0.000092700	0.000101100	0.000116300	0.000108100	0.000076300	0.000077400	0.000096900	0.000098700	0.000140100	0.000120000	0.000070400	0.000074500	0.000080800	0.000081000	0.000099100	0.000111400	0.000047000	0.000054000	0.000091100	0.000093300	0.000059000	0.000052900
C13H21NO4S	287.119175	1.615	0.308	0.08	0.0769	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000025300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H21NO6	287.136872	1.615	0.462	0.08	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000031700	0.000030400	0.000065300	0.000046000	0.000044300	0.000044000	0.000045700	0.000021900	0.000026600	0.000022000	0.000000000	0.000023500	0.000025200	0.000050600	0.000047900	0.000065800	0.000053100	0.000056000	0.000052400	0.000064000	0.000061300	0.000075900	0.000071900	0.000037000	0.000028400	0.000047300	0.000061300	0.000052500	0.000048700	0.000037400	0.000041700	0.000034400	0.000042100	0.000026500	0.000028500
C17H21NO3	287.152201	1.235	0.176	0.06	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000020500	0.000022600	0.000000000	0.000021400	0.000000000	0.000031500	0.000020900	0.000022300	0.000019000	0.000000000	0.000000000	0.000019100	0.000019200	0.000020300	0.000026200	0.000000000	0.000020400	0.000021700	0.000018100	0.000000000	0.000000000	0.000031600	0.000026300	0.000023700	0.000000000	0.000019700	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000025600	0.000000000	0.000000000
C14H8O5S	288.009285	0.571	0.357	0.00	0.0714	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000029600	0.000018100	0.000000000	0.000031700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024800	0.000029900	0.000000000	0.000000000	0.000020900	0.000023900	0.000000000	0.000000000	0.000035200	0.000019700	0.000000000	0.000000000
C11H12O5S2	288.012666	1.091	0.455	0.00	0.1818	0.0000	0.23	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000042300	0.000000000	0.000046700	0.000049300	0.000022100	0.000034200	0.000029700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026500	0.000024200	0.000048800	0.000045400	0.000022500	0.000022500	0.000043000	0.000055100	0.000063500	0.000071400	0.000027800	0.000026400	0.000029900	0.000035700	0.000051000	0.000054200	0.000000000	0.000000000	0.000037300	0.000039500	0.000000000	0.000000000
C14H8O7	288.026993	0.571	0.500	0.00	0.0000	0.0000	0.71	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000083300	0.000050500	0.000046700	0.000046200	0.000039200	0.000051700	0.000052100	0.000062200	0.000073300	0.000057200	0.000061600	0.000050300	0.000067800	0.000025800	0.000021500	0.000000000	0.000021100	0.000039300	0.000031000	0.000068400	0.000079600	0.000022600	0.000000000	0.000060800	0.000073600	0.000031800	0.000035400	0.000046900	0.000035100	0.000083200	0.000082400	0.000075800	0.000079500	0.000181800	0.000175900
C11H12O7S	288.030387	1.091	0.636	0.00	0.0909	0.0000	0.23	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000062400	0.000041200	0.000055500	0.000059600	0.000055700	0.000058700	0.000056000	0.000038000	0.000045800	0.000045100	0.000043800	0.000038200	0.000054400	0.000049300	0.000035200	0.000052200	0.000066800	0.000064100	0.000045100	0.000056400	0.000055000	0.000060500	0.000054100	0.000055600	0.000076300	0.000070800	0.000065300	0.000084100	0.000084600	0.000047900	0.000038600	0.000071600	0.000075100	0.000040200	0.000028100
C15H12O4S	288.045637	0.800	0.267	0.00	0.0667	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000084000	0.000032400	0.000056300	0.000116100	0.000066900	0.000063900	0.000054400	0.000038900	0.000034700	0.000025600	0.000031500	0.000036300	0.000027500	0.000061100	0.000046500	0.000086600	0.000086600	0.000047000	0.000037900	0.000047300	0.000059700	0.000088500	0.000071600	0.000059600	0.000067100	0.000056800	0.000060900	0.000103300	0.000102600	0.000000000	0.000000000	0.000097000	0.000095900	0.000022600	0.000025200
C11H12O9	288.048126	1.091	0.818	0.00	0.0000	0.0000	0.23	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000043400	0.000024300	0.000000000	0.000022300	0.000000000	0.000029900	0.000021600	0.000026900	0.000036800	0.000033100	0.000023300	0.000024300	0.000025800	0.000023300	0.000000000	0.000000000	0.000000000	0.000030900	0.000000000	0.000027800	0.000021400	0.000000000	0.000000000	0.000031900	0.000046800	0.000000000	0.000000000	0.000028800	0.000024500	0.000106200	0.000082500	0.000041800	0.000055300	0.000078100	0.000085400
C12H16O4S2	288.048987	1.333	0.333	0.00	0.1667	0.0000	0.12	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000037900	0.000000000	0.000063000	0.000050700	0.000036600	0.000035100	0.000044100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000027900	0.000034300	0.000059300	0.000048000	0.000026200	0.000033300	0.000050700	0.000050900	0.000071600	0.000079600	0.000025200	0.000027400	0.000042200	0.000034300	0.000051400	0.000058400	0.000000000	0.000000000	0.000040700	0.000038600	0.000000000	0.000000000
C15H12O6	288.063442	0.800	0.400	0.00	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000315800	0.000248800	0.000237000	0.000271900	0.000237200	0.000252700	0.000246400	0.000244000	0.000282800	0.000253600	0.000245300	0.000245100	0.000269200	0.000213500	0.000187400	0.000223900	0.000220800	0.000249000	0.000223300	0.000262400	0.000268900	0.000212300	0.000209900	0.000301300	0.000303200	0.000238300	0.000246300	0.000269400	0.000270100	0.000274100	0.000244000	0.000320200	0.000310400	0.000362800	0.000352900
C12H16O6S	288.066816	1.333	0.500	0.00	0.0833	0.0000	0.12	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000136600	0.000098800	0.000189500	0.000209200	0.000163200	0.000161400	0.000159300	0.000112600	0.000109200	0.000088900	0.000095500	0.000100100	0.000102600	0.000148600	0.000141100	0.000228300	0.000230500	0.000173700	0.000162800	0.000176500	0.000178500	0.000220100	0.000223800	0.000140800	0.000136600	0.000184500	0.000173700	0.000207200	0.000224900	0.000080000	0.000069100	0.000168400	0.000139700	0.000046600	0.000056000
C14H12N2O5	288.074625	0.857	0.357	0.14	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000062500	0.000043400	0.000046800	0.000064000	0.000049900	0.000050600	0.000055000	0.000035400	0.000046300	0.000037600	0.000050000	0.000044200	0.000048400	0.000041800	0.000039700	0.000046900	0.000050500	0.000049300	0.000035100	0.000050800	0.000047700	0.000052800	0.000048200	0.000047400	0.000050400	0.000042900	0.000053200	0.000057800	0.000063600	0.000051700	0.000059200	0.000073400	0.000073100	0.000062800	0.000050800
C19H12O3	288.078622	0.632	0.158	0.00	0.0000	0.0000	0.71	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000025800	0.000000000	0.000019600	0.000000000	0.000019000	0.000023100	0.000000000	0.000025100	0.000021100	0.000024500	0.000018800	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025000	0.000000000	0.000000000	0.000000000	0.000026800	0.000029900	0.000000000	0.000000000	0.000000000	0.000020000	0.000045800	0.000037200	0.000026600	0.000035100	0.000044300	0.000037700
C16H16O3S	288.082002	1.000	0.188	0.00	0.0625	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000038300	0.000000000	0.000031400	0.000050700	0.000031500	0.000039800	0.000038100	0.000024800	0.000027500	0.000019400	0.000000000	0.000020700	0.000027800	0.000034700	0.000044500	0.000056200	0.000037900	0.000034200	0.000031700	0.000030900	0.000037200	0.000051300	0.000043800	0.000027700	0.000028100	0.000031800	0.000045200	0.000050000	0.000051300	0.000000000	0.000000000	0.000041700	0.000050200	0.000000000	0.000000000
C12H16O8	288.084519	1.333	0.667	0.00	0.0000	0.0000	0.12	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000446200	0.000388900	0.000329800	0.000423200	0.000377500	0.000427500	0.000392000	0.000372900	0.000480800	0.000415800	0.000343100	0.000356100	0.000403300	0.000451500	0.000321000	0.000409700	0.000430300	0.000563700	0.000489400	0.000408900	0.000392200	0.000346300	0.000380800	0.000486000	0.000592500	0.000478700	0.000450700	0.000513100	0.000523000	0.001118200	0.000983900	0.000519000	0.000518100	0.000620700	0.000612400
C13H20O3S2	288.085360	1.538	0.231	0.00	0.1538	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000021800	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H16O5	288.099799	1.000	0.312	0.00	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000423300	0.000445300	0.000503200	0.000445800	0.000501100	0.000468200	0.000477800	0.000486200	0.000462900	0.000458500	0.000433200	0.000450500	0.000439500	0.000498000	0.000511400	0.000495300	0.000494100	0.000469300	0.000458500	0.000490300	0.000463900	0.000530000	0.000508100	0.000427200	0.000439900	0.000450600	0.000478200	0.000430300	0.000452000	0.000342700	0.000334400	0.000439300	0.000425600	0.000402500	0.000410000
C13H20O5S	288.103142	1.538	0.385	0.00	0.0769	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000092800	0.000062800	0.000166400	0.000144300	0.000128500	0.000129400	0.000129400	0.000083100	0.000077400	0.000078000	0.000069100	0.000078900	0.000069500	0.000117600	0.000115400	0.000174800	0.000160700	0.000117400	0.000132400	0.000160600	0.000160800	0.000201300	0.000195800	0.000097600	0.000090900	0.000136500	0.000138300	0.000145900	0.000136800	0.000062800	0.000052900	0.000118300	0.000109400	0.000045500	0.000049900
C15H16N2O4	288.110998	1.067	0.267	0.13	0.0000	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000090100	0.000066300	0.000084500	0.000096300	0.000082000	0.000078000	0.000083300	0.000068000	0.000066100	0.000060000	0.000068300	0.000065300	0.000071700	0.000089400	0.000087500	0.000094500	0.000096200	0.000074400	0.000080300	0.000086600	0.000077400	0.000104200	0.000099200	0.000084500	0.000089700	0.000086000	0.000078100	0.000102300	0.000109400	0.000087700	0.000099700	0.000105400	0.000107600	0.000075500	0.000078700
C13H20O7	288.120965	1.538	0.538	0.00	0.0000	0.0000	0.05	4	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000407200	0.000492400	0.000568400	0.000533200	0.000586100	0.000601400	0.000568300	0.000468000	0.000483900	0.000454300	0.000412300	0.000504300	0.000446600	0.000611600	0.000638500	0.000726600	0.000703400	0.000716900	0.000792100	0.000555200	0.000549300	0.000608900	0.000636400	0.000533300	0.000507200	0.000628900	0.000649400	0.000539900	0.000568900	0.000775800	0.000751100	0.000521200	0.000449200	0.000454200	0.000465300
C17H20O4	288.136140	1.176	0.235	0.00	0.0000	0.0000	0.40	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000307700	0.000456700	0.000420800	0.000368800	0.000479600	0.000468500	0.000437400	0.000543700	0.000461700	0.000524500	0.000476100	0.000501900	0.000433700	0.000473800	0.000574600	0.000470400	0.000440800	0.000464100	0.000539400	0.000441700	0.000417200	0.000463100	0.000454800	0.000376200	0.000379500	0.000429000	0.000409700	0.000374000	0.000386900	0.000295200	0.000285700	0.000378300	0.000381900	0.000354700	0.000386300
C14H24O4S	288.139518	1.714	0.286	0.00	0.0714	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000038600	0.000032100	0.000023800	0.000026700	0.000024900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000024500	0.000042800	0.000027500	0.000029600	0.000027000	0.000026400	0.000031700	0.000037000	0.000044900	0.000000000	0.000000000	0.000018200	0.000034900	0.000024500	0.000026500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H20N2O3	288.147461	1.250	0.188	0.13	0.0000	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024300	0.000000000	0.000000000	0.000033800	0.000023300	0.000021900	0.000000000	0.000020800	0.000020700	0.000000000	0.000019100	0.000000000	0.000000000	0.000023600	0.000027600	0.000020400	0.000028800	0.000025200	0.000018500	0.000023900	0.000020700	0.000031100	0.000030700	0.000023100	0.000021600	0.000027700	0.000026800	0.000025800	0.000024600	0.000000000	0.000018600	0.000032500	0.000024200	0.000000000	0.000000000
C14H24O6	288.157294	1.714	0.429	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000091500	0.000106400	0.000161200	0.000131600	0.000160100	0.000146900	0.000152600	0.000112700	0.000107800	0.000080400	0.000098000	0.000116400	0.000089500	0.000140000	0.000178700	0.000178400	0.000174300	0.000166600	0.000197100	0.000157200	0.000138100	0.000176600	0.000173400	0.000123000	0.000093400	0.000144200	0.000157700	0.000129400	0.000128100	0.000151600	0.000134300	0.000108000	0.000102700	0.000098500	0.000102000
C18H24O3	288.172589	1.333	0.167	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000091400	0.000153700	0.000108300	0.000111900	0.000146800	0.000128300	0.000126000	0.000173700	0.000158500	0.000164500	0.000161000	0.000175200	0.000136200	0.000154700	0.000184300	0.000146000	0.000141200	0.000141100	0.000176500	0.000116300	0.000117000	0.000125200	0.000104400	0.000116300	0.000118300	0.000133300	0.000123600	0.000117200	0.000109700	0.000088400	0.000090400	0.000122100	0.000089600	0.000098600	0.000109900
C19H28O2	288.209010	1.474	0.105	0.00	0.0000	0.0000	0.28	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028700	0.000021200	0.000018000	0.000025500	0.000024800	0.000000000	0.000022700	0.000000000	0.000022500	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000
C13H7NO7	289.022272	0.538	0.538	0.08	0.0000	0.0000	0.76	11	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000021700
C10H11NO7S	289.025656	1.100	0.700	0.10	0.1000	0.0000	0.11	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000019100	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H11NO4S	289.040917	0.786	0.286	0.07	0.0714	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000043800	0.000000000	0.000019700	0.000038700	0.000022600	0.000018300	0.000019700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000044100	0.000018900	0.000000000	0.000028000	0.000023900	0.000027200	0.000032600	0.000024000	0.000027200	0.000023400	0.000000000	0.000048700	0.000040200	0.000000000	0.000000000	0.000047000	0.000035300	0.000000000	0.000000000
C14H11NO6	289.058628	0.786	0.429	0.07	0.0000	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000111700	0.000060900	0.000077000	0.000085300	0.000070300	0.000082100	0.000076100	0.000067800	0.000070800	0.000065000	0.000067300	0.000064500	0.000063400	0.000061400	0.000060400	0.000069800	0.000073000	0.000071500	0.000068400	0.000081200	0.000085100	0.000075100	0.000089200	0.000086000	0.000093500	0.000067500	0.000065000	0.000102400	0.000104900	0.000080300	0.000081400	0.000109200	0.000121900	0.000101500	0.000096200
C11H15NO6S	289.061993	1.364	0.545	0.09	0.0909	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000058000	0.000000000	0.000085400	0.000085200	0.000047100	0.000051900	0.000046700	0.000036100	0.000029000	0.000000000	0.000021300	0.000026400	0.000000000	0.000048300	0.000037800	0.000069100	0.000069700	0.000048300	0.000046600	0.000081400	0.000079000	0.000102600	0.000122700	0.000038100	0.000048800	0.000068100	0.000059100	0.000078300	0.000076000	0.000035600	0.000035000	0.000052200	0.000060900	0.000024600	0.000021300
C15H15NO3S	289.077328	1.000	0.200	0.07	0.0667	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025700	0.000000000	0.000021600	0.000029500	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000033900	0.000029500	0.000018300	0.000000000	0.000021300	0.000019400	0.000023600	0.000031400	0.000000000	0.000019900	0.000000000	0.000018200	0.000033500	0.000028000	0.000000000	0.000000000	0.000019600	0.000022200	0.000000000	0.000000000
C15H15NO5	289.095039	1.000	0.333	0.07	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000176200	0.000110900	0.000184800	0.000185900	0.000155800	0.000147200	0.000162500	0.000112000	0.000109500	0.000102400	0.000104000	0.000104800	0.000106100	0.000157900	0.000163200	0.000178000	0.000190700	0.000129700	0.000144500	0.000156300	0.000159500	0.000204300	0.000212300	0.000145500	0.000146700	0.000146500	0.000150700	0.000180300	0.000178100	0.000110400	0.000121600	0.000169300	0.000177000	0.000105200	0.000111500
C12H19NO5S	289.098444	1.583	0.417	0.08	0.0833	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000019500	0.000000000	0.000032900	0.000039000	0.000019800	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025300	0.000000000	0.000030600	0.000031100	0.000019100	0.000000000	0.000027400	0.000032700	0.000032700	0.000040200	0.000000000	0.000018300	0.000018200	0.000019600	0.000022500	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000
C14H15N3O4	289.106244	1.071	0.286	0.21	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000
C12H19NO7	289.116139	1.583	0.583	0.08	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	0	0	0	0	0	0.000022300	0.000022600	0.000029800	0.000037900	0.000019200	0.000026900	0.000024300	0.000000000	0.000021900	0.000000000	0.000020500	0.000000000	0.000000000	0.000022500	0.000019100	0.000029200	0.000025400	0.000027200	0.000025000	0.000022200	0.000022100	0.000029900	0.000035200	0.000019500	0.000026900	0.000026200	0.000030200	0.000031600	0.000022300	0.000040000	0.000038600	0.000025800	0.000000000	0.000000000	0.000020100
C16H19NO4	289.131471	1.188	0.250	0.06	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000066300	0.000054400	0.000094400	0.000089800	0.000081500	0.000072700	0.000081200	0.000062300	0.000058000	0.000047500	0.000053900	0.000062300	0.000050600	0.000080300	0.000090300	0.000094900	0.000090700	0.000067300	0.000071200	0.000085000	0.000089900	0.000115700	0.000106700	0.000073900	0.000070800	0.000082300	0.000073800	0.000080700	0.000081200	0.000059100	0.000055400	0.000081700	0.000063500	0.000045000	0.000046200
C17H23NO3	289.167801	1.353	0.176	0.06	0.0000	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000028100	0.000021700	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000019400	0.000018700	0.000000000	0.000032000	0.000029600	0.000000000	0.000000000	0.000029600	0.000020700	0.000000000	0.000021400	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000025400	0.000030200	0.000019500	0.000000000	0.000027500	0.000000000	0.000000000	0.000000000
C10H10O6S2	289.991873	1.000	0.600	0.00	0.2000	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026100	0.000000000	0.000027400	0.000030800	0.000018400	0.000018800	0.000030100	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000000000	0.000019400	0.000022300	0.000029100	0.000023300	0.000034200	0.000026500	0.000000000	0.000029100	0.000025000	0.000032900	0.000034500	0.000000000	0.000000000	0.000022000	0.000025600	0.000000000	0.000000000
C14H10O3S2	290.007222	0.714	0.214	0.00	0.1429	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000000000
C14H10O5S	290.024891	0.714	0.357	0.00	0.0714	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000087500	0.000042800	0.000050800	0.000086500	0.000062300	0.000061600	0.000047000	0.000045700	0.000039100	0.000038500	0.000036300	0.000025000	0.000039300	0.000044600	0.000041500	0.000075400	0.000068300	0.000038100	0.000038800	0.000052400	0.000056400	0.000062500	0.000051900	0.000054500	0.000073500	0.000046200	0.000043400	0.000098800	0.000093200	0.000000000	0.000000000	0.000088800	0.000090400	0.000024000	0.000022700
C11H14O5S2	290.028282	1.273	0.455	0.00	0.1818	0.0000	0.08	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000049100	0.000022800	0.000073600	0.000064700	0.000040300	0.000046300	0.000039400	0.000000000	0.000021600	0.000000000	0.000000000	0.000021300	0.000000000	0.000041200	0.000036800	0.000069100	0.000068300	0.000031700	0.000034400	0.000067800	0.000075100	0.000093300	0.000097200	0.000036200	0.000039200	0.000049000	0.000057800	0.000073400	0.000065300	0.000000000	0.000000000	0.000045900	0.000049300	0.000000000	0.000000000
C14H10O7	290.042674	0.714	0.500	0.00	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000208500	0.000141400	0.000131400	0.000115700	0.000112800	0.000127200	0.000129800	0.000145200	0.000172900	0.000153800	0.000154600	0.000134500	0.000177000	0.000083900	0.000066800	0.000084900	0.000091100	0.000119400	0.000107800	0.000163100	0.000163800	0.000081400	0.000074800	0.000170600	0.000182300	0.000122600	0.000131100	0.000136000	0.000139600	0.000202300	0.000194600	0.000197800	0.000206400	0.000345800	0.000321700
C11H14O7S	290.046018	1.273	0.636	0.00	0.0909	0.0000	0.08	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000093000	0.000053100	0.000079900	0.000098200	0.000072400	0.000092600	0.000081600	0.000061900	0.000067900	0.000065300	0.000047900	0.000056800	0.000064800	0.000073300	0.000052100	0.000090300	0.000095800	0.000095400	0.000080200	0.000081700	0.000085100	0.000091100	0.000088200	0.000085700	0.000095800	0.000097600	0.000077300	0.000125300	0.000122300	0.000071300	0.000061700	0.000097400	0.000106400	0.000048100	0.000050800
C13H10N2O6	290.053882	0.769	0.462	0.15	0.0000	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000040500	0.000000000	0.000029800	0.000023700	0.000029600	0.000028000	0.000029700	0.000025800	0.000034200	0.000029700	0.000000000	0.000023500	0.000018800	0.000022600	0.000026000	0.000021600	0.000027300	0.000018700	0.000024800	0.000021400	0.000023100	0.000020800	0.000026400	0.000038700	0.000030400	0.000024100	0.000031000	0.000032800	0.000036900	0.000036300	0.000041200	0.000048000	0.000036200	0.000038400	0.000041200
C18H10O4	290.057933	0.556	0.222	0.00	0.0000	0.0000	0.75	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000030800	0.000025800	0.000000000	0.000021300	0.000029400	0.000019500	0.000000000	0.000028900	0.000031500	0.000021500	0.000028600	0.000031100	0.000019900	0.000020300	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000025400	0.000019500	0.000019300	0.000000000	0.000038900	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000043600	0.000043800	0.000038600	0.000039300	0.000059300	0.000061900
C15H14O4S	290.061323	0.933	0.267	0.00	0.0667	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000086700	0.000047200	0.000099100	0.000137700	0.000078900	0.000081300	0.000082100	0.000048100	0.000035500	0.000026100	0.000033400	0.000038200	0.000038200	0.000079600	0.000064200	0.000134700	0.000124600	0.000060400	0.000054700	0.000078500	0.000088200	0.000120300	0.000112200	0.000057900	0.000067300	0.000074300	0.000080600	0.000110200	0.000122900	0.000000000	0.000000000	0.000097800	0.000083800	0.000024100	0.000000000
C11H14O9	290.063843	1.273	0.818	0.00	0.0000	0.0000	0.08	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000018700	0.000000000	0.000029000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029100	0.000000000	0.000000000	0.000025000	0.000020700	0.000064900	0.000042100	0.000000000	0.000000000	0.000043700	0.000045500
C12H18O4S2	290.064699	1.500	0.333	0.00	0.1667	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000024400	0.000000000	0.000040900	0.000041500	0.000022300	0.000031800	0.000031400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000051100	0.000042000	0.000000000	0.000026600	0.000041400	0.000039300	0.000053700	0.000054600	0.000018700	0.000000000	0.000022900	0.000029600	0.000044400	0.000042100	0.000000000	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000
C15H14O6	290.079022	0.933	0.400	0.00	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000706100	0.000628700	0.000666500	0.000637600	0.000640700	0.000647500	0.000636500	0.000632300	0.000632000	0.000612200	0.000604400	0.000613500	0.000643600	0.000612800	0.000574200	0.000613900	0.000598000	0.000641000	0.000614200	0.000669300	0.000677700	0.000640300	0.000639500	0.000662100	0.000702400	0.000634600	0.000622000	0.000690900	0.000672300	0.000601200	0.000591700	0.000690500	0.000765100	0.000742900	0.000751700
C12H18O6S	290.082399	1.500	0.500	0.00	0.0833	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000163700	0.000123800	0.000249100	0.000233200	0.000210300	0.000234800	0.000210500	0.000137400	0.000145500	0.000121800	0.000111600	0.000108300	0.000130800	0.000197300	0.000190600	0.000277000	0.000266100	0.000210800	0.000215700	0.000250100	0.000248500	0.000290500	0.000314300	0.000162000	0.000167500	0.000230000	0.000223900	0.000237800	0.000233000	0.000123500	0.000109000	0.000183400	0.000182800	0.000081500	0.000079800
C14H14N2O5	290.090321	1.000	0.357	0.14	0.0000	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000097800	0.000072800	0.000094100	0.000091100	0.000082100	0.000072600	0.000079400	0.000055500	0.000061000	0.000061500	0.000070000	0.000063800	0.000059400	0.000076000	0.000082800	0.000087700	0.000084200	0.000070400	0.000067700	0.000086400	0.000083900	0.000112700	0.000098700	0.000083200	0.000071700	0.000082200	0.000092800	0.000088600	0.000096400	0.000084700	0.000095000	0.000100000	0.000087300	0.000075900	0.000083400
C19H14O3	290.094340	0.737	0.158	0.00	0.0000	0.0000	0.66	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029800	0.000020300	0.000000000	0.000019100	0.000021000	0.000020900	0.000029100	0.000030200	0.000036100	0.000030800	0.000033900	0.000029300	0.000020000	0.000018700	0.000000000	0.000020100	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000030200	0.000034700	0.000018100	0.000027900	0.000020000	0.000024700	0.000026700	0.000027900	0.000040900	0.000034800	0.000044400	0.000040900
C16H18O3S	290.097695	1.125	0.188	0.00	0.0625	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027800	0.000020300	0.000036500	0.000039500	0.000027500	0.000030700	0.000035100	0.000025200	0.000025200	0.000020700	0.000033900	0.000019200	0.000000000	0.000034000	0.000040600	0.000047800	0.000039200	0.000021000	0.000031000	0.000031900	0.000035000	0.000047700	0.000044100	0.000024300	0.000032000	0.000030700	0.000027200	0.000044700	0.000040400	0.000019500	0.000000000	0.000027200	0.000025300	0.000000000	0.000000000
C12H18O8	290.100186	1.500	0.667	0.00	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000127800	0.000115800	0.000111700	0.000132200	0.000119000	0.000131000	0.000118100	0.000102800	0.000129800	0.000115400	0.000084600	0.000109800	0.000127700	0.000125900	0.000111200	0.000145200	0.000119800	0.000182300	0.000158800	0.000120900	0.000120500	0.000114500	0.000117400	0.000136600	0.000163400	0.000138600	0.000139000	0.000148300	0.000147600	0.000334100	0.000302900	0.000145000	0.000145200	0.000191900	0.000188500
C16H18O5	290.115455	1.125	0.312	0.00	0.0000	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000582800	0.000744300	0.000776300	0.000657500	0.000841300	0.000798300	0.000769600	0.000812800	0.000745100	0.000771100	0.000747100	0.000804200	0.000717400	0.000826400	0.000873300	0.000823900	0.000791500	0.000819900	0.000860800	0.000748100	0.000745600	0.000856800	0.000777600	0.000670600	0.000663600	0.000762400	0.000784600	0.000641100	0.000643900	0.000511100	0.000540400	0.000642800	0.000612300	0.000596500	0.000619900
C13H22O5S	290.118857	1.692	0.385	0.00	0.0769	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000038600	0.000031300	0.000077000	0.000063900	0.000069200	0.000069300	0.000071800	0.000030600	0.000034700	0.000028500	0.000033500	0.000034600	0.000028700	0.000048500	0.000062300	0.000077600	0.000073800	0.000058900	0.000057700	0.000077600	0.000074900	0.000081400	0.000104300	0.000038600	0.000037000	0.000061700	0.000068200	0.000049600	0.000059400	0.000032600	0.000026300	0.000049500	0.000041200	0.000000000	0.000024100
C15H18N2O4	290.126687	1.200	0.267	0.13	0.0000	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000072500	0.000056100	0.000067100	0.000086500	0.000078000	0.000075900	0.000076700	0.000065400	0.000052900	0.000050000	0.000045900	0.000053700	0.000051200	0.000078200	0.000077500	0.000090900	0.000094200	0.000075200	0.000078800	0.000070000	0.000077100	0.000099400	0.000083400	0.000063300	0.000080200	0.000078100	0.000083000	0.000087400	0.000080200	0.000076800	0.000089800	0.000084300	0.000080100	0.000055800	0.000065100
C20H18O2	290.130734	0.900	0.100	0.00	0.0000	0.0000	0.58	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000000000	0.000028900	0.000000000	0.000000000	0.000000000
C13H22O7	290.136533	1.692	0.538	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000069400	0.000078300	0.000094600	0.000104300	0.000097800	0.000096900	0.000091600	0.000076600	0.000080700	0.000069400	0.000072200	0.000085800	0.000071100	0.000092000	0.000104600	0.000136500	0.000134900	0.000116500	0.000128400	0.000105700	0.000085000	0.000106000	0.000111300	0.000086100	0.000081000	0.000109800	0.000125900	0.000097700	0.000099700	0.000149200	0.000149200	0.000085600	0.000092600	0.000099000	0.000096300
C17H22O4	290.151861	1.294	0.235	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000291700	0.000467000	0.000393700	0.000354100	0.000454600	0.000431700	0.000437800	0.000531500	0.000466700	0.000508000	0.000473200	0.000531200	0.000418400	0.000504000	0.000585600	0.000493900	0.000447300	0.000478700	0.000567600	0.000385800	0.000396300	0.000433400	0.000419500	0.000380400	0.000357100	0.000430400	0.000446200	0.000364600	0.000356200	0.000321900	0.000303300	0.000373600	0.000317400	0.000334500	0.000357900
C16H22N2O3	290.163019	1.375	0.188	0.13	0.0000	0.0000	0.28	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000021100	0.000021500	0.000021800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000019500	0.000000000	0.000025700	0.000021300	0.000000000	0.000000000	0.000000000
C18H26O3	290.188195	1.444	0.167	0.00	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000063500	0.000108400	0.000082200	0.000085000	0.000116100	0.000097900	0.000102000	0.000138900	0.000105600	0.000123000	0.000108600	0.000117000	0.000101000	0.000116800	0.000158200	0.000126400	0.000113500	0.000107800	0.000151400	0.000097100	0.000099700	0.000100500	0.000098800	0.000099100	0.000097700	0.000089600	0.000090100	0.000094200	0.000093400	0.000079000	0.000075900	0.000102100	0.000093300	0.000081500	0.000098600
C13H9NO5S	291.020114	0.692	0.385	0.08	0.0769	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000041400	0.000000000	0.000000000	0.000026200	0.000019100	0.000028300	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000021200	0.000026700	0.000019900	0.000027100	0.000027700	0.000023400	0.000026400	0.000030800	0.000036500	0.000000000	0.000000000	0.000035100	0.000034100	0.000019200	0.000000000
C13H9NO7	291.037969	0.692	0.538	0.08	0.0000	0.0000	0.65	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000030000	0.000019300	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000020800	0.000028900	0.000000000	0.000000000	0.000028100	0.000021000	0.000000000	0.000000000	0.000000000	0.000020900	0.000023200	0.000019900	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000025400	0.000028200	0.000022800	0.000022800	0.000000000	0.000036300	0.000024400	0.000023700	0.000028100	0.000039500	0.000044600
C17H9NO4	291.053138	0.529	0.235	0.06	0.0000	0.0000	0.79	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000019700	0.000000000	0.000021200	0.000000000
C14H13NO4S	291.056535	0.929	0.286	0.07	0.0714	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000056700	0.000022400	0.000047200	0.000073400	0.000041400	0.000045000	0.000033800	0.000018600	0.000019200	0.000025200	0.000021400	0.000000000	0.000026400	0.000042000	0.000029800	0.000062200	0.000059300	0.000029800	0.000027700	0.000040000	0.000041700	0.000057700	0.000062900	0.000043200	0.000042700	0.000038100	0.000041500	0.000068300	0.000070100	0.000000000	0.000019600	0.000060100	0.000058100	0.000000000	0.000024600
C14H13NO6	291.074292	0.929	0.429	0.07	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000186300	0.000102900	0.000147100	0.000170600	0.000124600	0.000133900	0.000142100	0.000112800	0.000113000	0.000110500	0.000101200	0.000106100	0.000118000	0.000130500	0.000125500	0.000145900	0.000157000	0.000132300	0.000124700	0.000136600	0.000144200	0.000164700	0.000163200	0.000139900	0.000154300	0.000136100	0.000147700	0.000175200	0.000174800	0.000129300	0.000129400	0.000175100	0.000202600	0.000130800	0.000146000
C11H17NO6S	291.077647	1.545	0.545	0.09	0.0909	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	0	0	0	0	0	0.000021800	0.000000000	0.000049300	0.000024700	0.000024500	0.000022600	0.000026100	0.000000000	0.000017900	0.000000000	0.000000000	0.000000000	0.000019100	0.000022800	0.000026500	0.000030700	0.000033100	0.000022200	0.000018100	0.000036400	0.000036600	0.000047800	0.000041200	0.000020900	0.000000000	0.000028600	0.000022100	0.000028100	0.000034400	0.000000000	0.000000000	0.000026900	0.000022500	0.000000000	0.000000000
C13H13N3O5	291.085437	1.000	0.385	0.23	0.0000	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000000000	0.000020000	0.000023400	0.000021800	0.000000000	0.000018900
C18H13NO3	291.089583	0.722	0.167	0.06	0.0000	0.0000	0.68	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000
C15H17NO3S	291.092984	1.133	0.200	0.07	0.0667	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022500	0.000000000	0.000025600	0.000029900	0.000025600	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000019300	0.000027200	0.000024600	0.000000000	0.000000000	0.000019700	0.000022900	0.000032500	0.000027900	0.000000000	0.000020700	0.000000000	0.000000000	0.000036600	0.000019900	0.000000000	0.000000000	0.000028300	0.000022400	0.000000000	0.000000000
C15H17NO5	291.110658	1.133	0.333	0.07	0.0000	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000217800	0.000151900	0.000256100	0.000246200	0.000233400	0.000208500	0.000220800	0.000163300	0.000145300	0.000135700	0.000131900	0.000155200	0.000139200	0.000210500	0.000239000	0.000253700	0.000246900	0.000191900	0.000204400	0.000219600	0.000228400	0.000311500	0.000311100	0.000181700	0.000181800	0.000222300	0.000226200	0.000245900	0.000255400	0.000172900	0.000173800	0.000220600	0.000233400	0.000150900	0.000152500
C14H17N3O4	291.121963	1.214	0.286	0.21	0.0000	0.0000	0.33	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H21NO4	291.147106	1.312	0.250	0.06	0.0000	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000051800	0.000046100	0.000078200	0.000054900	0.000062700	0.000063400	0.000063100	0.000052000	0.000048800	0.000039900	0.000040400	0.000055600	0.000048000	0.000075500	0.000083300	0.000073400	0.000076500	0.000071200	0.000079500	0.000058800	0.000063800	0.000096100	0.000091300	0.000051300	0.000050200	0.000066100	0.000065300	0.000068100	0.000068700	0.000057100	0.000043700	0.000050600	0.000044800	0.000040300	0.000046400
C13H8O6S	292.004126	0.615	0.462	0.00	0.0769	0.0000	0.67	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000031700	0.000000000	0.000000000	0.000032800	0.000021200	0.000019000	0.000021400	0.000000000	0.000024500	0.000000000	0.000019700	0.000000000	0.000020800	0.000000000	0.000021000	0.000022100	0.000021600	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000018300	0.000031900	0.000032900	0.000020200	0.000000000	0.000034000	0.000034900	0.000000000	0.000000000	0.000040300	0.000039000	0.000019400	0.000000000
C10H12O6S2	292.007526	1.200	0.600	0.00	0.2000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000045500	0.000000000	0.000059500	0.000059300	0.000028500	0.000044600	0.000031700	0.000000000	0.000027500	0.000000000	0.000000000	0.000000000	0.000023500	0.000032700	0.000026300	0.000050200	0.000057700	0.000036800	0.000027300	0.000062000	0.000057600	0.000071500	0.000074900	0.000000000	0.000033200	0.000041200	0.000046700	0.000056500	0.000062000	0.000000000	0.000000000	0.000049400	0.000046300	0.000000000	0.000000000
C13H8O8	292.021973	0.615	0.615	0.00	0.0000	0.0000	0.67	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034400	0.000023100	0.000028500	0.000018300	0.000021300	0.000027400	0.000022800	0.000029600	0.000041400	0.000026100	0.000036100	0.000034500	0.000036700	0.000000000	0.000000000	0.000000000	0.000019100	0.000020900	0.000000000	0.000033400	0.000038800	0.000000000	0.000000000	0.000033100	0.000031200	0.000000000	0.000000000	0.000027100	0.000000000	0.000059500	0.000041200	0.000033100	0.000037300	0.000130600	0.000111900
C14H12O3S2	292.022830	0.857	0.214	0.00	0.1429	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000021900	0.000043000	0.000019900	0.000023700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000024200	0.000021600	0.000032300	0.000000000	0.000000000	0.000024200	0.000018300	0.000035800	0.000038200	0.000019200	0.000021800	0.000000000	0.000031200	0.000037800	0.000032600	0.000000000	0.000000000	0.000032500	0.000034500	0.000000000	0.000000000
C10H12O8S	292.025319	1.200	0.800	0.00	0.1000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000020000	0.000000000	0.000000000	0.000025200	0.000018300	0.000000000	0.000000000	0.000021800	0.000022000
C17H8O5	292.037164	0.471	0.294	0.00	0.0000	0.0000	0.79	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000031100	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000025000	0.000000000	0.000019100	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000000000	0.000024800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000044400	0.000030700	0.000019400	0.000030100	0.000064600	0.000060200
C14H12O5S	292.040571	0.857	0.357	0.00	0.0714	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000135500	0.000047700	0.000123300	0.000171800	0.000099100	0.000107700	0.000105000	0.000055600	0.000066900	0.000045900	0.000052900	0.000051300	0.000051100	0.000122300	0.000100100	0.000142600	0.000156100	0.000084500	0.000077800	0.000116400	0.000105700	0.000175900	0.000191100	0.000092500	0.000102600	0.000096300	0.000101300	0.000166500	0.000165400	0.000019600	0.000019600	0.000138300	0.000136300	0.000028900	0.000036300
C11H16O5S2	292.043972	1.455	0.455	0.00	0.1818	0.0000	0.00	4	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035400	0.000000000	0.000070700	0.000058200	0.000035400	0.000038100	0.000037100	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000031600	0.000029200	0.000059100	0.000054900	0.000020300	0.000030900	0.000064400	0.000064300	0.000085100	0.000093000	0.000030000	0.000032900	0.000042500	0.000056900	0.000053400	0.000050700	0.000000000	0.000000000	0.000036100	0.000030500	0.000000000	0.000000000
C14H12O7	292.058295	0.857	0.500	0.00	0.0000	0.0000	0.52	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000495300	0.000362100	0.000328100	0.000340100	0.000326400	0.000358000	0.000339600	0.000369900	0.000405200	0.000405900	0.000382800	0.000357200	0.000423000	0.000291900	0.000232600	0.000278000	0.000299200	0.000376400	0.000324800	0.000398800	0.000381900	0.000264000	0.000280100	0.000428000	0.000480100	0.000371800	0.000352600	0.000412300	0.000401100	0.000480400	0.000482200	0.000472900	0.000527400	0.000652300	0.000634300
C11H16O7S	292.061657	1.455	0.636	0.00	0.0909	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000107600	0.000080500	0.000113500	0.000126100	0.000128300	0.000127800	0.000115400	0.000081500	0.000099500	0.000076600	0.000077600	0.000072800	0.000096900	0.000108800	0.000078800	0.000132400	0.000139500	0.000123500	0.000114300	0.000114600	0.000117500	0.000128800	0.000133700	0.000096100	0.000118800	0.000136600	0.000131000	0.000144700	0.000131600	0.000123000	0.000107300	0.000104900	0.000114600	0.000069600	0.000071700
C13H12N2O6	292.069562	0.923	0.462	0.15	0.0000	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000056900	0.000027900	0.000037000	0.000051600	0.000038100	0.000050700	0.000046500	0.000043100	0.000050000	0.000034900	0.000046900	0.000045300	0.000043700	0.000047400	0.000031400	0.000045300	0.000048500	0.000045400	0.000046700	0.000043300	0.000044200	0.000039300	0.000050300	0.000055800	0.000058200	0.000042600	0.000046200	0.000054100	0.000065500	0.000064500	0.000060700	0.000064100	0.000056100	0.000063400	0.000047600
C18H12O4	292.073615	0.667	0.222	0.00	0.0000	0.0000	0.69	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000052700	0.000048800	0.000030200	0.000041700	0.000039600	0.000033500	0.000039900	0.000047600	0.000050700	0.000046600	0.000056200	0.000054900	0.000042300	0.000034000	0.000032800	0.000026100	0.000024600	0.000034500	0.000022100	0.000041100	0.000056400	0.000028600	0.000027700	0.000057900	0.000063300	0.000040900	0.000030800	0.000045300	0.000046600	0.000062900	0.000075000	0.000060300	0.000063400	0.000091700	0.000096900
C15H16O4S	292.076987	1.067	0.267	0.00	0.0667	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000085100	0.000048000	0.000112500	0.000113900	0.000097800	0.000086300	0.000089900	0.000053400	0.000047200	0.000043300	0.000045400	0.000051400	0.000044100	0.000083600	0.000084200	0.000131100	0.000125100	0.000071900	0.000068100	0.000085000	0.000098800	0.000140700	0.000136200	0.000071400	0.000072700	0.000089900	0.000090000	0.000107600	0.000112900	0.000021300	0.000000000	0.000090600	0.000083600	0.000023800	0.000019600
C11H16O9	292.079486	1.455	0.818	0.00	0.0000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028900	0.000018900	0.000000000	0.000000000	0.000022000	0.000000000
C12H20O4S2	292.080332	1.667	0.333	0.00	0.1667	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H16O6	292.094683	1.067	0.400	0.00	0.0000	0.0000	0.42	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001094800	0.001196600	0.001254300	0.001122400	0.001233700	0.001247100	0.001205900	0.001242400	0.001190300	0.001228200	0.001163000	0.001177500	0.001149400	0.001200900	0.001217000	0.001228900	0.001176900	0.001255800	0.001274300	0.001217900	0.001181300	0.001235800	0.001240200	0.001132600	0.001116300	0.001226800	0.001203300	0.001124300	0.001153300	0.000991100	0.001031500	0.001114200	0.001136100	0.001107000	0.001152600
C12H20O6S	292.098074	1.667	0.500	0.00	0.0833	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000077700	0.000075400	0.000149600	0.000106900	0.000125100	0.000128600	0.000140600	0.000069100	0.000085400	0.000070800	0.000059100	0.000080300	0.000062400	0.000105000	0.000107900	0.000152800	0.000154500	0.000120800	0.000133200	0.000133000	0.000134600	0.000168900	0.000173600	0.000092900	0.000081100	0.000123100	0.000130100	0.000107400	0.000102000	0.000085300	0.000087900	0.000079200	0.000072300	0.000052300	0.000054700
C14H16N2O5	292.105984	1.143	0.357	0.14	0.0000	0.0000	0.37	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000110500	0.000081200	0.000097700	0.000109300	0.000081300	0.000087100	0.000090100	0.000073700	0.000081200	0.000070200	0.000069500	0.000083000	0.000076100	0.000087700	0.000088200	0.000105700	0.000116600	0.000095500	0.000091300	0.000089200	0.000087300	0.000110300	0.000115900	0.000099800	0.000097500	0.000110900	0.000111100	0.000097800	0.000109200	0.000133000	0.000126400	0.000109900	0.000103000	0.000097800	0.000097000
C19H16O3	292.109983	0.842	0.158	0.00	0.0000	0.0000	0.60	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000035000	0.000035900	0.000031600	0.000050200	0.000029600	0.000031400	0.000036200	0.000046500	0.000047700	0.000045800	0.000033700	0.000036900	0.000040600	0.000031800	0.000043700	0.000030100	0.000044500	0.000037400	0.000035100	0.000034700	0.000038100	0.000021600	0.000028400	0.000063300	0.000060800	0.000028000	0.000028400	0.000044100	0.000051500	0.000030800	0.000038800	0.000050200	0.000045800	0.000045300	0.000041400
C16H20O3S	292.113323	1.250	0.188	0.00	0.0625	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000026700	0.000030500	0.000038700	0.000041900	0.000035200	0.000035900	0.000035700	0.000028300	0.000028400	0.000031600	0.000027500	0.000045200	0.000023200	0.000000000	0.000048100	0.000045200	0.000048100	0.000034800	0.000042500	0.000037100	0.000040700	0.000047700	0.000041300	0.000020200	0.000031700	0.000034100	0.000023500	0.000036100	0.000040600	0.000000000	0.000000000	0.000037400	0.000033600	0.000000000	0.000000000
C12H20O8	292.115815	1.667	0.667	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000026400	0.000024300	0.000018600	0.000000000	0.000027200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000000000	0.000000000	0.000020100	0.000023600	0.000020400	0.000025800	0.000000000	0.000018200	0.000023900	0.000025500	0.000022300	0.000024400	0.000021800	0.000020000	0.000022300	0.000020200	0.000037800	0.000039800	0.000000000	0.000000000	0.000020200	0.000027000
C16H20O5	292.131127	1.250	0.312	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000716500	0.001094200	0.001064200	0.000924100	0.001170500	0.001128700	0.001093000	0.001221300	0.001101700	0.001162500	0.001052700	0.001180000	0.001024700	0.001237900	0.001394600	0.001225400	0.001164000	0.001182000	0.001345000	0.000989200	0.001003600	0.001125200	0.001074400	0.000933000	0.000895100	0.001103200	0.001101700	0.000876400	0.000914800	0.000840100	0.000820000	0.000909900	0.000767400	0.000778800	0.000864700
C13H24O5S	292.134503	1.846	0.385	0.00	0.0769	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000032200	0.000000000	0.000000000	0.000025800	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000000000	0.000028600	0.000024200	0.000019600	0.000022000	0.000027900	0.000024600	0.000033300	0.000038400	0.000000000	0.000000000	0.000020300	0.000033400	0.000000000	0.000000000	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000
C15H20N2O4	292.142320	1.333	0.267	0.13	0.0000	0.0000	0.27	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000056800	0.000037600	0.000064600	0.000069800	0.000060400	0.000053400	0.000063800	0.000037200	0.000039500	0.000035700	0.000031600	0.000050000	0.000039400	0.000067000	0.000082500	0.000068000	0.000072100	0.000052800	0.000059100	0.000063300	0.000068900	0.000087100	0.000076400	0.000062000	0.000055500	0.000066400	0.000066700	0.000061900	0.000069400	0.000079000	0.000059900	0.000067600	0.000059000	0.000038200	0.000045100
C20H20O2	292.146319	1.000	0.100	0.00	0.0000	0.0000	0.53	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000
C17H24O4	292.167500	1.412	0.235	0.00	0.0000	0.0000	0.27	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000248300	0.000390400	0.000360600	0.000345900	0.000415700	0.000392800	0.000405200	0.000468100	0.000397200	0.000411900	0.000390300	0.000454500	0.000344000	0.000473800	0.000579600	0.000467900	0.000447700	0.000446000	0.000525800	0.000336300	0.000355800	0.000418400	0.000383300	0.000348900	0.000322400	0.000369000	0.000390900	0.000344700	0.000342000	0.000292800	0.000285900	0.000336100	0.000289700	0.000282700	0.000316100
C18H28O3	292.203834	1.556	0.167	0.00	0.0000	0.0000	0.21	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000038800	0.000050300	0.000059300	0.000054000	0.000064100	0.000078200	0.000075100	0.000080900	0.000053400	0.000060300	0.000064100	0.000055200	0.000052600	0.000068200	0.000123300	0.000073100	0.000072300	0.000068000	0.000106500	0.000076700	0.000079800	0.000103400	0.000096000	0.000056900	0.000053400	0.000077400	0.000091600	0.000066200	0.000061700	0.000070400	0.000077100	0.000077400	0.000057400	0.000046100	0.000067200
C13H11NO5S	293.035835	0.846	0.385	0.08	0.0769	0.0000	0.53	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000046600	0.000019600	0.000033400	0.000056300	0.000027700	0.000036300	0.000026600	0.000000000	0.000020200	0.000021400	0.000000000	0.000000000	0.000025200	0.000040700	0.000029100	0.000036500	0.000053300	0.000020700	0.000027100	0.000029700	0.000038300	0.000037000	0.000051500	0.000033600	0.000034700	0.000032400	0.000029000	0.000054900	0.000054700	0.000000000	0.000020900	0.000056600	0.000043600	0.000025300	0.000000000
C13H11NO7	293.053538	0.846	0.538	0.08	0.0000	0.0000	0.53	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000073400	0.000058100	0.000032400	0.000047000	0.000050000	0.000065200	0.000045500	0.000049200	0.000054300	0.000050800	0.000047500	0.000046700	0.000063600	0.000049900	0.000033600	0.000050200	0.000039400	0.000055800	0.000046700	0.000057700	0.000051100	0.000046200	0.000055700	0.000075200	0.000080900	0.000062300	0.000062000	0.000080800	0.000077900	0.000095700	0.000086900	0.000074600	0.000094700	0.000091600	0.000088100
C17H11NO4	293.068877	0.647	0.235	0.06	0.0000	0.0000	0.71	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000030200	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000024900	0.000000000	0.000000000	0.000019400	0.000000000	0.000027100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000020500	0.000000000	0.000000000	0.000019400	0.000029800	0.000019300	0.000000000	0.000023700	0.000018500	0.000000000	0.000031000	0.000027400	0.000035200	0.000029900	0.000023600
C14H15NO4S	293.072226	1.071	0.286	0.07	0.0714	0.0000	0.40	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000055400	0.000021200	0.000063900	0.000088600	0.000043000	0.000039200	0.000050900	0.000022700	0.000029500	0.000000000	0.000019700	0.000020300	0.000000000	0.000041600	0.000045100	0.000074800	0.000066900	0.000034100	0.000039500	0.000049000	0.000043900	0.000087100	0.000073100	0.000037000	0.000029400	0.000047400	0.000043800	0.000058200	0.000075100	0.000000000	0.000000000	0.000059400	0.000048500	0.000000000	0.000000000
C14H15NO6	293.089948	1.071	0.429	0.07	0.0000	0.0000	0.40	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000243800	0.000159300	0.000230000	0.000255600	0.000210000	0.000218300	0.000217100	0.000166000	0.000172200	0.000161000	0.000146800	0.000163700	0.000174100	0.000220100	0.000196600	0.000245700	0.000247500	0.000207200	0.000218400	0.000212600	0.000220500	0.000263900	0.000283700	0.000218100	0.000217300	0.000229800	0.000226600	0.000256600	0.000266700	0.000216300	0.000214800	0.000247100	0.000252100	0.000185200	0.000185700
C13H15N3O5	293.101187	1.154	0.385	0.23	0.0000	0.0000	0.33	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020400	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000023100	0.000018400	0.000000000	0.000019600	0.000000000	0.000026500	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000
C18H15NO3	293.105228	0.833	0.167	0.06	0.0000	0.0000	0.61	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020700	0.000000000	0.000020500	0.000020500	0.000019700	0.000030300	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000028400	0.000028100	0.000027200	0.000000000	0.000000000	0.000000000	0.000018600	0.000023400	0.000023100	0.000018800	0.000000000	0.000000000	0.000021600	0.000027400	0.000023100	0.000000000	0.000000000	0.000029400	0.000018800	0.000000000	0.000000000
C15H19NO3S	293.108573	1.267	0.200	0.07	0.0667	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000029500	0.000022800	0.000018800	0.000021900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000034400	0.000031200	0.000000000	0.000022100	0.000021600	0.000023200	0.000029900	0.000031700	0.000000000	0.000020700	0.000026600	0.000031400	0.000035600	0.000034500	0.000000000	0.000000000	0.000025200	0.000024100	0.000000000	0.000000000
C15H19NO5	293.126381	1.267	0.333	0.07	0.0000	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000143300	0.000125400	0.000169300	0.000162000	0.000160200	0.000160200	0.000154100	0.000122400	0.000108400	0.000097900	0.000104000	0.000122400	0.000100900	0.000170200	0.000186300	0.000187800	0.000202100	0.000141500	0.000160500	0.000159200	0.000169700	0.000224600	0.000214500	0.000128600	0.000130900	0.000173400	0.000170200	0.000149800	0.000157700	0.000136900	0.000143100	0.000160800	0.000138600	0.000103800	0.000115900
C16H23NO4	293.162747	1.438	0.250	0.06	0.0000	0.0000	0.23	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024700	0.000023800	0.000054000	0.000032900	0.000045300	0.000044000	0.000038000	0.000029200	0.000000000	0.000019600	0.000000000	0.000025200	0.000021600	0.000042400	0.000054800	0.000043700	0.000045900	0.000039300	0.000037100	0.000047600	0.000044900	0.000064500	0.000054900	0.000026100	0.000040400	0.000044600	0.000041200	0.000034700	0.000035300	0.000025300	0.000031900	0.000037000	0.000039100	0.000019400	0.000028500
C13H10O4S2	294.002060	0.769	0.308	0.00	0.1538	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000023600	0.000000000	0.000000000	0.000030400	0.000000000	0.000000000	0.000022200	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000026200	0.000023200	0.000000000	0.000000000	0.000000000	0.000021300	0.000024600	0.000020800	0.000020400	0.000000000	0.000000000	0.000000000	0.000035300	0.000030800	0.000000000	0.000000000	0.000034100	0.000031700	0.000000000	0.000000000
C13H10O6S	294.019833	0.769	0.462	0.00	0.0769	0.0000	0.56	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000074000	0.000030800	0.000043100	0.000069100	0.000050500	0.000047000	0.000051600	0.000033000	0.000044700	0.000032500	0.000031400	0.000030600	0.000044700	0.000046900	0.000032000	0.000061700	0.000048700	0.000044800	0.000033900	0.000051700	0.000059600	0.000054200	0.000057400	0.000056900	0.000060700	0.000042000	0.000047800	0.000096600	0.000085100	0.000000000	0.000000000	0.000079800	0.000082000	0.000024900	0.000022800
C10H14O6S2	294.023167	1.400	0.600	0.00	0.2000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000043900	0.000000000	0.000069900	0.000059100	0.000038400	0.000043500	0.000049800	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000000000	0.000030500	0.000034700	0.000059600	0.000066700	0.000037500	0.000031100	0.000065600	0.000066000	0.000085400	0.000096600	0.000025900	0.000030400	0.000052600	0.000042400	0.000059900	0.000065300	0.000000000	0.000000000	0.000046700	0.000049300	0.000000000	0.000000000
C13H10O8	294.037616	0.769	0.615	0.00	0.0000	0.0000	0.56	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000104800	0.000076500	0.000060000	0.000051500	0.000063000	0.000071500	0.000063500	0.000082000	0.000098900	0.000084100	0.000089000	0.000072100	0.000102100	0.000047100	0.000022600	0.000026500	0.000048000	0.000065600	0.000048400	0.000082400	0.000081900	0.000034200	0.000034000	0.000094800	0.000103700	0.000065000	0.000066600	0.000060000	0.000069400	0.000166500	0.000136200	0.000087100	0.000094300	0.000252300	0.000240700
C14H14O3S2	294.038483	1.000	0.214	0.00	0.1429	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027800	0.000000000	0.000026600	0.000033700	0.000024700	0.000018700	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028500	0.000039600	0.000037600	0.000000000	0.000000000	0.000024200	0.000027200	0.000035800	0.000040300	0.000000000	0.000020900	0.000021800	0.000020500	0.000036200	0.000038100	0.000000000	0.000000000	0.000026200	0.000031600	0.000000000	0.000000000
C10H14O8S	294.040993	1.400	0.800	0.00	0.1000	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000024300	0.000000000	0.000021600	0.000000000	0.000000000	0.000029900	0.000025500	0.000000000	0.000000000	0.000000000	0.000000000
C12H10N2O7	294.048808	0.833	0.583	0.17	0.0000	0.0000	0.54	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020800	0.000000000	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000029600	0.000021200	0.000027500	0.000000000	0.000000000	0.000000000
C17H10O5	294.052815	0.588	0.294	0.00	0.0000	0.0000	0.72	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000090100	0.000054800	0.000044600	0.000053500	0.000049000	0.000044200	0.000057800	0.000078000	0.000083300	0.000076200	0.000074100	0.000061600	0.000067300	0.000047400	0.000030700	0.000036800	0.000032000	0.000040300	0.000033000	0.000078900	0.000076500	0.000036800	0.000028600	0.000063600	0.000082200	0.000048600	0.000026500	0.000060400	0.000058500	0.000088700	0.000075900	0.000099100	0.000112000	0.000156800	0.000156200
C14H14O5S	294.056174	1.000	0.357	0.00	0.0714	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000246600	0.000075500	0.000285600	0.000310800	0.000204600	0.000201800	0.000198100	0.000106500	0.000109000	0.000072100	0.000078800	0.000085800	0.000086500	0.000191100	0.000187700	0.000302200	0.000290100	0.000156200	0.000157000	0.000257700	0.000243500	0.000347300	0.000359000	0.000151900	0.000151300	0.000207400	0.000199000	0.000306100	0.000303800	0.000041900	0.000039900	0.000250200	0.000253500	0.000044800	0.000042500
C11H18O5S2	294.059555	1.636	0.455	0.00	0.1818	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000020300	0.000000000	0.000042300	0.000039600	0.000027500	0.000023500	0.000020700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000020500	0.000035700	0.000035400	0.000000000	0.000000000	0.000035500	0.000032200	0.000045400	0.000046100	0.000018100	0.000000000	0.000028500	0.000021400	0.000028900	0.000030900	0.000000000	0.000000000	0.000020200	0.000020900	0.000000000	0.000000000
C16H10N2O4	294.064067	0.625	0.250	0.13	0.0000	0.0000	0.75	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000019700
C14H14O7	294.074006	1.000	0.500	0.00	0.0000	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000695800	0.000671800	0.000596900	0.000617400	0.000593100	0.000659200	0.000629600	0.000621100	0.000717200	0.000702600	0.000666100	0.000652000	0.000727500	0.000613200	0.000522800	0.000567400	0.000575800	0.000696700	0.000645500	0.000642600	0.000632700	0.000534100	0.000543400	0.000707400	0.000753600	0.000682900	0.000666600	0.000664100	0.000669700	0.000796000	0.000756700	0.000710700	0.000681100	0.000792700	0.000785400
C11H18O7S	294.077354	1.636	0.636	0.00	0.0909	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000069200	0.000074300	0.000091500	0.000083400	0.000097500	0.000097600	0.000092900	0.000050800	0.000063100	0.000053700	0.000046300	0.000056400	0.000065800	0.000087200	0.000076200	0.000110100	0.000116000	0.000098600	0.000088000	0.000084700	0.000089200	0.000093700	0.000105900	0.000056800	0.000086500	0.000097600	0.000103700	0.000091800	0.000086500	0.000112800	0.000110200	0.000062200	0.000058000	0.000064800	0.000069300
C13H14N2O6	294.085174	1.077	0.462	0.15	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000114200	0.000079000	0.000086800	0.000096200	0.000077600	0.000083200	0.000088200	0.000068200	0.000080400	0.000076000	0.000061800	0.000068500	0.000073100	0.000092800	0.000071500	0.000099600	0.000098200	0.000091200	0.000086300	0.000081700	0.000088300	0.000112300	0.000102700	0.000096600	0.000099800	0.000096400	0.000089900	0.000109800	0.000114500	0.000145500	0.000135100	0.000110000	0.000118200	0.000098600	0.000106600
C18H14O4	294.089199	0.778	0.222	0.00	0.0000	0.0000	0.62	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000111000	0.000079100	0.000073500	0.000101600	0.000082600	0.000082800	0.000088900	0.000100000	0.000103100	0.000093000	0.000080600	0.000077300	0.000084800	0.000076800	0.000085600	0.000081300	0.000083100	0.000079500	0.000078900	0.000080600	0.000091300	0.000077500	0.000063400	0.000103600	0.000115500	0.000058200	0.000070500	0.000114500	0.000105200	0.000094400	0.000088700	0.000120300	0.000128600	0.000134000	0.000124900
C15H18O4S	294.092593	1.200	0.267	0.00	0.0667	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000087200	0.000064100	0.000139100	0.000132300	0.000101000	0.000097100	0.000099300	0.000073200	0.000066300	0.000059600	0.000054200	0.000062300	0.000000000	0.000089200	0.000101300	0.000134600	0.000134600	0.000086400	0.000094900	0.000114700	0.000115800	0.000172700	0.000149200	0.000073500	0.000081200	0.000100500	0.000107600	0.000121000	0.000119600	0.000025000	0.000031100	0.000103600	0.000088800	0.000027200	0.000026400
C17H14N2O3	294.100523	0.824	0.176	0.12	0.0000	0.0000	0.63	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000021400	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000
C15H18O6	294.110351	1.200	0.400	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001900600	0.002316900	0.002286700	0.002090400	0.002463500	0.002429800	0.002277200	0.002601500	0.002341300	0.002483500	0.002261500	0.002398800	0.002170100	0.002575900	0.002698500	0.002608800	0.002376900	0.002615000	0.002782800	0.002291400	0.002184500	0.002313500	0.002301700	0.002087600	0.002092200	0.002387200	0.002308700	0.002233800	0.002215700	0.002067700	0.002028800	0.002064100	0.002102100	0.001935800	0.002141800
C12H22O6S	294.113692	1.833	0.500	0.00	0.0833	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000042000	0.000033200	0.000067800	0.000056100	0.000042200	0.000053000	0.000048200	0.000036700	0.000027500	0.000023200	0.000029300	0.000036500	0.000037600	0.000043700	0.000047100	0.000064900	0.000060700	0.000047700	0.000044500	0.000062600	0.000059400	0.000065100	0.000065900	0.000041800	0.000031700	0.000057100	0.000056600	0.000042400	0.000047700	0.000047700	0.000044800	0.000035400	0.000045500	0.000027100	0.000033000
C14H18N2O5	294.121576	1.286	0.357	0.14	0.0000	0.0000	0.26	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000116700	0.000090400	0.000120200	0.000128200	0.000098300	0.000103100	0.000101500	0.000084400	0.000086500	0.000065400	0.000066900	0.000087600	0.000078500	0.000118100	0.000119500	0.000140200	0.000144300	0.000121900	0.000118200	0.000116700	0.000120800	0.000150200	0.000155100	0.000104400	0.000116400	0.000123500	0.000127500	0.000124500	0.000127300	0.000149700	0.000145000	0.000126700	0.000124000	0.000097000	0.000102200
C19H18O3	294.125633	0.947	0.158	0.00	0.0000	0.0000	0.54	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000044300	0.000045400	0.000044500	0.000064800	0.000047700	0.000043700	0.000045400	0.000051300	0.000041400	0.000047700	0.000042400	0.000049700	0.000043500	0.000052100	0.000045700	0.000064000	0.000065800	0.000045900	0.000049200	0.000045000	0.000032000	0.000036200	0.000038600	0.000062300	0.000067500	0.000043300	0.000037700	0.000059100	0.000058600	0.000038400	0.000035600	0.000058900	0.000056300	0.000042400	0.000041600
C16H22O3S	294.129030	1.375	0.188	0.00	0.0625	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000020300	0.000025000	0.000038800	0.000029800	0.000025200	0.000032800	0.000018500	0.000000000	0.000000000	0.000000000	0.000030600	0.000000000	0.000030200	0.000029900	0.000042400	0.000037400	0.000025600	0.000033600	0.000021500	0.000021300	0.000029800	0.000025900	0.000000000	0.000026600	0.000031100	0.000030900	0.000032800	0.000027700	0.000000000	0.000000000	0.000027000	0.000021700	0.000000000	0.000000000
C16H22O5	294.146709	1.375	0.312	0.00	0.0000	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001040000	0.001412400	0.001575700	0.001306400	0.001739900	0.001668400	0.001573300	0.001734200	0.001426300	0.001452100	0.001307200	0.001526800	0.001275400	0.001784600	0.002106200	0.001901100	0.001722400	0.001757200	0.002007500	0.001535500	0.001450300	0.001780800	0.001723000	0.001290500	0.001264300	0.001545000	0.001518800	0.001385800	0.001393800	0.001237800	0.001209200	0.001257800	0.001227100	0.001081200	0.001232500
C15H22N2O4	294.158019	1.467	0.267	0.13	0.0000	0.0000	0.18	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022500	0.000000000	0.000031000	0.000029200	0.000023400	0.000034400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000026300	0.000037100	0.000029500	0.000000000	0.000027100	0.000021500	0.000019600	0.000035400	0.000030500	0.000000000	0.000018200	0.000024100	0.000028600	0.000000000	0.000025000	0.000019600	0.000000000	0.000000000	0.000020000	0.000000000	0.000000000
C17H26O4	294.183130	1.529	0.235	0.00	0.0000	0.0000	0.20	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000133000	0.000191900	0.000222800	0.000187600	0.000300600	0.000478500	0.000397900	0.000298900	0.000254600	0.000223600	0.000199000	0.000238900	0.000198800	0.000520300	0.000539800	0.000423200	0.000375600	0.000579400	0.000669700	0.000447100	0.000441300	0.000572700	0.000603000	0.000245400	0.000239600	0.000358000	0.000387200	0.000318600	0.000300700	0.000481600	0.000304800	0.000277100	0.000230200	0.000170500	0.000226200
C14H30O4S	294.186523	2.143	0.286	0.00	0.0714	0.0000	0.00	0	0	0	0	0	0	0	0	0	0	0	1	1	1	0	0	0	0	0	0	0.000244600	0.000221000	0.000303300	0.000284900	0.000268600	0.000419000	0.000335500	0.000074100	0.000271200	0.000185500	0.000111500	0.000183100	0.000268300	0.000564100	0.000107300	0.000399000	0.000203700	0.000272500	0.000448300	0.000143800	0.000332200	0.000483200	0.000180700	0.000266500	0.000206300	0.000386700	0.000352600	0.000402900	0.000127900	0.000172000	0.000146900	0.000119500	0.000089200	0.000232600	0.000138900
C18H30O3	294.219540	1.667	0.167	0.00	0.0000	0.0000	0.15	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H9NO6S	295.015055	0.750	0.500	0.08	0.0833	0.0000	0.57	9	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020500	0.000000000	0.000000000	0.000000000	0.000020600	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025300	0.000023000	0.000026900	0.000021500	0.000021100	0.000025800	0.000022900	0.000000000	0.000000000	0.000025000	0.000023300	0.000000000	0.000000000
C12H9NO8	295.032838	0.750	0.667	0.08	0.0000	0.0000	0.57	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026000	0.000000000	0.000000000	0.000000000	0.000022600	0.000018700
C16H9NO5	295.048097	0.562	0.312	0.06	0.0000	0.0000	0.76	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000021000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000018400	0.000019200	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000021400	0.000000000	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000028500	0.000027200	0.000024200	0.000035500	0.000030300
C13H13NO5S	295.051493	1.000	0.385	0.08	0.0769	0.0000	0.41	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000071900	0.000023800	0.000073400	0.000093800	0.000044300	0.000047600	0.000057300	0.000028700	0.000024300	0.000026400	0.000020800	0.000021300	0.000000000	0.000048500	0.000046800	0.000067300	0.000084000	0.000040000	0.000038300	0.000057900	0.000067700	0.000092200	0.000089900	0.000044000	0.000048300	0.000056800	0.000051100	0.000078800	0.000076200	0.000000000	0.000000000	0.000067800	0.000068400	0.000000000	0.000000000
C13H13NO7	295.069184	1.000	0.538	0.08	0.0000	0.0000	0.41	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000146200	0.000093700	0.000090800	0.000112700	0.000095000	0.000107700	0.000100100	0.000088500	0.000092400	0.000091500	0.000086400	0.000085500	0.000103600	0.000109300	0.000074100	0.000093900	0.000100800	0.000102000	0.000093900	0.000104700	0.000099600	0.000101200	0.000111600	0.000130200	0.000136100	0.000112100	0.000101200	0.000134100	0.000137200	0.000167700	0.000158400	0.000158300	0.000163000	0.000137800	0.000143700
C17H13NO4	295.084529	0.765	0.235	0.06	0.0000	0.0000	0.64	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000033200	0.000026700	0.000024100	0.000037400	0.000031900	0.000024000	0.000037700	0.000026500	0.000023900	0.000028400	0.000032200	0.000019000	0.000025700	0.000022800	0.000025600	0.000032700	0.000031200	0.000025600	0.000034900	0.000027400	0.000035400	0.000031600	0.000027500	0.000041200	0.000040100	0.000023900	0.000024400	0.000039700	0.000044800	0.000033200	0.000035400	0.000048100	0.000043400	0.000024100	0.000030500
C14H17NO4S	295.087886	1.214	0.286	0.07	0.0714	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044300	0.000000000	0.000061700	0.000062500	0.000039800	0.000040200	0.000037500	0.000000000	0.000028300	0.000000000	0.000000000	0.000000000	0.000000000	0.000034200	0.000032200	0.000054200	0.000053800	0.000029300	0.000029000	0.000049100	0.000055300	0.000075500	0.000068400	0.000023800	0.000020900	0.000038500	0.000044900	0.000046700	0.000049600	0.000000000	0.000000000	0.000047100	0.000037700	0.000000000	0.000000000
C14H17NO6	295.105600	1.214	0.429	0.07	0.0000	0.0000	0.30	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000265600	0.000216800	0.000297300	0.000282400	0.000258200	0.000271300	0.000261800	0.000203700	0.000199600	0.000179500	0.000185800	0.000203600	0.000201200	0.000286800	0.000282900	0.000327600	0.000318600	0.000271100	0.000282000	0.000271700	0.000267300	0.000359600	0.000345800	0.000246600	0.000243500	0.000284800	0.000290500	0.000299300	0.000291800	0.000284400	0.000285700	0.000272000	0.000275100	0.000205600	0.000208700
C13H17N3O5	295.116858	1.308	0.385	0.23	0.0000	0.0000	0.20	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000023800	0.000000000	0.000000000	0.000019500	0.000000000	0.000022700	0.000027100	0.000000000	0.000000000	0.000000000	0.000021900	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000
C18H17NO3	295.120874	0.944	0.167	0.06	0.0000	0.0000	0.55	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020100	0.000000000	0.000019300	0.000022600	0.000024400	0.000026500	0.000025500	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000028200	0.000022100	0.000022600	0.000000000	0.000026700	0.000023600	0.000030400	0.000027100	0.000000000	0.000026400	0.000000000	0.000000000	0.000024600	0.000019700	0.000000000	0.000018200	0.000024700	0.000025900	0.000000000	0.000024000
C15H21NO3S	295.124255	1.400	0.200	0.07	0.0667	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000029500	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000024500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H21NO5	295.142024	1.400	0.333	0.07	0.0000	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000085400	0.000090000	0.000140000	0.000127300	0.000123500	0.000126000	0.000119700	0.000081000	0.000081900	0.000070600	0.000055600	0.000090700	0.000074700	0.000132000	0.000159100	0.000156200	0.000145100	0.000123000	0.000133000	0.000123900	0.000123400	0.000188200	0.000176300	0.000090900	0.000082700	0.000129800	0.000119000	0.000104200	0.000108100	0.000096300	0.000098100	0.000096800	0.000091900	0.000061600	0.000067700
C16H25NO4	295.178402	1.562	0.250	0.06	0.0000	0.0000	0.15	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000028600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000018100	0.000000000	0.000000000	0.000000000
C12H8O7S	295.999060	0.667	0.583	0.00	0.0833	0.0000	0.60	9	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000021500	0.000000000	0.000000000	0.000026300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000021900	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000020500	0.000021800	0.000021500	0.000020300
C13H12O4S2	296.017765	0.923	0.308	0.00	0.1538	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000031200	0.000000000	0.000031700	0.000046400	0.000024000	0.000023600	0.000027700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025900	0.000000000	0.000043600	0.000045700	0.000000000	0.000000000	0.000030600	0.000023400	0.000038200	0.000039500	0.000018400	0.000018100	0.000020900	0.000024400	0.000039000	0.000043900	0.000000000	0.000000000	0.000035300	0.000032600	0.000000000	0.000000000
C16H8O6	296.032065	0.500	0.375	0.00	0.0000	0.0000	0.77	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000057100	0.000042600	0.000031900	0.000037200	0.000036000	0.000032200	0.000040200	0.000054400	0.000058000	0.000046600	0.000043800	0.000037100	0.000045100	0.000020000	0.000029500	0.000031100	0.000025500	0.000034800	0.000000000	0.000049000	0.000039500	0.000035700	0.000020200	0.000054800	0.000051100	0.000034400	0.000025200	0.000040400	0.000034100	0.000068600	0.000059800	0.000058400	0.000066700	0.000136800	0.000133900
C13H12O6S	296.035448	0.923	0.462	0.00	0.0769	0.0000	0.44	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000165500	0.000072300	0.000139800	0.000172800	0.000123400	0.000130100	0.000127100	0.000083100	0.000092700	0.000075300	0.000073400	0.000059000	0.000072700	0.000121100	0.000098300	0.000165500	0.000157100	0.000114800	0.000100100	0.000141500	0.000134700	0.000154300	0.000160800	0.000115600	0.000132800	0.000135400	0.000123000	0.000195600	0.000196300	0.000041600	0.000039400	0.000170400	0.000180200	0.000045700	0.000047600
C10H16O6S2	296.038839	1.600	0.600	0.00	0.2000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000021500	0.000000000	0.000046500	0.000042700	0.000025500	0.000037200	0.000029200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000035100	0.000039200	0.000026700	0.000031500	0.000035500	0.000044700	0.000055800	0.000055400	0.000018000	0.000027700	0.000040000	0.000036600	0.000035500	0.000036800	0.000000000	0.000000000	0.000018400	0.000021000	0.000000000	0.000000000
C17H12O3S	296.050810	0.706	0.176	0.00	0.0588	0.0000	0.66	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000019800	0.000000000	0.000022600	0.000000000	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000
C13H12O8	296.053261	0.923	0.615	0.00	0.0000	0.0000	0.44	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000249200	0.000209400	0.000143200	0.000164500	0.000163700	0.000190900	0.000183400	0.000181000	0.000244800	0.000232600	0.000200800	0.000191600	0.000231800	0.000159800	0.000106900	0.000113500	0.000123600	0.000194900	0.000157900	0.000198900	0.000193600	0.000104600	0.000120400	0.000248300	0.000281700	0.000197700	0.000183500	0.000210700	0.000210300	0.000411700	0.000369900	0.000278700	0.000270500	0.000447300	0.000431000
C14H16O3S2	296.054109	1.143	0.214	0.00	0.1429	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000032100	0.000000000	0.000048400	0.000036800	0.000018700	0.000027100	0.000029900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026500	0.000026700	0.000034400	0.000036800	0.000000000	0.000000000	0.000027900	0.000034500	0.000053200	0.000046300	0.000021200	0.000000000	0.000025900	0.000031600	0.000034800	0.000035900	0.000000000	0.000000000	0.000037400	0.000026100	0.000000000	0.000000000
C10H16O8S	296.056613	1.600	0.800	0.00	0.1000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000032300	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000025300	0.000023400	0.000022700	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000022700	0.000000000	0.000000000	0.000025600	0.000020600	0.000035900	0.000023500	0.000023900	0.000000000	0.000000000	0.000000000
C12H12N2O7	296.064440	1.000	0.583	0.17	0.0000	0.0000	0.38	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000039800	0.000000000	0.000019400	0.000025100	0.000019900	0.000020900	0.000024000	0.000023500	0.000028900	0.000022500	0.000022900	0.000000000	0.000026100	0.000018300	0.000000000	0.000022100	0.000000000	0.000018900	0.000018100	0.000000000	0.000024200	0.000018200	0.000021800	0.000026700	0.000029500	0.000021500	0.000026900	0.000027200	0.000026100	0.000036900	0.000040500	0.000041200	0.000040100	0.000034400	0.000038400
C17H12O5	296.068479	0.706	0.294	0.00	0.0000	0.0000	0.66	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000179100	0.000120600	0.000118200	0.000131500	0.000116100	0.000118900	0.000124000	0.000141300	0.000145800	0.000121500	0.000124800	0.000123900	0.000131500	0.000104400	0.000094600	0.000098700	0.000101500	0.000109000	0.000102000	0.000135000	0.000135900	0.000105000	0.000089600	0.000152100	0.000175800	0.000099300	0.000100800	0.000144900	0.000141000	0.000142200	0.000150700	0.000172800	0.000185200	0.000210900	0.000210700
C14H16O5S	296.071870	1.143	0.357	0.00	0.0714	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000196200	0.000086500	0.000296000	0.000270100	0.000205300	0.000202800	0.000190400	0.000115400	0.000116500	0.000087300	0.000078300	0.000089300	0.000090900	0.000206800	0.000190400	0.000286900	0.000280700	0.000160800	0.000174500	0.000243400	0.000252400	0.000382500	0.000351200	0.000131700	0.000135000	0.000216100	0.000197700	0.000246800	0.000246500	0.000057800	0.000059600	0.000214500	0.000186800	0.000042000	0.000044000
C11H20O5S2	296.075292	1.818	0.455	0.00	0.1818	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H12N2O4	296.079766	0.750	0.250	0.13	0.0000	0.0000	0.67	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000023400	0.000021400	0.000018600	0.000024400	0.000020100	0.000022200	0.000021100	0.000025700	0.000018900	0.000019100	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000021000	0.000019800	0.000000000	0.000019300	0.000000000	0.000000000	0.000026800	0.000022800	0.000000000	0.000019500	0.000024600	0.000027100	0.000020300	0.000019900	0.000029000	0.000028500	0.000000000	0.000028600
C14H16O7	296.089599	1.143	0.500	0.00	0.0000	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001824500	0.001852800	0.001698900	0.001826100	0.001889900	0.002020900	0.001838700	0.001988100	0.002009800	0.002038400	0.001814600	0.001815900	0.001859200	0.002036800	0.001830600	0.001903900	0.001858100	0.002084400	0.002040100	0.001898100	0.001803000	0.001672900	0.001777300	0.001976200	0.002039500	0.001952600	0.001835100	0.002060700	0.002004200	0.002326400	0.002203800	0.001922700	0.002127800	0.002017700	0.002099300
C11H20O7S	296.092951	1.818	0.636	0.00	0.0909	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000031100	0.000028400	0.000051900	0.000050600	0.000049700	0.000046000	0.000046900	0.000000000	0.000034100	0.000021500	0.000022800	0.000000000	0.000024700	0.000043500	0.000037900	0.000064400	0.000045100	0.000054400	0.000049600	0.000047900	0.000052500	0.000047000	0.000056600	0.000033800	0.000033600	0.000057900	0.000059400	0.000043000	0.000048000	0.000114900	0.000110500	0.000029200	0.000035500	0.000054700	0.000048400
C13H16N2O6	296.100853	1.231	0.462	0.15	0.0000	0.0000	0.25	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000107000	0.000076700	0.000111600	0.000112000	0.000104500	0.000107700	0.000111700	0.000073400	0.000083300	0.000068300	0.000073200	0.000071600	0.000075900	0.000117900	0.000108200	0.000133900	0.000147100	0.000108300	0.000104100	0.000104400	0.000110900	0.000158000	0.000153300	0.000100000	0.000106200	0.000111200	0.000114700	0.000124800	0.000121500	0.000147400	0.000149700	0.000117300	0.000114500	0.000083100	0.000091200
C18H16O4	296.104907	0.889	0.222	0.00	0.0000	0.0000	0.56	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000105400	0.000102000	0.000099100	0.000126100	0.000112500	0.000116400	0.000115600	0.000112300	0.000110400	0.000106800	0.000102200	0.000112400	0.000089200	0.000114000	0.000126300	0.000118100	0.000111900	0.000095100	0.000101600	0.000112100	0.000111300	0.000115400	0.000114200	0.000110400	0.000109700	0.000099100	0.000102300	0.000117100	0.000117900	0.000084700	0.000086900	0.000129000	0.000110300	0.000106600	0.000103600
C15H20O4S	296.108293	1.333	0.267	0.00	0.0667	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000059600	0.000054000	0.000077400	0.000099300	0.000078600	0.000062500	0.000077200	0.000055600	0.000051600	0.000054200	0.000049200	0.000048400	0.000036400	0.000065200	0.000082100	0.000105100	0.000101100	0.000058200	0.000068300	0.000070200	0.000069300	0.000096500	0.000090200	0.000051700	0.000051000	0.000058200	0.000082200	0.000076800	0.000086800	0.000023300	0.000000000	0.000072700	0.000064100	0.000025900	0.000022100
C17H16N2O3	296.116121	0.941	0.176	0.12	0.0000	0.0000	0.56	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000026500	0.000000000	0.000000000	0.000025400	0.000023000	0.000000000	0.000023800	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000027100	0.000024300	0.000021500	0.000000000	0.000000000	0.000019600	0.000000000	0.000024700	0.000019500	0.000000000	0.000000000	0.000018500	0.000000000	0.000024800	0.000027200	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000
C15H20O6	296.125973	1.333	0.400	0.00	0.0000	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.002840800	0.003661800	0.003987200	0.003439100	0.004288400	0.004149400	0.003903600	0.004227600	0.003720600	0.003820000	0.003349900	0.003828000	0.003349200	0.004554100	0.004954200	0.004760200	0.004275700	0.004514500	0.004983700	0.003921900	0.003595300	0.004182000	0.004157300	0.003259300	0.003399400	0.003916800	0.003775500	0.003782900	0.003704800	0.003630400	0.003556500	0.003377800	0.003562800	0.003269800	0.003554400
C14H20N2O5	296.137275	1.429	0.357	0.14	0.0000	0.0000	0.16	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000049700	0.000040600	0.000074800	0.000059900	0.000056700	0.000057000	0.000052700	0.000030400	0.000046400	0.000032500	0.000022900	0.000043600	0.000030500	0.000057900	0.000074600	0.000078400	0.000072100	0.000056200	0.000059600	0.000060800	0.000061100	0.000089000	0.000083200	0.000053900	0.000046200	0.000059700	0.000055900	0.000059900	0.000055700	0.000057600	0.000055600	0.000050500	0.000046000	0.000030500	0.000033500
C19H20O3	296.141305	1.053	0.158	0.00	0.0000	0.0000	0.49	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000032200	0.000046000	0.000036700	0.000030400	0.000048000	0.000053900	0.000051800	0.000061500	0.000051200	0.000072600	0.000057400	0.000058200	0.000046000	0.000047900	0.000062200	0.000045900	0.000047100	0.000039700	0.000050300	0.000040500	0.000045100	0.000035400	0.000039500	0.000049700	0.000037400	0.000048500	0.000050300	0.000043000	0.000036900	0.000035800	0.000033700	0.000044500	0.000037400	0.000043000	0.000054200
C16H24O3S	296.144655	1.500	0.188	0.00	0.0625	0.0000	0.19	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000030000	0.000031200	0.000029600	0.000000000	0.000022500	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000022500	0.000028700	0.000024900	0.000019500	0.000021800	0.000031300	0.000025400	0.000022300	0.000029400	0.000018100	0.000000000	0.000022700	0.000000000	0.000028400	0.000025300	0.000000000	0.000000000	0.000023500	0.000020700	0.000000000	0.000019400
C16H24O5	296.162404	1.500	0.312	0.00	0.0000	0.0000	0.19	5	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000465300	0.000672200	0.000892200	0.000675600	0.001004600	0.000929800	0.000910400	0.000811500	0.000694300	0.000641100	0.000595400	0.000756000	0.000599600	0.000987300	0.001241900	0.001083300	0.000977400	0.000932100	0.001132100	0.000855900	0.000790200	0.001052100	0.001042300	0.000619600	0.000579000	0.000829200	0.000821500	0.000672900	0.000659800	0.000630400	0.000599300	0.000630200	0.000548400	0.000500800	0.000533400
C20H24O2	296.177646	1.200	0.100	0.00	0.0000	0.0000	0.42	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000022300	0.000000000	0.000000000	0.000000000	0.000026000	0.000020900	0.000018300	0.000019000	0.000020100	0.000021100	0.000021600	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000028800	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000020600	0.000000000
C17H28O4	296.198819	1.647	0.235	0.00	0.0000	0.0000	0.13	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000024300	0.000035100	0.000038700	0.000037800	0.000059600	0.000067200	0.000052900	0.000048100	0.000052000	0.000041000	0.000041800	0.000041300	0.000037200	0.000064700	0.000086600	0.000065900	0.000067000	0.000053700	0.000071500	0.000051900	0.000055200	0.000063800	0.000066100	0.000035500	0.000029400	0.000040900	0.000054200	0.000038500	0.000042400	0.000042900	0.000029000	0.000036400	0.000032100	0.000037500	0.000034600
C12H11NO6S	297.030714	0.917	0.500	0.08	0.0833	0.0000	0.43	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000044800	0.000018500	0.000033600	0.000040200	0.000037900	0.000032700	0.000031100	0.000019700	0.000018100	0.000022100	0.000023700	0.000000000	0.000025000	0.000034700	0.000024500	0.000044900	0.000036300	0.000030300	0.000028000	0.000039100	0.000030500	0.000041600	0.000046000	0.000034200	0.000038200	0.000029000	0.000037700	0.000047300	0.000042700	0.000018900	0.000000000	0.000051200	0.000050700	0.000000000	0.000018300
C12H11NO8	297.048554	0.917	0.667	0.08	0.0000	0.0000	0.43	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000021300	0.000000000	0.000029300	0.000031200	0.000025500	0.000027100	0.000025600	0.000029400
C16H11NO5	297.063711	0.688	0.312	0.06	0.0000	0.0000	0.68	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000067500	0.000036200	0.000042800	0.000053400	0.000033400	0.000043700	0.000047600	0.000037800	0.000041100	0.000039900	0.000044100	0.000042100	0.000047400	0.000031400	0.000032700	0.000037900	0.000043100	0.000038500	0.000035000	0.000046900	0.000045500	0.000042200	0.000041700	0.000052700	0.000051800	0.000036900	0.000048400	0.000058500	0.000069000	0.000044800	0.000054300	0.000069200	0.000076000	0.000058800	0.000058600
C13H15NO5S	297.067078	1.154	0.385	0.08	0.0769	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000095700	0.000024800	0.000132200	0.000121500	0.000079800	0.000074400	0.000074300	0.000043700	0.000042600	0.000018700	0.000029700	0.000035500	0.000040800	0.000072000	0.000064700	0.000109100	0.000122500	0.000066300	0.000060500	0.000124900	0.000113300	0.000170100	0.000167100	0.000054200	0.000062200	0.000094300	0.000090300	0.000125600	0.000121500	0.000033300	0.000026400	0.000103700	0.000100900	0.000000000	0.000000000
C13H15NO7	297.084903	1.154	0.538	0.08	0.0000	0.0000	0.29	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000158100	0.000135400	0.000128200	0.000159600	0.000125700	0.000151300	0.000140700	0.000121300	0.000140200	0.000114500	0.000121600	0.000130900	0.000132800	0.000162100	0.000125200	0.000155100	0.000167100	0.000166700	0.000138700	0.000136400	0.000145300	0.000152600	0.000166500	0.000163400	0.000172500	0.000158700	0.000164300	0.000178200	0.000177500	0.000251500	0.000227900	0.000170100	0.000172800	0.000160300	0.000157600
C12H15N3O6	297.096049	1.250	0.500	0.25	0.0000	0.0000	0.17	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000022400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000
C17H15NO4	297.100097	0.882	0.235	0.06	0.0000	0.0000	0.57	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000070100	0.000029000	0.000066900	0.000080800	0.000055800	0.000062300	0.000055500	0.000041800	0.000037700	0.000037900	0.000033800	0.000034500	0.000046500	0.000056300	0.000064700	0.000066600	0.000063800	0.000052600	0.000048400	0.000058500	0.000051400	0.000077300	0.000074500	0.000054400	0.000060900	0.000056400	0.000044800	0.000088100	0.000075000	0.000037500	0.000038900	0.000077800	0.000078500	0.000044300	0.000044200
C14H19NO4S	297.103487	1.357	0.286	0.07	0.0714	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000031500	0.000000000	0.000051800	0.000046000	0.000034200	0.000036400	0.000028600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000034200	0.000048700	0.000053300	0.000000000	0.000000000	0.000037500	0.000039800	0.000063200	0.000058300	0.000000000	0.000018100	0.000023600	0.000037600	0.000037800	0.000044900	0.000000000	0.000000000	0.000029700	0.000028900	0.000000000	0.000000000
C14H19NO6	297.121251	1.357	0.429	0.07	0.0000	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000207200	0.000175400	0.000325800	0.000255000	0.000255600	0.000255600	0.000256000	0.000179900	0.000173700	0.000136800	0.000127600	0.000173200	0.000161200	0.000274100	0.000284500	0.000321400	0.000314000	0.000257500	0.000269600	0.000270100	0.000272300	0.000385600	0.000378000	0.000205200	0.000205300	0.000274000	0.000268400	0.000253700	0.000256900	0.000257700	0.000250800	0.000240800	0.000227900	0.000157900	0.000168900
C18H19NO3	297.136527	1.056	0.167	0.06	0.0000	0.0000	0.48	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000025800	0.000019400	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000021500	0.000018500	0.000029500	0.000024900	0.000000000	0.000022300	0.000000000	0.000000000	0.000021200	0.000023000	0.000018300	0.000000000	0.000032300	0.000000000	0.000000000	0.000020300	0.000000000	0.000020400	0.000026600	0.000021200	0.000000000	0.000000000
C15H23NO5	297.157607	1.533	0.333	0.07	0.0000	0.0000	0.13	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000052800	0.000044600	0.000081200	0.000063200	0.000080500	0.000066200	0.000076900	0.000044900	0.000041800	0.000028600	0.000035900	0.000040300	0.000032200	0.000076800	0.000094800	0.000087600	0.000080200	0.000070100	0.000080600	0.000074200	0.000070500	0.000119400	0.000116900	0.000051500	0.000040000	0.000065100	0.000072400	0.000064500	0.000065000	0.000046200	0.000047400	0.000047400	0.000056000	0.000037700	0.000030600
C12H10O5S2	297.997002	0.833	0.417	0.00	0.1667	0.0000	0.47	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000043600	0.000000000	0.000033700	0.000062700	0.000027500	0.000023200	0.000034800	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000037700	0.000029100	0.000042600	0.000047400	0.000000000	0.000000000	0.000027500	0.000032300	0.000032100	0.000042900	0.000018200	0.000023600	0.000022200	0.000024200	0.000051900	0.000053200	0.000000000	0.000000000	0.000039300	0.000043500	0.000000000	0.000000000
C15H6O7	298.011379	0.400	0.467	0.00	0.0000	0.0000	0.83	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019400	0.000021200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000021400	0.000024800	0.000019700	0.000045100	0.000055800
C12H10O7S	298.014716	0.833	0.583	0.00	0.0833	0.0000	0.47	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000061500	0.000021200	0.000037100	0.000056800	0.000042500	0.000038500	0.000040100	0.000036500	0.000054600	0.000037900	0.000034800	0.000033900	0.000035800	0.000035400	0.000022600	0.000050300	0.000054400	0.000044400	0.000040500	0.000035900	0.000042000	0.000034100	0.000043400	0.000041200	0.000052200	0.000046400	0.000036900	0.000061500	0.000062800	0.000039300	0.000031700	0.000045700	0.000069100	0.000034300	0.000034500
C16H10O4S	298.030057	0.625	0.250	0.00	0.0625	0.0000	0.69	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000024500	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000019600	0.000027400	0.000028700	0.000000000	0.000000000	0.000028900	0.000022000	0.000000000	0.000000000
C12H10O9	298.032557	0.833	0.750	0.00	0.0000	0.0000	0.47	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000026000	0.000000000	0.000019800	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000	0.000027600	0.000022600	0.000000000	0.000000000	0.000029200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000026400	0.000000000	0.000000000	0.000018900	0.000027800	0.000000000	0.000000000	0.000022700	0.000000000	0.000061100	0.000043900	0.000027100	0.000025500	0.000076100	0.000073600
C13H14O4S2	298.033410	1.077	0.308	0.00	0.1538	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000028600	0.000000000	0.000047000	0.000052000	0.000025700	0.000032300	0.000031700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028100	0.000028300	0.000053000	0.000050900	0.000023600	0.000000000	0.000035100	0.000030900	0.000056600	0.000057900	0.000000000	0.000018400	0.000024100	0.000022800	0.000045700	0.000045600	0.000000000	0.000000000	0.000045700	0.000037300	0.000000000	0.000000000
C16H10O6	298.047722	0.625	0.375	0.00	0.0000	0.0000	0.69	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000161200	0.000108100	0.000107400	0.000097100	0.000108700	0.000105100	0.000094200	0.000125000	0.000145300	0.000117900	0.000117600	0.000113500	0.000127000	0.000066500	0.000062700	0.000073600	0.000074100	0.000088300	0.000074300	0.000133300	0.000126400	0.000073200	0.000068500	0.000135900	0.000154300	0.000088200	0.000087200	0.000111400	0.000109200	0.000152300	0.000137800	0.000152200	0.000176700	0.000254400	0.000242200
C13H14O6S	298.051094	1.077	0.462	0.00	0.0769	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000221400	0.000109900	0.000274900	0.000268900	0.000203600	0.000204500	0.000193100	0.000120800	0.000133600	0.000101000	0.000100500	0.000103900	0.000123000	0.000198100	0.000178000	0.000260800	0.000263100	0.000183700	0.000169300	0.000243600	0.000250500	0.000311200	0.000328500	0.000175100	0.000175400	0.000223400	0.000205100	0.000285400	0.000266500	0.000062100	0.000071800	0.000215900	0.000228500	0.000061100	0.000059900
C10H18O6S2	298.054486	1.800	0.600	0.00	0.2000	0.0000	0.00	2	0	0	0	0	0	0	1	1	0	0	0	0	0	1	1	0	0	0	0	0.000000000	0.000000000	0.000024400	0.000020000	0.000021900	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028500	0.000000000	0.000000000	0.000020100	0.000022500	0.000032600	0.000040500	0.000000000	0.000022000	0.000029200	0.000037400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H10N2O5	298.059012	0.667	0.333	0.13	0.0000	0.0000	0.71	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000028600	0.000018700	0.000000000	0.000020500	0.000019200	0.000000000	0.000031300	0.000000000	0.000022400	0.000000000	0.000000000	0.000025000	0.000019400	0.000000000	0.000000000	0.000000000	0.000019600	0.000019300	0.000000000	0.000018400	0.000000000	0.000018500	0.000000000	0.000000000	0.000028900	0.000000000	0.000000000	0.000000000	0.000022600	0.000025600	0.000027300	0.000019700	0.000029600	0.000021900	0.000028800
C17H14O3S	298.066444	0.824	0.176	0.00	0.0588	0.0000	0.59	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000027000	0.000022400	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000027900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000000000	0.000028900	0.000000000	0.000000000	0.000000000	0.000000000	0.000027400	0.000000000	0.000000000
C13H14O8	298.068915	1.077	0.615	0.00	0.0000	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000617400	0.000517100	0.000404100	0.000500600	0.000487600	0.000539400	0.000501600	0.000499500	0.000676000	0.000567300	0.000490900	0.000491900	0.000600000	0.000564500	0.000382200	0.000433500	0.000456600	0.000586700	0.000470400	0.000502800	0.000488600	0.000356900	0.000400700	0.000629300	0.000760000	0.000528800	0.000502000	0.000612500	0.000599300	0.001101800	0.000929600	0.000675400	0.000657200	0.000797100	0.000789200
C14H18O3S2	298.069772	1.286	0.214	0.00	0.1429	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000024100	0.000033500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023700	0.000042700	0.000029100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H14N2O7	298.080085	1.167	0.583	0.17	0.0000	0.0000	0.23	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000047400	0.000022400	0.000019500	0.000040700	0.000026600	0.000022100	0.000024800	0.000023800	0.000037700	0.000021700	0.000021900	0.000026900	0.000026500	0.000032700	0.000019100	0.000039300	0.000036000	0.000038900	0.000022000	0.000030800	0.000027000	0.000029900	0.000032300	0.000052500	0.000041800	0.000026200	0.000035800	0.000045100	0.000048700	0.000070700	0.000059000	0.000044700	0.000053200	0.000037600	0.000043400
C17H14O5	298.084115	0.824	0.294	0.00	0.0000	0.0000	0.59	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000244200	0.000201000	0.000218700	0.000227600	0.000214700	0.000218100	0.000219000	0.000223200	0.000215300	0.000208500	0.000208200	0.000203800	0.000200600	0.000204100	0.000206700	0.000208400	0.000215800	0.000191700	0.000187600	0.000222000	0.000226000	0.000224300	0.000209200	0.000217600	0.000238000	0.000199300	0.000193200	0.000256500	0.000246200	0.000176000	0.000178100	0.000268600	0.000285900	0.000257400	0.000269700
C14H18O5S	298.087508	1.286	0.357	0.00	0.0714	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000216900	0.000151300	0.000297700	0.000290300	0.000218700	0.000212800	0.000212400	0.000139200	0.000121800	0.000119300	0.000104500	0.000129200	0.000127400	0.000209200	0.000238700	0.000321100	0.000323900	0.000209300	0.000210900	0.000253700	0.000248700	0.000357900	0.000340800	0.000202800	0.000182700	0.000230900	0.000224400	0.000264700	0.000286200	0.000193400	0.000198800	0.000218800	0.000211800	0.000105400	0.000109500
C16H14N2O4	298.095415	0.875	0.250	0.13	0.0000	0.0000	0.58	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000041000	0.000021900	0.000035400	0.000048900	0.000030300	0.000000000	0.000035000	0.000030000	0.000000000	0.000027500	0.000000000	0.000026000	0.000024600	0.000033800	0.000037600	0.000028200	0.000041100	0.000000000	0.000027400	0.000027600	0.000030800	0.000034700	0.000038500	0.000027700	0.000043900	0.000000000	0.000034200	0.000048200	0.000049800	0.000034500	0.000000000	0.000041800	0.000043100	0.000026500	0.000030500
C14H18O7	298.105266	1.286	0.500	0.00	0.0000	0.0000	0.24	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.002869200	0.003160900	0.003205200	0.003144800	0.003505100	0.003584900	0.003346300	0.003508400	0.003302100	0.003342500	0.002931800	0.003121500	0.003025400	0.003829300	0.003619000	0.003799600	0.003542000	0.003890600	0.003949900	0.003471700	0.003191800	0.003340600	0.003496800	0.003188100	0.003334000	0.003539000	0.003208400	0.003603600	0.003533100	0.004031100	0.003821000	0.003221900	0.003530100	0.003118600	0.003264700
C13H18N2O6	298.116486	1.385	0.462	0.15	0.0000	0.0000	0.12	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000086800	0.000064700	0.000127000	0.000095200	0.000088900	0.000093200	0.000094000	0.000063400	0.000060000	0.000046100	0.000039700	0.000065600	0.000052000	0.000099700	0.000096800	0.000115200	0.000112500	0.000095700	0.000105800	0.000104700	0.000106900	0.000153200	0.000159100	0.000079000	0.000085100	0.000113500	0.000104500	0.000098100	0.000108500	0.000118900	0.000124100	0.000095500	0.000081900	0.000067800	0.000070700
C18H18O4	298.120545	1.000	0.222	0.00	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000121400	0.000136100	0.000133000	0.000144400	0.000158000	0.000146300	0.000141400	0.000162700	0.000161100	0.000165700	0.000159800	0.000164700	0.000143300	0.000153400	0.000178200	0.000146500	0.000151000	0.000149900	0.000160200	0.000138100	0.000148600	0.000155500	0.000143200	0.000138700	0.000135700	0.000136500	0.000123200	0.000134700	0.000136900	0.000097700	0.000086300	0.000137100	0.000135500	0.000129500	0.000140700
C15H22O4S	298.123945	1.467	0.267	0.00	0.0667	0.0000	0.17	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000044700	0.000037700	0.000064800	0.000079700	0.000068500	0.000069000	0.000059900	0.000040700	0.000034100	0.000036100	0.000033400	0.000042900	0.000031200	0.000047100	0.000065900	0.000094400	0.000085400	0.000059500	0.000065600	0.000063900	0.000059700	0.000090800	0.000077700	0.000045800	0.000041400	0.000059700	0.000073700	0.000065700	0.000061800	0.000029500	0.000022200	0.000062000	0.000039700	0.000000000	0.000025000
C17H18N2O3	298.131795	1.059	0.176	0.12	0.0000	0.0000	0.48	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024100	0.000000000	0.000000000	0.000000000	0.000020300	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023600	0.000023500	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000025600	0.000000000	0.000000000	0.000022600	0.000023800	0.000000000	0.000026200	0.000031000	0.000000000	0.000018700	0.000018700	0.000027500	0.000000000	0.000000000
C15H22O6	298.141622	1.467	0.400	0.00	0.0000	0.0000	0.17	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001982000	0.002545200	0.003122200	0.002470400	0.003344000	0.003210400	0.002968000	0.002905600	0.002518500	0.002525900	0.002255700	0.002715200	0.002197300	0.003337000	0.003840600	0.003731400	0.003302900	0.003406000	0.003944500	0.003000000	0.002760900	0.003318800	0.003393400	0.002378600	0.002284200	0.002902700	0.002779100	0.002682100	0.002663600	0.002583700	0.002559200	0.002339900	0.002442800	0.002037900	0.002240500
C14H22N2O5	298.152916	1.571	0.357	0.14	0.0000	0.0000	0.05	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000024100	0.000018100	0.000000000	0.000024900	0.000024600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024500	0.000029100	0.000029300	0.000025000	0.000000000	0.000023300	0.000025700	0.000030300	0.000033000	0.000000000	0.000000000	0.000029000	0.000024800	0.000000000	0.000022800	0.000000000	0.000023600	0.000024100	0.000020800	0.000000000	0.000000000
C19H22O3	298.156963	1.158	0.158	0.00	0.0000	0.0000	0.43	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000041600	0.000071500	0.000061600	0.000039800	0.000061700	0.000071500	0.000075200	0.000088600	0.000068700	0.000085200	0.000079800	0.000069600	0.000062400	0.000077800	0.000099600	0.000062900	0.000065000	0.000067200	0.000081600	0.000061800	0.000062200	0.000052200	0.000055600	0.000049100	0.000059000	0.000053900	0.000076700	0.000054800	0.000058300	0.000035100	0.000044100	0.000054500	0.000046100	0.000053200	0.000058800
C16H26O3S	298.160297	1.625	0.188	0.00	0.0625	0.0000	0.11	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000090200	0.000044000	0.000176500	0.000111100	0.000211700	0.000138400	0.000093700	0.000079000	0.000058300	0.000083000	0.000051400	0.000068300	0.000055900	0.000132600	0.000133400	0.000116400	0.000064100	0.000167400	0.000322300	0.000249800	0.000272700	0.000299700	0.000213800	0.000080700	0.000047500	0.000204400	0.000060300	0.000122300	0.000076400	0.000098300	0.000042600	0.000055400	0.000055700	0.000110300	0.000145000
C16H26O5	298.178028	1.625	0.312	0.00	0.0000	0.0000	0.11	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000132200	0.000192100	0.000287500	0.000207200	0.000311500	0.000297800	0.000297100	0.000225500	0.000190100	0.000170800	0.000166500	0.000200200	0.000159200	0.000300800	0.000383900	0.000346800	0.000308300	0.000299500	0.000373800	0.000275300	0.000268200	0.000355600	0.000354000	0.000187000	0.000166500	0.000249300	0.000249200	0.000208100	0.000196500	0.000193400	0.000191900	0.000185600	0.000158300	0.000168400	0.000158600
C20H26O2	298.193299	1.300	0.100	0.00	0.0000	0.0000	0.37	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000023800	0.000000000	0.000000000	0.000022900	0.000023600	0.000019300	0.000030000	0.000019300	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H9NO7S	299.009932	0.818	0.636	0.09	0.0909	0.0000	0.45	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000000000	0.000000000
C15H9NO6	299.042967	0.600	0.400	0.07	0.0000	0.0000	0.73	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000042500	0.000027200	0.000023200	0.000027500	0.000022200	0.000028000	0.000029400	0.000027300	0.000036700	0.000027200	0.000022700	0.000026900	0.000033900	0.000019000	0.000000000	0.000020500	0.000024500	0.000023200	0.000000000	0.000027200	0.000027800	0.000023900	0.000023400	0.000031200	0.000035400	0.000033700	0.000020500	0.000034800	0.000034300	0.000048000	0.000033600	0.000030200	0.000045200	0.000060200	0.000051000
C12H13NO6S	299.046344	1.083	0.500	0.08	0.0833	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000064700	0.000023000	0.000071400	0.000081700	0.000053900	0.000055000	0.000067500	0.000032000	0.000041700	0.000023300	0.000029200	0.000000000	0.000036400	0.000056900	0.000047400	0.000073400	0.000082000	0.000050200	0.000042500	0.000071500	0.000073600	0.000096100	0.000107100	0.000052900	0.000045600	0.000064400	0.000066600	0.000084900	0.000080200	0.000022100	0.000022800	0.000073100	0.000067500	0.000019200	0.000019100
C16H13NO3S	299.061676	0.812	0.188	0.06	0.0625	0.0000	0.60	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020100	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000019000	0.000000000	0.000000000	0.000023600	0.000022500	0.000000000	0.000000000
C12H13NO8	299.064150	1.083	0.667	0.08	0.0000	0.0000	0.29	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000045500	0.000000000	0.000025400	0.000026900	0.000022800	0.000025500	0.000023900	0.000019900	0.000042500	0.000024500	0.000026300	0.000029200	0.000029800	0.000023800	0.000000000	0.000026600	0.000026400	0.000038700	0.000026900	0.000029900	0.000022800	0.000000000	0.000000000	0.000031000	0.000042700	0.000026000	0.000000000	0.000040300	0.000038600	0.000070500	0.000068900	0.000048900	0.000044800	0.000051800	0.000055400
C16H13NO5	299.079389	0.812	0.312	0.06	0.0000	0.0000	0.60	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000110300	0.000055900	0.000078100	0.000103400	0.000077800	0.000086900	0.000080700	0.000056200	0.000062100	0.000053200	0.000059900	0.000059500	0.000062000	0.000072300	0.000071000	0.000087100	0.000081900	0.000066800	0.000059600	0.000074900	0.000074200	0.000102700	0.000092900	0.000078100	0.000081700	0.000057700	0.000055100	0.000103600	0.000102500	0.000051000	0.000055800	0.000106200	0.000101400	0.000068400	0.000061400
C13H17NO5S	299.082780	1.308	0.385	0.08	0.0769	0.0000	0.18	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000073500	0.000000000	0.000100800	0.000085000	0.000067400	0.000055600	0.000056000	0.000025300	0.000033300	0.000000000	0.000000000	0.000019600	0.000027900	0.000052000	0.000052200	0.000090800	0.000087600	0.000047900	0.000052500	0.000083300	0.000084900	0.000129000	0.000122200	0.000046800	0.000043800	0.000065300	0.000075000	0.000083800	0.000085400	0.000000000	0.000000000	0.000072300	0.000061200	0.000000000	0.000018600
C13H17NO7	299.100500	1.308	0.538	0.08	0.0000	0.0000	0.18	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000206900	0.000148300	0.000220500	0.000225600	0.000207400	0.000219000	0.000208300	0.000157200	0.000167600	0.000149500	0.000127800	0.000157900	0.000154900	0.000234900	0.000209900	0.000252900	0.000261700	0.000233700	0.000232300	0.000215800	0.000218300	0.000276500	0.000291000	0.000201900	0.000212600	0.000235500	0.000234000	0.000256000	0.000248700	0.000288300	0.000284700	0.000211100	0.000225100	0.000180400	0.000165400
C17H17NO4	299.115807	1.000	0.235	0.06	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000050100	0.000036300	0.000067300	0.000071500	0.000067000	0.000056500	0.000050800	0.000043300	0.000035900	0.000036000	0.000039100	0.000039200	0.000029200	0.000061900	0.000063900	0.000075000	0.000070100	0.000045800	0.000051500	0.000054100	0.000055100	0.000077100	0.000070100	0.000051700	0.000041800	0.000058200	0.000052000	0.000063800	0.000069800	0.000035700	0.000032600	0.000061700	0.000055600	0.000030300	0.000034600
C14H21NO4S	299.119244	1.500	0.286	0.07	0.0714	0.0000	0.10	5	0	0	0	0	0	0	1	0	1	1	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000021300	0.000023500	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000022000	0.000021200	0.000019200	0.000000000	0.000000000	0.000022400	0.000033600	0.000030000	0.000000000	0.000000000	0.000021400	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000
C14H21NO6	299.136873	1.500	0.429	0.07	0.0000	0.0000	0.10	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000098600	0.000085000	0.000198600	0.000131200	0.000166200	0.000148400	0.000154600	0.000100200	0.000080300	0.000061700	0.000057600	0.000084300	0.000083100	0.000138600	0.000164000	0.000186200	0.000172400	0.000143600	0.000155300	0.000169500	0.000169100	0.000235400	0.000243700	0.000105400	0.000107000	0.000146700	0.000145200	0.000132300	0.000138800	0.000113600	0.000122000	0.000117800	0.000125100	0.000080700	0.000086900
C18H21NO3	299.152205	1.167	0.167	0.06	0.0000	0.0000	0.42	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000022000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000022200	0.000022800	0.000023200	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H25NO5	299.173292	1.667	0.333	0.07	0.0000	0.0000	0.04	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000021500	0.000020200	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000022300	0.000026200	0.000025000	0.000021400	0.000000000	0.000000000	0.000018300	0.000021200	0.000027300	0.000021600	0.000000000	0.000023600	0.000000000	0.000000000	0.000018800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C11H8O8S	299.993990	0.727	0.727	0.00	0.0909	0.0000	0.50	8	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000
C15H8O5S	300.009245	0.533	0.333	0.00	0.0667	0.0000	0.74	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022800	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000020800	0.000024900	0.000000000	0.000000000
C12H12O5S2	300.012601	1.000	0.417	0.00	0.1667	0.0000	0.33	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000059100	0.000000000	0.000055300	0.000073800	0.000042000	0.000048600	0.000043600	0.000023900	0.000021300	0.000000000	0.000000000	0.000023000	0.000000000	0.000035500	0.000037500	0.000059400	0.000074700	0.000030100	0.000023500	0.000069300	0.000065300	0.000080600	0.000075300	0.000033200	0.000036600	0.000046600	0.000048100	0.000076100	0.000080400	0.000000000	0.000000000	0.000056800	0.000061500	0.000000000	0.000000000
C15H8O7	300.027064	0.533	0.467	0.00	0.0000	0.0000	0.74	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000051800	0.000046300	0.000038700	0.000024100	0.000034500	0.000032300	0.000039500	0.000055800	0.000057400	0.000045700	0.000052600	0.000047200	0.000047400	0.000025900	0.000045000	0.000022800	0.000023200	0.000026600	0.000021400	0.000044000	0.000042900	0.000032700	0.000000000	0.000050400	0.000043200	0.000037800	0.000020600	0.000025500	0.000021800	0.000072200	0.000050400	0.000053100	0.000054500	0.000121800	0.000118400
C12H12O7S	300.030439	1.000	0.583	0.00	0.0833	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000096400	0.000050800	0.000078200	0.000101200	0.000077800	0.000091200	0.000089400	0.000049300	0.000067400	0.000057800	0.000053900	0.000044700	0.000055900	0.000075100	0.000056000	0.000087200	0.000091300	0.000092600	0.000074300	0.000075500	0.000090000	0.000091600	0.000091600	0.000084800	0.000086800	0.000083900	0.000089200	0.000119300	0.000111000	0.000061100	0.000045800	0.000085300	0.000085300	0.000034900	0.000047100
C14H8N2O6	300.038242	0.571	0.429	0.14	0.0000	0.0000	0.78	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021100	0.000000000	0.000000000	0.000022900	0.000000000
C16H12O4S	300.045612	0.750	0.250	0.00	0.0625	0.0000	0.62	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000062100	0.000019400	0.000033800	0.000067900	0.000033700	0.000035900	0.000034100	0.000033100	0.000019300	0.000022700	0.000023000	0.000020400	0.000025000	0.000031400	0.000029200	0.000047900	0.000048800	0.000034800	0.000030300	0.000027400	0.000037400	0.000039000	0.000037000	0.000044200	0.000045500	0.000031100	0.000028200	0.000068100	0.000077100	0.000000000	0.000000000	0.000066500	0.000066900	0.000000000	0.000000000
C12H12O9	300.048124	1.000	0.750	0.00	0.0000	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000102000	0.000056500	0.000045700	0.000049000	0.000052000	0.000065000	0.000058400	0.000062300	0.000108000	0.000067900	0.000064400	0.000059400	0.000085300	0.000058200	0.000033000	0.000029500	0.000027400	0.000068100	0.000038200	0.000064500	0.000070000	0.000024600	0.000030500	0.000086400	0.000112800	0.000056500	0.000045700	0.000078900	0.000071700	0.000260300	0.000207400	0.000105800	0.000130600	0.000212400	0.000205300
C13H16O4S2	300.048989	1.231	0.308	0.00	0.1538	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000051600	0.000000000	0.000063100	0.000056900	0.000028500	0.000026700	0.000030000	0.000023000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000033800	0.000040000	0.000061200	0.000064200	0.000028600	0.000022300	0.000050100	0.000049800	0.000082900	0.000077400	0.000032000	0.000000000	0.000036700	0.000049900	0.000054700	0.000064500	0.000000000	0.000000000	0.000049600	0.000043100	0.000000000	0.000000000
C16H12O6	300.063450	0.750	0.375	0.00	0.0000	0.0000	0.62	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000246900	0.000177800	0.000181500	0.000199900	0.000183800	0.000186100	0.000175700	0.000191100	0.000219300	0.000193800	0.000185100	0.000198200	0.000187600	0.000164200	0.000139200	0.000163200	0.000170600	0.000168900	0.000157500	0.000196800	0.000189300	0.000158700	0.000154500	0.000205800	0.000230500	0.000169700	0.000169600	0.000214900	0.000210500	0.000186100	0.000184800	0.000252600	0.000236600	0.000275800	0.000274300
C13H16O6S	300.066797	1.231	0.462	0.00	0.0769	0.0000	0.22	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000189400	0.000118800	0.000237400	0.000256700	0.000186400	0.000195800	0.000189800	0.000126700	0.000137100	0.000100900	0.000116700	0.000122800	0.000115300	0.000185100	0.000180800	0.000264000	0.000241900	0.000184800	0.000180300	0.000216700	0.000221900	0.000285900	0.000279200	0.000171100	0.000161900	0.000210600	0.000209400	0.000234800	0.000234000	0.000089400	0.000076300	0.000195900	0.000180200	0.000056600	0.000065000
C15H12N2O5	300.074612	0.800	0.333	0.13	0.0000	0.0000	0.62	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000053100	0.000031000	0.000030400	0.000047000	0.000037100	0.000039900	0.000033900	0.000035100	0.000032900	0.000042700	0.000040100	0.000028500	0.000023700	0.000038400	0.000034800	0.000045500	0.000047900	0.000039900	0.000036900	0.000031900	0.000030700	0.000053500	0.000039300	0.000038700	0.000058200	0.000031700	0.000035000	0.000056300	0.000053400	0.000038500	0.000000000	0.000062900	0.000060900	0.000047000	0.000047500
C20H12O3	300.078609	0.600	0.150	0.00	0.0000	0.0000	0.73	15	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000019900	0.000028300	0.000028800
C17H16O3S	300.082053	0.941	0.176	0.00	0.0588	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000032600	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000032500	0.000000000	0.000000000
C13H16O8	300.084544	1.231	0.615	0.00	0.0000	0.0000	0.22	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001213700	0.001072800	0.000960500	0.001136700	0.001117800	0.001248500	0.001161200	0.001086500	0.001352300	0.001169600	0.001029700	0.001046700	0.001170200	0.001302200	0.000957800	0.001097500	0.001126100	0.001384000	0.001178400	0.001172900	0.001120300	0.001001600	0.001046700	0.001333900	0.001514700	0.001244600	0.001123900	0.001387000	0.001342300	0.002150000	0.001909000	0.001325000	0.001329800	0.001445800	0.001398700
C12H16N2O7	300.095800	1.333	0.583	0.17	0.0000	0.0000	0.08	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022600	0.000021300	0.000000000	0.000036600	0.000019900	0.000027500	0.000028800	0.000022600	0.000019400	0.000000000	0.000019500	0.000000000	0.000022600	0.000029200	0.000026600	0.000021800	0.000031700	0.000026800	0.000021800	0.000022200	0.000020300	0.000026600	0.000032600	0.000021900	0.000028400	0.000030000	0.000027200	0.000029700	0.000021900	0.000042100	0.000049500	0.000030100	0.000028800	0.000030500	0.000026500
C17H16O5	300.099801	0.941	0.294	0.00	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000280200	0.000269800	0.000300400	0.000307800	0.000313800	0.000298000	0.000296700	0.000304800	0.000288600	0.000295700	0.000281200	0.000291500	0.000277600	0.000298100	0.000315600	0.000298000	0.000294200	0.000287300	0.000272100	0.000298400	0.000303000	0.000330300	0.000312400	0.000274600	0.000294000	0.000289500	0.000272500	0.000303000	0.000301500	0.000212100	0.000209800	0.000307200	0.000294400	0.000279100	0.000281400
C14H20O5S	300.103145	1.429	0.357	0.00	0.0714	0.0000	0.14	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000160900	0.000126700	0.000230700	0.000223900	0.000194200	0.000170600	0.000172800	0.000131700	0.000108000	0.000114900	0.000109800	0.000106800	0.000106200	0.000178800	0.000204100	0.000252100	0.000232600	0.000163400	0.000179600	0.000308500	0.000292400	0.000352100	0.000274600	0.000149600	0.000142300	0.000184700	0.000174800	0.000207300	0.000212200	0.000126400	0.000134800	0.000168500	0.000166600	0.000090800	0.000117000
C16H16N2O4	300.110999	1.000	0.250	0.13	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000062900	0.000000000	0.000069100	0.000000000	0.000065400	0.000060800	0.000065500	0.000000000	0.000045100	0.000042700	0.000047700	0.000037300	0.000046900	0.000000000	0.000064800	0.000000000	0.000073500	0.000000000	0.000042000	0.000060000	0.000059700	0.000081900	0.000075500	0.000055200	0.000064900	0.000062000	0.000059200	0.000080100	0.000076600	0.000000000	0.000065900	0.000085200	0.000079800	0.000047400	0.000049700
C14H20O7	300.120962	1.429	0.500	0.00	0.0000	0.0000	0.14	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001743100	0.002112100	0.002352300	0.002176000	0.002513500	0.002500000	0.002363800	0.002182400	0.002136600	0.002011600	0.001816100	0.002161200	0.001873600	0.002657500	0.002721300	0.002853200	0.002667800	0.002732000	0.003016800	0.002312800	0.002246300	0.002491100	0.002611800	0.002100000	0.002093600	0.002503700	0.002361200	0.002323500	0.002226200	0.002631500	0.002564700	0.002009300	0.001915500	0.001773400	0.001870800
C13H20N2O6	300.132154	1.538	0.462	0.15	0.0000	0.0000	0.00	5	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000027700	0.000027400	0.000052600	0.000041800	0.000031200	0.000028100	0.000035800	0.000026900	0.000019100	0.000025000	0.000025500	0.000018500	0.000024900	0.000029500	0.000028900	0.000041600	0.000038800	0.000034400	0.000032700	0.000033700	0.000039500	0.000050000	0.000061400	0.000025300	0.000022800	0.000041500	0.000032400	0.000038100	0.000031700	0.000051300	0.000038900	0.000033400	0.000036600	0.000019500	0.000027700
C18H20O4	300.136151	1.111	0.222	0.00	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000182200	0.000266300	0.000252200	0.000220700	0.000286000	0.000272900	0.000254900	0.000313400	0.000274800	0.000298700	0.000277800	0.000298800	0.000246100	0.000281900	0.000328200	0.000282000	0.000242500	0.000255400	0.000298500	0.000260900	0.000253600	0.000278600	0.000264500	0.000218500	0.000216800	0.000252900	0.000238500	0.000238700	0.000221100	0.000155100	0.000163500	0.000224000	0.000216400	0.000210800	0.000223400
C15H24O4S	300.139512	1.600	0.267	0.00	0.0667	0.0000	0.08	4	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	1	0	0	0	0.000047200	0.000034200	0.000068000	0.000057200	0.000058400	0.000054600	0.000053000	0.000032400	0.000033000	0.000039000	0.000032100	0.000036500	0.000037100	0.000041300	0.000056000	0.000081900	0.000070300	0.000055300	0.000066300	0.000057900	0.000062400	0.000076200	0.000065900	0.000033700	0.000044400	0.000046800	0.000054700	0.000066000	0.000062100	0.000030500	0.000027100	0.000051200	0.000050400	0.000020900	0.000021700
C17H20N2O3	300.147409	1.176	0.176	0.12	0.0000	0.0000	0.41	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000019100	0.000000000	0.000022600	0.000029100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000018900	0.000000000	0.000024500	0.000022700	0.000024300	0.000021800	0.000021000	0.000020700	0.000000000	0.000025400	0.000022500	0.000023900	0.000000000	0.000000000	0.000000000	0.000030800	0.000029100	0.000028900	0.000024400	0.000023400	0.000022100	0.000021600	0.000000000	0.000023200
C15H24O6	300.157355	1.600	0.400	0.00	0.0000	0.0000	0.08	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000402000	0.000556500	0.000726800	0.000579500	0.000750400	0.000705400	0.000700000	0.000619800	0.000545800	0.000506600	0.000476900	0.000598700	0.000480400	0.000760000	0.000921600	0.000881500	0.000815000	0.000807400	0.000903000	0.000662800	0.000657800	0.000785100	0.000796500	0.000533700	0.000492300	0.000692100	0.000710100	0.000534300	0.000552400	0.000630000	0.000599700	0.000505000	0.000432600	0.000427800	0.000442600
C19H24O3	300.172527	1.263	0.158	0.00	0.0000	0.0000	0.37	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000066600	0.000120300	0.000089400	0.000085300	0.000111300	0.000120000	0.000106600	0.000141100	0.000121700	0.000139600	0.000120200	0.000154800	0.000108000	0.000121900	0.000145800	0.000111900	0.000099000	0.000111400	0.000130800	0.000099600	0.000087300	0.000096200	0.000096000	0.000088900	0.000098500	0.000098000	0.000101900	0.000084200	0.000094800	0.000072200	0.000078400	0.000096200	0.000089700	0.000087300	0.000098900
C16H28O5	300.193693	1.750	0.312	0.00	0.0000	0.0000	0.04	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000024100	0.000028200	0.000050400	0.000038300	0.000053600	0.000059100	0.000042200	0.000031800	0.000025700	0.000030200	0.000022800	0.000027500	0.000026900	0.000057300	0.000059300	0.000062700	0.000046300	0.000046900	0.000061000	0.000041100	0.000042600	0.000060200	0.000055700	0.000028300	0.000028300	0.000040500	0.000053100	0.000029400	0.000026500	0.000031800	0.000029200	0.000032600	0.000026000	0.000027900	0.000028100
C14H7NO7	301.022261	0.500	0.500	0.07	0.0000	0.0000	0.79	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000019500	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000028400	0.000019200	0.000000000	0.000000000	0.000026300	0.000028200
C11H11NO7S	301.025603	1.000	0.636	0.09	0.0909	0.0000	0.27	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000024300	0.000000000	0.000026600	0.000028100	0.000000000	0.000022900	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000019300	0.000000000	0.000024300	0.000031200	0.000000000	0.000018200	0.000018500	0.000019400	0.000022200	0.000019400	0.000000000	0.000023000	0.000020400	0.000023200	0.000027300	0.000025900	0.000019300	0.000019100	0.000023100	0.000034800	0.000000000	0.000000000
C15H11NO4S	301.040944	0.733	0.267	0.07	0.0667	0.0000	0.64	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000034300	0.000000000	0.000000000	0.000032800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000000000	0.000000000	0.000000000	0.000024100	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022600	0.000023900	0.000000000	0.000000000	0.000000000	0.000020700	0.000028100	0.000000000	0.000000000	0.000027700	0.000021900	0.000000000	0.000000000
C15H11NO6	301.058620	0.733	0.400	0.07	0.0000	0.0000	0.64	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000100500	0.000047900	0.000065800	0.000093400	0.000067400	0.000070400	0.000074500	0.000045600	0.000074800	0.000051600	0.000049700	0.000054600	0.000061300	0.000065000	0.000047500	0.000067500	0.000064200	0.000064100	0.000051400	0.000069200	0.000062900	0.000070100	0.000067300	0.000080100	0.000084900	0.000066100	0.000063500	0.000096600	0.000084800	0.000066100	0.000061400	0.000102500	0.000104800	0.000082500	0.000077600
C12H15NO6S	301.061993	1.250	0.500	0.08	0.0833	0.0000	0.14	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000067800	0.000018500	0.000099900	0.000091000	0.000061100	0.000072800	0.000065900	0.000037300	0.000045000	0.000025100	0.000025300	0.000027700	0.000022900	0.000070300	0.000049400	0.000082500	0.000100400	0.000058800	0.000056800	0.000088400	0.000092100	0.000135100	0.000140200	0.000055600	0.000055500	0.000084700	0.000070300	0.000097600	0.000097300	0.000023300	0.000026200	0.000080000	0.000072300	0.000024800	0.000018400
C16H15NO3S	301.077332	0.938	0.188	0.06	0.0625	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000025100	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023000	0.000030600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C12H15NO8	301.079806	1.250	0.667	0.08	0.0000	0.0000	0.14	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000048000	0.000031200	0.000028000	0.000046100	0.000022200	0.000036500	0.000036000	0.000028000	0.000042700	0.000035000	0.000029300	0.000028700	0.000041800	0.000045300	0.000028900	0.000029900	0.000041900	0.000052900	0.000036800	0.000031300	0.000031400	0.000028100	0.000043800	0.000041900	0.000046500	0.000037500	0.000040000	0.000047300	0.000047800	0.000086600	0.000080700	0.000060300	0.000045600	0.000054700	0.000040300
C16H15NO5	301.095024	0.938	0.312	0.06	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000140100	0.000078600	0.000127900	0.000153100	0.000115600	0.000109700	0.000122200	0.000088900	0.000085200	0.000082200	0.000075600	0.000086300	0.000077600	0.000112300	0.000123700	0.000137700	0.000141300	0.000094900	0.000105900	0.000127900	0.000115900	0.000166200	0.000155800	0.000109100	0.000109700	0.000114200	0.000110600	0.000154800	0.000148100	0.000076600	0.000081800	0.000146200	0.000143800	0.000088200	0.000086200
C13H19NO5S	301.098420	1.462	0.385	0.08	0.0769	0.0000	0.06	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000041500	0.000000000	0.000081800	0.000057800	0.000046800	0.000043700	0.000043300	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000039200	0.000042600	0.000064300	0.000063900	0.000034000	0.000033100	0.000067100	0.000067300	0.000102200	0.000113500	0.000029500	0.000030900	0.000050300	0.000064100	0.000056800	0.000060600	0.000000000	0.000000000	0.000051000	0.000049000	0.000000000	0.000000000
C15H15N3O4	301.106199	1.000	0.267	0.20	0.0000	0.0000	0.50	10	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022100	0.000000000	0.000000000	0.000000000
C13H19NO7	301.116152	1.462	0.538	0.08	0.0000	0.0000	0.06	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000108700	0.000072600	0.000148700	0.000133400	0.000127200	0.000128000	0.000124300	0.000080600	0.000082100	0.000066800	0.000057700	0.000072900	0.000074200	0.000122700	0.000120600	0.000163300	0.000147600	0.000134000	0.000135300	0.000142500	0.000132400	0.000183500	0.000193500	0.000106800	0.000107000	0.000149300	0.000148200	0.000131600	0.000135000	0.000130800	0.000147500	0.000115300	0.000113700	0.000088500	0.000083400
C17H19NO4	301.131447	1.118	0.235	0.06	0.0000	0.0000	0.43	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000053700	0.000036100	0.000067500	0.000076900	0.000051600	0.000064300	0.000071700	0.000050000	0.000037100	0.000034700	0.000034300	0.000044900	0.000036200	0.000067300	0.000079600	0.000068900	0.000080100	0.000061800	0.000058700	0.000057900	0.000065100	0.000091600	0.000078700	0.000038000	0.000050900	0.000053800	0.000062300	0.000060900	0.000064000	0.000038600	0.000043200	0.000062400	0.000060800	0.000033100	0.000032900
C14H23NO6	301.152532	1.643	0.429	0.07	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000032800	0.000000000	0.000042400	0.000037800	0.000028600	0.000034800	0.000034700	0.000024800	0.000023600	0.000000000	0.000000000	0.000024200	0.000000000	0.000027600	0.000037500	0.000039800	0.000047400	0.000028900	0.000044000	0.000039200	0.000041600	0.000052500	0.000057900	0.000000000	0.000022700	0.000038200	0.000033200	0.000038200	0.000039900	0.000034000	0.000029800	0.000026800	0.000023800	0.000000000	0.000021300
C18H23NO3	301.167857	1.278	0.167	0.06	0.0000	0.0000	0.35	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023300	0.000000000	0.000022400	0.000023900	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000
C11H10O6S2	301.991881	0.909	0.545	0.00	0.1818	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000025100	0.000000000	0.000036400	0.000028700	0.000025000	0.000027200	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000024700	0.000000000	0.000029900	0.000027100	0.000027700	0.000000000	0.000029900	0.000027900	0.000036600	0.000027200	0.000019500	0.000023200	0.000023800	0.000031900	0.000039500	0.000037700	0.000000000	0.000000000	0.000027700	0.000031500	0.000000000	0.000000000
C14H6O8	302.006314	0.429	0.571	0.00	0.0000	0.0000	0.80	12	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000049000	0.000034400
C11H10O8S	302.009654	0.909	0.727	0.00	0.0909	0.0000	0.33	7	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000022000	0.000000000	0.000020500	0.000021100	0.000023100	0.000024300	0.000028800	0.000000000	0.000021700	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000021400	0.000026100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000018700	0.000018500	0.000000000	0.000020000	0.000025100	0.000029900	0.000018900	0.000000000	0.000026800	0.000000000	0.000022200
C15H10O5S	302.024917	0.667	0.333	0.00	0.0667	0.0000	0.65	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000052400	0.000000000	0.000038000	0.000055900	0.000031700	0.000033800	0.000036600	0.000020500	0.000031200	0.000020600	0.000027000	0.000021300	0.000022300	0.000023200	0.000029600	0.000038700	0.000042700	0.000022500	0.000020900	0.000034700	0.000022300	0.000033200	0.000033400	0.000036200	0.000035800	0.000030100	0.000027000	0.000060600	0.000061600	0.000000000	0.000000000	0.000066200	0.000064200	0.000019400	0.000022900
C12H14O5S2	302.028316	1.167	0.417	0.00	0.1667	0.0000	0.20	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000049600	0.000000000	0.000091100	0.000083400	0.000046200	0.000056300	0.000041200	0.000025900	0.000019100	0.000000000	0.000000000	0.000029800	0.000000000	0.000039500	0.000042800	0.000084800	0.000082600	0.000038700	0.000028400	0.000070700	0.000078500	0.000111700	0.000108400	0.000035300	0.000037600	0.000055300	0.000049500	0.000083800	0.000081900	0.000000000	0.000000000	0.000050300	0.000051200	0.000000000	0.000000000
C15H10O7	302.042661	0.667	0.467	0.00	0.0000	0.0000	0.65	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000175400	0.000117900	0.000105000	0.000103300	0.000100300	0.000113500	0.000118300	0.000129100	0.000146600	0.000131600	0.000133200	0.000123700	0.000133100	0.000075300	0.000064700	0.000075900	0.000075900	0.000102400	0.000078200	0.000142600	0.000138300	0.000074000	0.000062700	0.000153000	0.000164600	0.000104400	0.000102100	0.000125200	0.000121800	0.000173600	0.000157100	0.000170500	0.000186000	0.000308400	0.000279900
C12H14O7S	302.046014	1.167	0.583	0.00	0.0833	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000165200	0.000086300	0.000145400	0.000186500	0.000145000	0.000149800	0.000146200	0.000104800	0.000121500	0.000099000	0.000089800	0.000089100	0.000102000	0.000136000	0.000099200	0.000179000	0.000172800	0.000165300	0.000138500	0.000156400	0.000146300	0.000162100	0.000184000	0.000140400	0.000159500	0.000156300	0.000151800	0.000232000	0.000219000	0.000101200	0.000097300	0.000164900	0.000190400	0.000075800	0.000070300
C14H10N2O6	302.053887	0.714	0.429	0.14	0.0000	0.0000	0.67	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000026300	0.000021400	0.000019500	0.000029800	0.000000000	0.000018800	0.000023800	0.000019800	0.000032000	0.000027300	0.000022100	0.000018200	0.000025200	0.000018000	0.000000000	0.000000000	0.000020500	0.000023400	0.000021500	0.000000000	0.000024800	0.000020800	0.000022600	0.000029700	0.000027300	0.000028700	0.000027600	0.000032300	0.000026900	0.000031800	0.000023500	0.000030400	0.000034100	0.000035100	0.000030600
C19H10O4	302.057946	0.526	0.211	0.00	0.0000	0.0000	0.76	15	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000020400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000023500	0.000025700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027600	0.000000000	0.000000000	0.000000000	0.000000000	0.000028900	0.000020700	0.000000000	0.000000000	0.000035000	0.000039300
C16H14O4S	302.061338	0.875	0.250	0.00	0.0625	0.0000	0.54	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000070700	0.000025200	0.000061600	0.000090100	0.000053100	0.000058500	0.000050600	0.000034200	0.000031100	0.000026900	0.000026000	0.000020600	0.000023800	0.000055100	0.000049800	0.000082700	0.000076500	0.000038700	0.000039600	0.000048100	0.000041800	0.000074800	0.000068900	0.000039100	0.000054000	0.000052100	0.000042400	0.000092200	0.000091000	0.000000000	0.000018300	0.000077200	0.000065300	0.000000000	0.000000000
C12H14O9	302.063846	1.167	0.750	0.00	0.0000	0.0000	0.20	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000139300	0.000091900	0.000064400	0.000088700	0.000081000	0.000107400	0.000095100	0.000096400	0.000155600	0.000106000	0.000093100	0.000094900	0.000124400	0.000112100	0.000052500	0.000065300	0.000076200	0.000120500	0.000089200	0.000105800	0.000103000	0.000061100	0.000072400	0.000130800	0.000182400	0.000109900	0.000096100	0.000131600	0.000128000	0.000378000	0.000301100	0.000163300	0.000157000	0.000238800	0.000224200
C13H18O4S2	302.064720	1.385	0.308	0.00	0.1538	0.0000	0.11	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000019400	0.000000000	0.000035300	0.000025500	0.000028400	0.000020700	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021700	0.000034100	0.000045100	0.000018200	0.000018200	0.000035000	0.000028800	0.000040400	0.000050500	0.000000000	0.000000000	0.000022400	0.000028200	0.000039500	0.000032500	0.000000000	0.000000000	0.000035000	0.000023200	0.000000000	0.000000000
C16H14O6	302.079026	0.875	0.375	0.00	0.0000	0.0000	0.54	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000526700	0.000389000	0.000457000	0.000463800	0.000434500	0.000440300	0.000407400	0.000413900	0.000428900	0.000407300	0.000411300	0.000409600	0.000404800	0.000422200	0.000372200	0.000420700	0.000425900	0.000429000	0.000382000	0.000461300	0.000464600	0.000438900	0.000432800	0.000446600	0.000476600	0.000420100	0.000414700	0.000480500	0.000486400	0.000374300	0.000373700	0.000501400	0.000534100	0.000497400	0.000513800
C13H18O6S	302.082393	1.385	0.462	0.00	0.0769	0.0000	0.11	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000215900	0.000157600	0.000309100	0.000299600	0.000247800	0.000245700	0.000240600	0.000175600	0.000180700	0.000160800	0.000132300	0.000163900	0.000162000	0.000239100	0.000227500	0.000317700	0.000322300	0.000245700	0.000252200	0.000282400	0.000279900	0.000342900	0.000362500	0.000192400	0.000204400	0.000282400	0.000254300	0.000299300	0.000284400	0.000124500	0.000124900	0.000224100	0.000216400	0.000092500	0.000092500
C15H14N2O5	302.090303	0.933	0.333	0.13	0.0000	0.0000	0.52	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000078300	0.000056100	0.000064000	0.000073100	0.000061400	0.000062700	0.000057300	0.000047000	0.000057700	0.000054900	0.000051600	0.000060600	0.000064700	0.000060900	0.000061400	0.000066000	0.000068400	0.000059900	0.000055900	0.000062900	0.000062200	0.000078300	0.000070100	0.000066700	0.000070400	0.000072600	0.000069000	0.000077800	0.000074800	0.000061600	0.000074400	0.000079300	0.000076200	0.000061300	0.000064200
C20H14O3	302.094349	0.700	0.150	0.00	0.0000	0.0000	0.68	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000	0.000000000	0.000020800	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000000000	0.000000000	0.000027200	0.000029700
C13H18O8	302.100228	1.385	0.615	0.00	0.0000	0.0000	0.11	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000779100	0.000778200	0.000692700	0.000840100	0.000760100	0.000823100	0.000767500	0.000741400	0.000885600	0.000777500	0.000678300	0.000734000	0.000771200	0.000892200	0.000734100	0.000846000	0.000869100	0.001023300	0.000939700	0.000751700	0.000753200	0.000711400	0.000789600	0.000921400	0.000950700	0.000918700	0.000878100	0.000907000	0.000904200	0.001565300	0.001447500	0.000897000	0.000809500	0.000907400	0.000896600
C12H18N2O7	302.111385	1.500	0.583	0.17	0.0000	0.0000	0.00	5	0	0	0	0	0	0	1	1	0	1	0	0	0	1	0	0	0	0	0	0.000026700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024300	0.000000000	0.000026300	0.000000000	0.000022000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000036800	0.000033700	0.000000000	0.000000000	0.000000000	0.000018900
C17H18O5	302.115410	1.059	0.294	0.00	0.0000	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000442700	0.000554000	0.000585900	0.000494200	0.000644200	0.000606200	0.000561800	0.000600000	0.000542700	0.000574000	0.000539900	0.000573000	0.000500400	0.000586800	0.000663100	0.000576000	0.000545900	0.000564100	0.000605100	0.000579200	0.000551100	0.000631500	0.000626300	0.000492300	0.000480900	0.000558300	0.000533900	0.000495100	0.000490700	0.000355600	0.000376800	0.000476200	0.000498000	0.000451700	0.000482800
C14H22O5S	302.118795	1.571	0.357	0.00	0.0714	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000089500	0.000074500	0.000133700	0.000130900	0.000112800	0.000120600	0.000121500	0.000088200	0.000070500	0.000084000	0.000090200	0.000079700	0.000075900	0.000114900	0.000120400	0.000154800	0.000154000	0.000118200	0.000121100	0.000126900	0.000128400	0.000163000	0.000172700	0.000071200	0.000087200	0.000118000	0.000114900	0.000126300	0.000121100	0.000061500	0.000055700	0.000097600	0.000098200	0.000051300	0.000057800
C16H18N2O4	302.126714	1.125	0.250	0.13	0.0000	0.0000	0.42	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000057500	0.000060300	0.000063100	0.000077100	0.000062100	0.000061200	0.000054900	0.000048300	0.000058700	0.000040000	0.000046500	0.000058200	0.000047800	0.000067700	0.000070600	0.000077200	0.000066700	0.000056100	0.000061600	0.000053900	0.000063600	0.000079800	0.000073200	0.000050200	0.000060600	0.000062000	0.000068900	0.000073400	0.000071300	0.000055900	0.000065400	0.000072300	0.000061100	0.000052200	0.000049800
C14H22O7	302.136582	1.571	0.500	0.00	0.0000	0.0000	0.05	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000500800	0.000646000	0.000764300	0.000686100	0.000786500	0.000730100	0.000734500	0.000653500	0.000606100	0.000566300	0.000533100	0.000645600	0.000561300	0.000767600	0.000859100	0.000922000	0.000874000	0.000888900	0.000990000	0.000752200	0.000701000	0.000798100	0.000826800	0.000678000	0.000611800	0.000800100	0.000837900	0.000681600	0.000680300	0.000823700	0.000804900	0.000602100	0.000552500	0.000536400	0.000557500
C18H22O4	302.151815	1.222	0.222	0.00	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000235100	0.000366900	0.000335800	0.000310100	0.000383100	0.000377700	0.000367500	0.000451200	0.000378900	0.000426100	0.000377800	0.000420800	0.000324200	0.000401400	0.000480900	0.000419300	0.000380300	0.000395900	0.000463300	0.000347000	0.000336700	0.000350800	0.000343000	0.000301500	0.000299700	0.000348800	0.000343800	0.000308600	0.000304400	0.000231900	0.000233800	0.000309200	0.000271900	0.000273300	0.000303000
C15H26O4S	302.155220	1.733	0.267	0.00	0.0667	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	1	0	0	0	0	0	0	0.000028300	0.000027400	0.000023300	0.000018600	0.000020900	0.000024700	0.000021600	0.000021000	0.000000000	0.000024000	0.000000000	0.000019400	0.000000000	0.000022900	0.000023300	0.000036600	0.000028400	0.000028200	0.000025300	0.000029200	0.000028400	0.000022100	0.000025500	0.000000000	0.000018400	0.000021000	0.000027200	0.000026100	0.000027800	0.000018900	0.000000000	0.000022900	0.000022000	0.000000000	0.000000000
C17H22N2O3	302.163047	1.294	0.176	0.12	0.0000	0.0000	0.33	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C15H26O6	302.172936	1.733	0.400	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000067100	0.000089700	0.000145200	0.000111200	0.000133900	0.000134900	0.000135700	0.000097600	0.000096500	0.000078700	0.000083400	0.000100200	0.000084700	0.000142300	0.000153000	0.000169200	0.000151700	0.000148600	0.000180500	0.000142800	0.000120800	0.000156200	0.000145100	0.000097000	0.000080700	0.000131200	0.000143400	0.000108100	0.000107100	0.000114100	0.000103200	0.000088800	0.000084300	0.000080300	0.000076100
C19H26O3	302.188227	1.368	0.158	0.00	0.0000	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000047200	0.000096100	0.000060800	0.000066100	0.000080400	0.000080900	0.000074600	0.000103100	0.000098300	0.000106400	0.000103200	0.000108100	0.000078800	0.000094700	0.000122200	0.000076400	0.000080000	0.000082600	0.000103000	0.000072200	0.000073400	0.000070200	0.000072200	0.000068000	0.000075200	0.000068500	0.000075700	0.000071700	0.000070100	0.000061500	0.000057900	0.000075800	0.000060300	0.000057700	0.000060500
C14H9NO5S	303.020123	0.643	0.357	0.07	0.0714	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000022100	0.000000000	0.000000000	0.000027000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000033600	0.000029200	0.000000000	0.000000000	0.000022200	0.000029700	0.000000000	0.000000000
C14H9NO7	303.037979	0.643	0.500	0.07	0.0000	0.0000	0.68	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000030600	0.000019100	0.000000000	0.000025200	0.000023900	0.000000000	0.000020700	0.000018200	0.000031600	0.000000000	0.000020000	0.000022400	0.000030600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000020300	0.000024200	0.000023300	0.000024200	0.000000000	0.000031300	0.000027500	0.000020000	0.000030800	0.000037000	0.000031100
C11H13NO7S	303.041299	1.182	0.636	0.09	0.0909	0.0000	0.09	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000029800	0.000000000	0.000022600	0.000038300	0.000026300	0.000025900	0.000026300	0.000000000	0.000025000	0.000022700	0.000000000	0.000000000	0.000022900	0.000031100	0.000000000	0.000028300	0.000034200	0.000028600	0.000020700	0.000028800	0.000027800	0.000035100	0.000041100	0.000000000	0.000039700	0.000037600	0.000024500	0.000054900	0.000052600	0.000000000	0.000000000	0.000035900	0.000044900	0.000000000	0.000000000
C18H9NO4	303.053111	0.500	0.222	0.06	0.0000	0.0000	0.80	15	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021200	0.000000000
C15H13NO4S	303.056535	0.867	0.267	0.07	0.0667	0.0000	0.55	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000042500	0.000018000	0.000025300	0.000052500	0.000028300	0.000032200	0.000030000	0.000018900	0.000000000	0.000019600	0.000000000	0.000000000	0.000019600	0.000029500	0.000033200	0.000043100	0.000047600	0.000022900	0.000022300	0.000037600	0.000018800	0.000041200	0.000038700	0.000032200	0.000026200	0.000028700	0.000019400	0.000056500	0.000051100	0.000000000	0.000000000	0.000050000	0.000051600	0.000018900	0.000000000
C15H13NO6	303.074310	0.867	0.400	0.07	0.0000	0.0000	0.55	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000154900	0.000085200	0.000113100	0.000143600	0.000107600	0.000110000	0.000110800	0.000083200	0.000095800	0.000084900	0.000081400	0.000094000	0.000088600	0.000116600	0.000089700	0.000115600	0.000108400	0.000102100	0.000092500	0.000107300	0.000107900	0.000129200	0.000129300	0.000127700	0.000122500	0.000105100	0.000113000	0.000152700	0.000144700	0.000086900	0.000087100	0.000148800	0.000152900	0.000105600	0.000101800
C12H17NO6S	303.077655	1.417	0.500	0.08	0.0833	0.0000	0.00	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000063100	0.000025300	0.000118300	0.000088500	0.000065400	0.000061300	0.000064600	0.000033000	0.000029900	0.000000000	0.000000000	0.000020000	0.000025900	0.000051800	0.000049000	0.000083900	0.000088500	0.000047800	0.000059500	0.000101100	0.000093800	0.000131600	0.000143800	0.000042600	0.000044800	0.000071200	0.000077500	0.000073000	0.000081300	0.000030400	0.000031600	0.000063800	0.000064800	0.000019600	0.000000000
C14H13N3O5	303.085428	0.929	0.357	0.21	0.0000	0.0000	0.53	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020000	0.000018800	0.000019900
C16H17NO3S	303.092965	1.062	0.188	0.06	0.0625	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000019600	0.000022300	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023900	0.000025000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026700	0.000019400	0.000000000	0.000020800	0.000000000	0.000000000	0.000019600	0.000024600	0.000000000	0.000000000	0.000025900	0.000000000	0.000000000	0.000000000
C12H17NO8	303.095478	1.417	0.667	0.08	0.0000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000022800	0.000020200	0.000019400	0.000032800	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026900	0.000024200	0.000000000	0.000027300	0.000026400	0.000027400	0.000000000	0.000018700	0.000023300	0.000022400	0.000018900	0.000019500	0.000021500	0.000029100	0.000027100	0.000027900	0.000019800	0.000046600	0.000032000	0.000019400	0.000022300	0.000000000	0.000000000
C16H17NO5	303.110669	1.062	0.312	0.06	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000167500	0.000101500	0.000187700	0.000173000	0.000167100	0.000156200	0.000156300	0.000126400	0.000110100	0.000100800	0.000100300	0.000112500	0.000103800	0.000161300	0.000169300	0.000194400	0.000177500	0.000132800	0.000147900	0.000166700	0.000169400	0.000235600	0.000236300	0.000130300	0.000135500	0.000152600	0.000152000	0.000189100	0.000185600	0.000105500	0.000114900	0.000164900	0.000181700	0.000095600	0.000098600
C13H21NO5S	303.114032	1.615	0.385	0.08	0.0769	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000023200	0.000028000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000026300	0.000027800	0.000000000	0.000000000	0.000000000	0.000023700	0.000035400	0.000032100	0.000000000	0.000000000	0.000020800	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000022300	0.000021100	0.000000000	0.000000000
C15H17N3O4	303.121871	1.133	0.267	0.20	0.0000	0.0000	0.40	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000021900	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000000000	0.000018200	0.000024000	0.000029200	0.000000000	0.000000000	0.000025000
C13H21NO7	303.131878	1.615	0.538	0.08	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	1	0	0	0	0	0	0.000021600	0.000000000	0.000030900	0.000021500	0.000028800	0.000018800	0.000020000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021900	0.000020700	0.000026600	0.000034400	0.000026500	0.000028300	0.000026500	0.000027600	0.000036600	0.000032400	0.000023900	0.000023100	0.000022500	0.000031300	0.000022800	0.000024400	0.000032400	0.000033000	0.000023700	0.000000000	0.000000000	0.000000000
C17H21NO4	303.147041	1.235	0.235	0.06	0.0000	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000057400	0.000039500	0.000080400	0.000066100	0.000074200	0.000072900	0.000069500	0.000053700	0.000046000	0.000044500	0.000047600	0.000058100	0.000037000	0.000063100	0.000089800	0.000087000	0.000077300	0.000065500	0.000069700	0.000075000	0.000067100	0.000099300	0.000109900	0.000057200	0.000053800	0.000066300	0.000059300	0.000072400	0.000063300	0.000050700	0.000041100	0.000065200	0.000071600	0.000039500	0.000036000
C18H25NO3	303.183427	1.389	0.167	0.06	0.0000	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H8O6S	304.004160	0.571	0.429	0.00	0.0714	0.0000	0.70	11	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000035700	0.000000000	0.000020400	0.000020600	0.000000000	0.000020600	0.000000000	0.000000000	0.000024900	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000022300	0.000019700	0.000000000	0.000000000	0.000026900	0.000026400	0.000000000	0.000000000	0.000019300	0.000032100	0.000000000	0.000021300
C11H12O6S2	304.007584	1.091	0.545	0.00	0.1818	0.0000	0.17	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000046900	0.000000000	0.000066200	0.000052200	0.000034000	0.000032900	0.000032000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000040800	0.000022600	0.000048700	0.000044600	0.000034600	0.000026600	0.000060900	0.000055500	0.000079300	0.000069300	0.000027100	0.000020600	0.000042900	0.000035200	0.000059300	0.000058200	0.000000000	0.000000000	0.000042400	0.000036500	0.000000000	0.000000000
C14H8O8	304.021923	0.571	0.571	0.00	0.0000	0.0000	0.70	11	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000048900	0.000031700	0.000025200	0.000000000	0.000000000	0.000024800	0.000032500	0.000028700	0.000039700	0.000040500	0.000035600	0.000027400	0.000041100	0.000000000	0.000000000	0.000000000	0.000000000	0.000018400	0.000000000	0.000041500	0.000032700	0.000000000	0.000000000	0.000040400	0.000037600	0.000020200	0.000025800	0.000023000	0.000022400	0.000057700	0.000046700	0.000035200	0.000042800	0.000136900	0.000116500
C15H12O3S2	304.022792	0.800	0.200	0.00	0.1333	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019800	0.000000000	0.000000000	0.000020100	0.000000000	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000025100	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000
C11H12O8S	304.025275	1.091	0.727	0.00	0.0909	0.0000	0.17	6	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000040900	0.000021100	0.000000000	0.000028700	0.000025600	0.000030700	0.000028500	0.000024800	0.000030100	0.000024400	0.000019700	0.000020000	0.000023300	0.000018200	0.000000000	0.000021700	0.000028800	0.000025100	0.000019200	0.000026400	0.000024600	0.000000000	0.000000000	0.000034700	0.000043600	0.000027400	0.000027600	0.000042400	0.000036100	0.000024000	0.000019000	0.000043400	0.000050100	0.000027500	0.000030900
C18H8O5	304.037128	0.444	0.278	0.00	0.0000	0.0000	0.81	15	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000000000	0.000019100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000035100	0.000033900
C15H12O5S	304.040601	0.800	0.333	0.00	0.0667	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000112800	0.000034900	0.000108900	0.000150400	0.000096900	0.000087700	0.000082300	0.000050100	0.000045800	0.000034800	0.000033000	0.000029500	0.000040600	0.000084800	0.000068000	0.000125200	0.000127800	0.000066800	0.000061900	0.000095400	0.000094500	0.000132300	0.000133000	0.000074600	0.000084900	0.000077400	0.000072100	0.000136800	0.000131900	0.000018800	0.000000000	0.000110300	0.000103100	0.000023200	0.000024500
C12H16O5S2	304.043989	1.333	0.417	0.00	0.1667	0.0000	0.07	5	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000035800	0.000000000	0.000074300	0.000061800	0.000046800	0.000038900	0.000036900	0.000000000	0.000021900	0.000000000	0.000000000	0.000023000	0.000000000	0.000037700	0.000036400	0.000065300	0.000075400	0.000027100	0.000029700	0.000064000	0.000061300	0.000094600	0.000094300	0.000022700	0.000023200	0.000051600	0.000042700	0.000065700	0.000059600	0.000000000	0.000000000	0.000048000	0.000037700	0.000000000	0.000000000
C15H12O7	304.058289	0.800	0.467	0.00	0.0000	0.0000	0.57	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000427200	0.000310500	0.000289700	0.000313500	0.000280700	0.000300400	0.000299100	0.000303500	0.000351800	0.000321200	0.000321200	0.000299000	0.000360400	0.000240800	0.000193100	0.000234800	0.000239900	0.000303700	0.000250000	0.000340500	0.000331500	0.000229700	0.000240400	0.000363800	0.000411200	0.000284000	0.000283600	0.000344100	0.000350300	0.000357100	0.000343400	0.000397800	0.000446100	0.000510000	0.000521000
C12H16O7S	304.061660	1.333	0.583	0.00	0.0833	0.0000	0.07	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000189900	0.000117400	0.000179700	0.000249600	0.000180100	0.000186700	0.000173500	0.000141100	0.000146700	0.000124700	0.000117900	0.000118900	0.000135700	0.000165700	0.000137700	0.000233700	0.000242500	0.000181700	0.000178500	0.000178700	0.000173500	0.000195100	0.000203100	0.000173300	0.000187300	0.000205700	0.000186500	0.000277000	0.000259100	0.000119300	0.000102100	0.000195700	0.000205000	0.000085000	0.000086400
C14H12N2O6	304.069560	0.857	0.429	0.14	0.0000	0.0000	0.56	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000060800	0.000043900	0.000046300	0.000048500	0.000043100	0.000052300	0.000049400	0.000039900	0.000039100	0.000041900	0.000044000	0.000036900	0.000050800	0.000049400	0.000037500	0.000040800	0.000042600	0.000047900	0.000028500	0.000038900	0.000041300	0.000047300	0.000047100	0.000053700	0.000055500	0.000043100	0.000045800	0.000051800	0.000048900	0.000056900	0.000053900	0.000063500	0.000059000	0.000056800	0.000048300
C19H12O4	304.073610	0.632	0.211	0.00	0.0000	0.0000	0.71	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000030500	0.000019100	0.000000000	0.000025500	0.000018300	0.000025400	0.000000000	0.000030300	0.000033200	0.000034300	0.000032700	0.000027400	0.000042000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000030200	0.000000000	0.000000000	0.000032400	0.000034400	0.000000000	0.000000000	0.000028000	0.000028300	0.000042800	0.000033300	0.000042300	0.000040500	0.000057600	0.000060900
C16H16O4S	304.076983	1.000	0.250	0.00	0.0625	0.0000	0.46	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000064400	0.000035200	0.000075000	0.000106400	0.000070600	0.000061400	0.000073300	0.000039400	0.000031700	0.000028400	0.000027400	0.000036200	0.000036300	0.000057700	0.000063200	0.000109300	0.000109100	0.000047600	0.000053900	0.000074600	0.000064500	0.000104700	0.000095300	0.000043000	0.000050800	0.000062300	0.000056100	0.000086300	0.000094300	0.000018200	0.000000000	0.000075200	0.000069100	0.000000000	0.000000000
C12H16O9	304.079494	1.333	0.750	0.00	0.0000	0.0000	0.07	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000067100	0.000053300	0.000043400	0.000059100	0.000052200	0.000062700	0.000066200	0.000063600	0.000085700	0.000061100	0.000052200	0.000062300	0.000073800	0.000071500	0.000032000	0.000048000	0.000056800	0.000092400	0.000064800	0.000054000	0.000059100	0.000046100	0.000043700	0.000077400	0.000109600	0.000060900	0.000068300	0.000087000	0.000086300	0.000219000	0.000160800	0.000090900	0.000095300	0.000120100	0.000108000
C13H20O4S2	304.080359	1.538	0.308	0.00	0.1538	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000047100	0.000034100	0.000000000	0.000022500	0.000020300	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000020700	0.000032300	0.000034900	0.000019900	0.000024600	0.000043700	0.000047500	0.000050900	0.000058000	0.000000000	0.000000000	0.000000000	0.000025700	0.000032700	0.000036300	0.000000000	0.000000000	0.000028000	0.000000000	0.000000000	0.000000000
C16H16O6	304.094675	1.000	0.375	0.00	0.0000	0.0000	0.46	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000764900	0.000757600	0.000854000	0.000769500	0.000871300	0.000838200	0.000781400	0.000773800	0.000745100	0.000755600	0.000740700	0.000752000	0.000726800	0.000831000	0.000822900	0.000792000	0.000777000	0.000771900	0.000771000	0.000831600	0.000836900	0.000865700	0.000851400	0.000755800	0.000761500	0.000785900	0.000766600	0.000761300	0.000791300	0.000596000	0.000607200	0.000748300	0.000775100	0.000725400	0.000732300
C13H20O6S	304.098051	1.538	0.462	0.00	0.0769	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000178000	0.000155700	0.000302700	0.000257300	0.000251300	0.000261700	0.000252300	0.000173100	0.000158100	0.000149500	0.000142600	0.000150800	0.000144500	0.000212600	0.000228100	0.000305300	0.000303900	0.000229900	0.000254600	0.000294900	0.000273400	0.000334100	0.000365700	0.000189300	0.000182000	0.000257500	0.000243500	0.000257900	0.000265700	0.000157500	0.000156300	0.000195000	0.000193500	0.000099200	0.000101400
C15H16N2O5	304.105960	1.067	0.333	0.13	0.0000	0.0000	0.43	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000112400	0.000086000	0.000091000	0.000104600	0.000088700	0.000089400	0.000100300	0.000084000	0.000080800	0.000076700	0.000077900	0.000096200	0.000078500	0.000092100	0.000087300	0.000106100	0.000116700	0.000095100	0.000093400	0.000096500	0.000092300	0.000125900	0.000123800	0.000089600	0.000100800	0.000105800	0.000100700	0.000112500	0.000105600	0.000110500	0.000107600	0.000121600	0.000103400	0.000086000	0.000090700
C20H16O3	304.110012	0.800	0.150	0.00	0.0000	0.0000	0.62	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000021600	0.000020100	0.000000000	0.000018100	0.000000000	0.000023000	0.000023000	0.000031200	0.000029800	0.000023200	0.000018400	0.000021200	0.000000000	0.000020200	0.000023000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021000	0.000000000	0.000018300	0.000020300	0.000018900	0.000023500	0.000034500	0.000025200
C17H20O3S	304.113385	1.176	0.176	0.00	0.0588	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000029500	0.000000000	0.000000000	0.000021800	0.000021400	0.000021100	0.000000000	0.000026300	0.000000000	0.000000000	0.000022400	0.000020600	0.000028300	0.000030100	0.000019500	0.000020200	0.000000000	0.000022800	0.000025700	0.000024300	0.000018500	0.000000000	0.000022300	0.000019700	0.000021400	0.000022900	0.000000000	0.000000000	0.000026100	0.000018500	0.000000000	0.000000000
C13H20O8	304.115865	1.538	0.615	0.00	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000201900	0.000213900	0.000199800	0.000229500	0.000205800	0.000203700	0.000204100	0.000196400	0.000222000	0.000194000	0.000175500	0.000200000	0.000185800	0.000234500	0.000211000	0.000251500	0.000259100	0.000280400	0.000289800	0.000203600	0.000203900	0.000199700	0.000206900	0.000245400	0.000244900	0.000275100	0.000271300	0.000235900	0.000235500	0.000453600	0.000435700	0.000223700	0.000197000	0.000251700	0.000258000
C17H20O5	304.131061	1.176	0.294	0.00	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000620900	0.000863700	0.000886800	0.000717700	0.000965000	0.000906400	0.000888500	0.001003200	0.000887900	0.000934300	0.000866800	0.000895000	0.000786200	0.000959400	0.001084900	0.000942600	0.000861900	0.000939100	0.001058000	0.000879600	0.000810800	0.000941500	0.000913800	0.000724900	0.000718100	0.000868200	0.000846900	0.000717700	0.000745000	0.000548900	0.000566300	0.000684000	0.000695700	0.000666800	0.000708000
C14H24O5S	304.134450	1.714	0.357	0.00	0.0714	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000040100	0.000023100	0.000060100	0.000045900	0.000065600	0.000063800	0.000054900	0.000038100	0.000000000	0.000038700	0.000043600	0.000038600	0.000041800	0.000037800	0.000051800	0.000067600	0.000073500	0.000055300	0.000061200	0.000061100	0.000060600	0.000074000	0.000086200	0.000040100	0.000042800	0.000050200	0.000065400	0.000043300	0.000052200	0.000033900	0.000028800	0.000042700	0.000041100	0.000018600	0.000023100
C16H20N2O4	304.142373	1.250	0.250	0.13	0.0000	0.0000	0.33	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000045500	0.000034600	0.000049400	0.000059400	0.000050300	0.000041600	0.000046000	0.000037000	0.000036200	0.000030000	0.000021900	0.000035500	0.000030400	0.000049600	0.000062100	0.000059800	0.000057500	0.000052000	0.000040200	0.000051000	0.000047200	0.000072700	0.000066000	0.000041800	0.000040000	0.000052100	0.000041100	0.000060500	0.000059100	0.000041500	0.000049000	0.000048300	0.000049100	0.000028600	0.000030200
C14H24O7	304.152215	1.714	0.500	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000056700	0.000072000	0.000092100	0.000085900	0.000088800	0.000091700	0.000081400	0.000071700	0.000067000	0.000053700	0.000069800	0.000078300	0.000067000	0.000096800	0.000101700	0.000121600	0.000109200	0.000109300	0.000123500	0.000092900	0.000091900	0.000115700	0.000109200	0.000085400	0.000074400	0.000103200	0.000106400	0.000086700	0.000080700	0.000118100	0.000105400	0.000068200	0.000071700	0.000073500	0.000080400
C18H24O4	304.167475	1.333	0.222	0.00	0.0000	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000231600	0.000373900	0.000336500	0.000304100	0.000402200	0.000375600	0.000366700	0.000453200	0.000397200	0.000411900	0.000394400	0.000442100	0.000345700	0.000428200	0.000538100	0.000422500	0.000390800	0.000407100	0.000474800	0.000336600	0.000327400	0.000355600	0.000354700	0.000313900	0.000304000	0.000366900	0.000359800	0.000310800	0.000305700	0.000253000	0.000236000	0.000309400	0.000269900	0.000275000	0.000287400
C19H28O3	304.203886	1.474	0.158	0.00	0.0000	0.0000	0.26	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000036100	0.000052800	0.000030100	0.000042000	0.000044500	0.000040700	0.000039600	0.000053200	0.000047300	0.000057900	0.000056600	0.000057300	0.000039700	0.000056600	0.000069000	0.000054600	0.000049000	0.000052000	0.000051300	0.000040700	0.000034400	0.000039900	0.000033300	0.000032700	0.000046300	0.000043500	0.000039400	0.000036500	0.000042200	0.000031600	0.000037000	0.000053300	0.000034000	0.000035200	0.000036100
C14H11NO5S	305.035862	0.786	0.357	0.07	0.0714	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000040600	0.000000000	0.000022200	0.000038000	0.000022500	0.000030100	0.000026600	0.000023600	0.000020200	0.000000000	0.000000000	0.000000000	0.000021200	0.000026300	0.000000000	0.000033300	0.000022500	0.000025100	0.000000000	0.000022600	0.000025100	0.000025800	0.000029300	0.000031100	0.000027900	0.000027400	0.000024900	0.000042800	0.000033900	0.000000000	0.000018100	0.000040200	0.000027800	0.000000000	0.000000000
C14H11NO7	305.053548	0.786	0.500	0.07	0.0000	0.0000	0.58	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000091600	0.000055700	0.000056900	0.000059600	0.000055500	0.000056100	0.000056800	0.000043700	0.000053100	0.000058100	0.000045800	0.000037300	0.000055700	0.000046100	0.000030000	0.000050300	0.000054400	0.000057800	0.000047500	0.000065700	0.000048200	0.000046700	0.000057200	0.000073500	0.000074200	0.000054700	0.000050800	0.000074100	0.000077100	0.000074500	0.000059700	0.000075000	0.000091300	0.000084800	0.000082800
C11H15NO7S	305.056927	1.364	0.636	0.09	0.0909	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000027100	0.000000000	0.000030000	0.000031300	0.000025400	0.000000000	0.000020000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000031200	0.000030900	0.000025600	0.000000000	0.000027300	0.000027400	0.000021300	0.000032800	0.000000000	0.000028000	0.000019700	0.000023200	0.000034800	0.000037400	0.000000000	0.000018400	0.000033800	0.000021600	0.000000000	0.000021900
C18H11NO4	305.068865	0.611	0.222	0.06	0.0000	0.0000	0.73	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022400	0.000000000	0.000000000	0.000020400	0.000000000	0.000021400
C15H15NO4S	305.072226	1.000	0.267	0.07	0.0667	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000053100	0.000000000	0.000056000	0.000065600	0.000036600	0.000037500	0.000031700	0.000000000	0.000023900	0.000019300	0.000000000	0.000000000	0.000018300	0.000038000	0.000034900	0.000057400	0.000065400	0.000029400	0.000021400	0.000042000	0.000050100	0.000067100	0.000067700	0.000030800	0.000032000	0.000029600	0.000023700	0.000068500	0.000068700	0.000000000	0.000000000	0.000049000	0.000056100	0.000000000	0.000000000
C15H15NO6	305.089946	1.000	0.400	0.07	0.0000	0.0000	0.45	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000225100	0.000142300	0.000211000	0.000226400	0.000184700	0.000192500	0.000185800	0.000138400	0.000150300	0.000123900	0.000131800	0.000130000	0.000144300	0.000190200	0.000187200	0.000212000	0.000213600	0.000168800	0.000171000	0.000192800	0.000195200	0.000248900	0.000256800	0.000188600	0.000184900	0.000193600	0.000188400	0.000224400	0.000237500	0.000154300	0.000158900	0.000220600	0.000215200	0.000147100	0.000144400
C12H19NO6S	305.093339	1.583	0.500	0.08	0.0833	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	1	0	0	0	1	0	0	0	0	0	0.000025200	0.000023700	0.000037900	0.000034800	0.000021800	0.000035700	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020600	0.000022800	0.000031700	0.000037900	0.000025300	0.000022400	0.000023300	0.000033200	0.000048500	0.000046400	0.000000000	0.000000000	0.000021700	0.000027400	0.000020300	0.000027500	0.000021500	0.000000000	0.000019000	0.000000000	0.000000000	0.000000000
C14H15N3O5	305.101155	1.071	0.357	0.21	0.0000	0.0000	0.41	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000000000	0.000000000	0.000000000	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000021700	0.000000000	0.000020900	0.000019000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000
C19H15NO3	305.105233	0.789	0.158	0.05	0.0000	0.0000	0.64	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000024200	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000022400	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000
C16H19NO3S	305.108593	1.188	0.188	0.06	0.0625	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019000	0.000029000	0.000000000	0.000000000	0.000019400	0.000020300	0.000033600	0.000026200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024000	0.000000000	0.000000000	0.000018600	0.000019200	0.000000000	0.000000000
C12H19NO8	305.111095	1.583	0.667	0.08	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000019800	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000
C16H19NO5	305.126358	1.188	0.312	0.06	0.0000	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000128800	0.000106200	0.000169300	0.000150500	0.000150000	0.000132200	0.000142200	0.000103300	0.000099100	0.000088700	0.000086600	0.000109200	0.000090200	0.000153100	0.000162200	0.000174500	0.000177700	0.000132600	0.000134300	0.000140000	0.000150000	0.000222400	0.000197100	0.000118100	0.000104400	0.000137300	0.000146800	0.000139100	0.000142700	0.000107600	0.000112700	0.000135400	0.000113900	0.000079000	0.000086300
C15H19N3O4	305.137572	1.267	0.267	0.20	0.0000	0.0000	0.30	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019700	0.000000000	0.000000000	0.000022900	0.000000000	0.000000000	0.000000000	0.000000000	0.000020400	0.000018400	0.000000000	0.000000000	0.000000000	0.000000000
C17H23NO4	305.162765	1.353	0.235	0.06	0.0000	0.0000	0.29	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000025600	0.000030000	0.000048700	0.000032300	0.000042800	0.000041700	0.000044800	0.000030300	0.000019800	0.000029500	0.000027400	0.000029800	0.000029700	0.000043400	0.000057700	0.000044600	0.000064300	0.000032900	0.000043100	0.000035900	0.000038700	0.000053900	0.000049000	0.000035800	0.000027500	0.000031100	0.000032900	0.000034400	0.000035100	0.000030900	0.000027700	0.000037200	0.000029800	0.000023300	0.000000000
C14H10O4S2	306.002058	0.714	0.286	0.00	0.1429	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000023000	0.000000000	0.000000000	0.000000000
C14H10O6S	306.019817	0.714	0.429	0.00	0.0714	0.0000	0.60	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000073700	0.000030000	0.000042000	0.000068000	0.000055200	0.000054500	0.000056800	0.000032700	0.000039000	0.000035100	0.000029500	0.000033100	0.000038600	0.000043200	0.000029600	0.000055400	0.000050000	0.000038600	0.000037800	0.000048400	0.000052600	0.000056100	0.000053900	0.000052800	0.000073200	0.000050600	0.000050100	0.000081800	0.000077900	0.000000000	0.000000000	0.000077200	0.000077900	0.000032100	0.000027700
C11H14O6S2	306.023212	1.273	0.545	0.00	0.1818	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000071100	0.000000000	0.000091100	0.000077000	0.000045700	0.000052700	0.000048100	0.000024900	0.000031900	0.000000000	0.000000000	0.000000000	0.000019600	0.000055100	0.000040900	0.000061200	0.000067700	0.000031900	0.000038600	0.000085100	0.000082500	0.000105900	0.000113600	0.000036400	0.000040700	0.000066100	0.000060500	0.000079200	0.000084900	0.000000000	0.000000000	0.000061100	0.000061800	0.000000000	0.000000000
C14H10O8	306.037596	0.714	0.571	0.00	0.0000	0.0000	0.60	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000117600	0.000102000	0.000071700	0.000060100	0.000072200	0.000074500	0.000082300	0.000088400	0.000124100	0.000101800	0.000104000	0.000091900	0.000108300	0.000048500	0.000030300	0.000039900	0.000044900	0.000079000	0.000051700	0.000096300	0.000104800	0.000034500	0.000035800	0.000108600	0.000126300	0.000073200	0.000077500	0.000078100	0.000083400	0.000144500	0.000136800	0.000110700	0.000112100	0.000256800	0.000233400
C15H14O3S2	306.038449	0.933	0.200	0.00	0.1333	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000025100	0.000000000	0.000025700	0.000027500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031400	0.000034000	0.000000000	0.000000000	0.000018500	0.000000000	0.000026500	0.000028400	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000033900	0.000000000	0.000000000	0.000024600	0.000026300	0.000000000	0.000000000
C11H14O8S	306.040947	1.273	0.727	0.00	0.0909	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000051800	0.000021600	0.000024000	0.000050900	0.000040500	0.000032700	0.000034300	0.000029200	0.000040400	0.000031800	0.000023300	0.000027300	0.000030400	0.000030600	0.000022900	0.000034700	0.000033100	0.000043700	0.000033800	0.000026500	0.000033900	0.000031200	0.000025900	0.000040700	0.000050800	0.000036900	0.000034000	0.000049400	0.000057200	0.000059500	0.000058600	0.000044600	0.000041100	0.000035800	0.000030600
C13H10N2O7	306.048805	0.769	0.538	0.15	0.0000	0.0000	0.60	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000022300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000027300	0.000025500	0.000024400	0.000019200	0.000018800	0.000022500	0.000022900	0.000022000	0.000030400	0.000023600	0.000032200
C18H10O5	306.052830	0.556	0.278	0.00	0.0000	0.0000	0.74	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000050800	0.000037500	0.000022700	0.000038100	0.000036000	0.000026900	0.000025600	0.000051000	0.000052400	0.000040700	0.000046700	0.000035100	0.000044600	0.000018600	0.000020100	0.000000000	0.000022000	0.000029600	0.000022400	0.000045800	0.000044200	0.000024300	0.000000000	0.000049000	0.000046800	0.000022700	0.000028100	0.000032800	0.000025900	0.000056100	0.000052100	0.000062400	0.000053500	0.000108100	0.000092900
C15H14O5S	306.056210	0.933	0.333	0.00	0.0667	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000153200	0.000060200	0.000196600	0.000217700	0.000139800	0.000133400	0.000134000	0.000072800	0.000077100	0.000047000	0.000062800	0.000051900	0.000062800	0.000138700	0.000131900	0.000211100	0.000199300	0.000106500	0.000106700	0.000170200	0.000165500	0.000248400	0.000253000	0.000106300	0.000109200	0.000140800	0.000140700	0.000197200	0.000201800	0.000027800	0.000028800	0.000167200	0.000150300	0.000028100	0.000026500
C12H18O5S2	306.059606	1.500	0.417	0.00	0.1667	0.0000	0.00	4	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000024100	0.000000000	0.000074800	0.000049500	0.000032700	0.000033000	0.000038600	0.000019100	0.000019200	0.000000000	0.000000000	0.000020400	0.000000000	0.000025300	0.000035500	0.000065800	0.000055200	0.000031300	0.000038700	0.000061400	0.000068900	0.000086000	0.000085000	0.000025600	0.000025500	0.000037800	0.000049600	0.000047900	0.000055000	0.000000000	0.000000000	0.000047500	0.000030000	0.000000000	0.000000000
C15H14O7	306.073967	0.933	0.467	0.00	0.0000	0.0000	0.48	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000726800	0.000621400	0.000622400	0.000619300	0.000608100	0.000644800	0.000602100	0.000591400	0.000648100	0.000661700	0.000642700	0.000600300	0.000653700	0.000600000	0.000502600	0.000562500	0.000561300	0.000635500	0.000586400	0.000655100	0.000657800	0.000558400	0.000595500	0.000697000	0.000733800	0.000636700	0.000629400	0.000680400	0.000678300	0.000656900	0.000639600	0.000701400	0.000743600	0.000755600	0.000744800
C12H18O7S	306.077315	1.500	0.583	0.00	0.0833	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	0	0	0	0	1	0	0	0	0	0	0.000167800	0.000141700	0.000207200	0.000210000	0.000202500	0.000202800	0.000193700	0.000144500	0.000159100	0.000121200	0.000118300	0.000132600	0.000145900	0.000173900	0.000156800	0.000251300	0.000250000	0.000216300	0.000193100	0.000200200	0.000191000	0.000229800	0.000239000	0.000167500	0.000182700	0.000223100	0.000211300	0.000233800	0.000221300	0.000160100	0.000146600	0.000164700	0.000160000	0.000102400	0.000105900
C14H14N2O6	306.085174	1.000	0.429	0.14	0.0000	0.0000	0.44	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000115500	0.000077400	0.000093200	0.000105500	0.000082200	0.000088800	0.000096900	0.000070000	0.000081400	0.000077300	0.000073300	0.000084900	0.000079600	0.000089400	0.000078300	0.000085800	0.000090900	0.000086000	0.000084500	0.000086100	0.000095100	0.000101500	0.000100700	0.000098200	0.000112200	0.000097000	0.000095000	0.000113600	0.000116200	0.000122400	0.000120100	0.000129700	0.000119600	0.000102100	0.000109400
C19H14O4	306.089228	0.737	0.211	0.00	0.0000	0.0000	0.65	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000065700	0.000034300	0.000037500	0.000048800	0.000043100	0.000039900	0.000041500	0.000054400	0.000054900	0.000055700	0.000050700	0.000045100	0.000051500	0.000044900	0.000039400	0.000033900	0.000032000	0.000030300	0.000038500	0.000047600	0.000046100	0.000036600	0.000034400	0.000065400	0.000069700	0.000035000	0.000035500	0.000049700	0.000048000	0.000054300	0.000049300	0.000082100	0.000075400	0.000083300	0.000077900
C16H18O4S	306.092627	1.125	0.250	0.00	0.0625	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000051000	0.000046000	0.000091300	0.000099300	0.000077900	0.000069100	0.000063500	0.000055600	0.000053000	0.000049500	0.000035700	0.000039700	0.000037400	0.000070600	0.000066400	0.000098300	0.000107100	0.000061500	0.000060900	0.000081100	0.000076800	0.000112600	0.000103800	0.000048500	0.000054000	0.000073600	0.000078600	0.000083200	0.000093000	0.000029100	0.000019000	0.000069100	0.000063100	0.000000000	0.000020000
C12H18O9	306.095163	1.500	0.750	0.00	0.0000	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022800	0.000000000	0.000000000	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023800	0.000018600	0.000021100	0.000000000	0.000024000	0.000000000	0.000020900	0.000022200	0.000000000	0.000018700	0.000026300	0.000049900	0.000041400	0.000024000	0.000019700	0.000025100	0.000028500
C13H22O4S2	306.096043	1.692	0.308	0.00	0.1538	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020200	0.000021100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C16H18O6	306.110329	1.125	0.375	0.00	0.0000	0.0000	0.38	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.001185300	0.001400600	0.001543600	0.001257600	0.001565000	0.001503200	0.001425200	0.001538600	0.001397400	0.001473300	0.001356200	0.001427300	0.001320600	0.001521900	0.001565100	0.001528800	0.001410500	0.001535800	0.001607600	0.001462000	0.001403700	0.001555500	0.001510000	0.001240300	0.001232300	0.001445600	0.001386100	0.001306100	0.001293400	0.001069700	0.001062500	0.001231200	0.001268000	0.001182600	0.001242600
C13H22O6S	306.113690	1.692	0.462	0.00	0.0769	0.0000	0.00	3	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000105700	0.000085400	0.000181200	0.000132000	0.000137300	0.000141700	0.000148200	0.000093300	0.000087900	0.000082700	0.000076100	0.000081300	0.000090400	0.000117200	0.000124500	0.000166700	0.000158900	0.000125800	0.000130900	0.000159500	0.000152500	0.000184300	0.000199100	0.000096200	0.000091400	0.000134400	0.000130300	0.000129000	0.000142500	0.000103800	0.000086000	0.000092400	0.000090500	0.000065400	0.000072300
C15H18N2O5	306.121580	1.200	0.333	0.13	0.0000	0.0000	0.33	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000127900	0.000095200	0.000126800	0.000139100	0.000116000	0.000113200	0.000106300	0.000105800	0.000091800	0.000084000	0.000074600	0.000102800	0.000091600	0.000127400	0.000129300	0.000146600	0.000140000	0.000126800	0.000118900	0.000110700	0.000112500	0.000148800	0.000148100	0.000123400	0.000121000	0.000120500	0.000126400	0.000141200	0.000136200	0.000151800	0.000150900	0.000144900	0.000125500	0.000106000	0.000111900
C20H18O3	306.125623	0.900	0.150	0.00	0.0000	0.0000	0.57	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000019700	0.000024200	0.000019100	0.000019000	0.000026600	0.000023400	0.000020700	0.000028700	0.000022600	0.000000000	0.000022900	0.000023000	0.000022600	0.000033700	0.000021500	0.000023400	0.000000000	0.000000000	0.000026700	0.000023900	0.000000000	0.000000000	0.000020000	0.000020600	0.000027300	0.000000000	0.000000000	0.000025300	0.000025800	0.000000000	0.000000000	0.000025300	0.000028200	0.000027200	0.000028900
C17H22O3S	306.129027	1.294	0.176	0.00	0.0588	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000023400	0.000030400	0.000000000	0.000000000	0.000023100	0.000000000	0.000000000	0.000000000	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000027400	0.000025100	0.000000000	0.000020600	0.000000000	0.000000000	0.000000000	0.000000000	0.000020900	0.000000000	0.000000000	0.000000000	0.000027300	0.000023100	0.000000000	0.000000000	0.000018800	0.000022000	0.000000000	0.000000000
C13H22O8	306.131531	1.692	0.615	0.00	0.0000	0.0000	0.00	3	0	0	0	0	0	0	1	1	0	0	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000023700	0.000019200	0.000020000	0.000029900	0.000022500	0.000019200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025400	0.000027400	0.000028400	0.000030100	0.000026900	0.000028100	0.000000000	0.000023300	0.000027200	0.000019800	0.000000000	0.000022500	0.000022800	0.000024300	0.000023500	0.000022500	0.000046700	0.000039500	0.000024600	0.000020700	0.000022500	0.000026200
C17H22O5	306.146705	1.294	0.294	0.00	0.0000	0.0000	0.31	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000789500	0.001176000	0.001144600	0.001001500	0.001316400	0.001225100	0.001166400	0.001354900	0.001191900	0.001265600	0.001153700	0.001282800	0.001074200	0.001361800	0.001600600	0.001368200	0.001275600	0.001332500	0.001523300	0.001135000	0.001103800	0.001249500	0.001210000	0.000966300	0.000956400	0.001210500	0.001151000	0.001005400	0.001016600	0.000836400	0.000820800	0.000964100	0.000913900	0.000859500	0.000949100
C14H26O5S	306.150075	1.857	0.357	0.00	0.0714	0.0000	0.00	2	0	0	0	0	0	0	1	0	1	0	0	0	0	1	0	0	0	0	0	0.000000000	0.000000000	0.000022900	0.000000000	0.000019900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018300	0.000025000	0.000000000	0.000000000	0.000018100	0.000000000	0.000000000	0.000000000	0.000000000	0.000028700	0.000000000	0.000000000	0.000000000	0.000000000
C16H22N2O4	306.157991	1.375	0.250	0.13	0.0000	0.0000	0.25	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000024800	0.000020000	0.000038700	0.000025400	0.000030500	0.000025700	0.000033000	0.000023100	0.000000000	0.000000000	0.000019300	0.000030400	0.000000000	0.000036200	0.000033600	0.000043800	0.000035900	0.000031600	0.000037500	0.000033000	0.000036100	0.000049800	0.000050600	0.000019600	0.000022000	0.000042100	0.000031800	0.000034000	0.000040700	0.000025300	0.000025700	0.000040700	0.000034000	0.000000000	0.000000000
C18H26O4	306.183089	1.444	0.222	0.00	0.0000	0.0000	0.25	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000194600	0.000283700	0.000287200	0.000256800	0.000341800	0.000320200	0.000295300	0.000370300	0.000305000	0.000333200	0.000299200	0.000331500	0.000267100	0.000387100	0.000468800	0.000382000	0.000343100	0.000334000	0.000421100	0.000294600	0.000288300	0.000333400	0.000331300	0.000272100	0.000241800	0.000297100	0.000289800	0.000303700	0.000289500	0.000221000	0.000226700	0.000266100	0.000252100	0.000224300	0.000252300
C19H30O3	306.219484	1.579	0.158	0.00	0.0000	0.0000	0.20	5	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000018400	0.000000000	0.000024300	0.000025900	0.000018400	0.000021200	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021400	0.000026500	0.000031800	0.000031500	0.000024300	0.000033500	0.000020100	0.000000000	0.000022100	0.000022000	0.000018500	0.000024800	0.000000000	0.000022000	0.000018700	0.000000000	0.000027300	0.000026900	0.000000000	0.000022500	0.000021500	0.000020900
C13H9NO6S	307.015053	0.692	0.462	0.08	0.0769	0.0000	0.62	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029500	0.000000000	0.000022600	0.000024800	0.000000000	0.000018500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020300	0.000000000	0.000000000	0.000000000	0.000000000	0.000026100	0.000000000	0.000000000	0.000000000	0.000018300	0.000000000	0.000000000	0.000021900	0.000019500	0.000000000	0.000000000	0.000036300	0.000031300	0.000020600	0.000000000	0.000027800	0.000026700	0.000023400	0.000000000
C13H9NO8	307.032854	0.692	0.615	0.08	0.0000	0.0000	0.62	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000020100	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018600	0.000000000	0.000000000	0.000000000	0.000022300	0.000000000	0.000020700	0.000000000	0.000019500	0.000021300
C21H9NS	307.045491	0.429	0.000	0.05	0.0476	0.0000	0.84	18	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000027200	0.000025800
C17H9NO5	307.048093	0.529	0.294	0.06	0.0000	0.0000	0.78	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000023600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020800	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000025700	0.000025300
C14H13NO5S	307.051438	0.929	0.357	0.07	0.0714	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000084100	0.000020600	0.000077800	0.000087000	0.000060100	0.000049200	0.000055500	0.000035200	0.000000000	0.000019500	0.000024900	0.000025600	0.000025300	0.000042600	0.000045500	0.000070200	0.000077600	0.000040900	0.000043600	0.000061400	0.000059600	0.000086300	0.000089700	0.000050800	0.000044000	0.000049800	0.000051600	0.000091500	0.000094500	0.000000000	0.000000000	0.000077800	0.000085900	0.000000000	0.000000000
C14H13NO7	307.069258	0.929	0.500	0.07	0.0000	0.0000	0.47	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000121200	0.000077200	0.000085500	0.000114500	0.000094300	0.000091900	0.000093200	0.000078400	0.000092100	0.000076100	0.000073500	0.000086100	0.000091800	0.000092300	0.000066000	0.000088200	0.000100200	0.000103800	0.000085000	0.000099900	0.000100900	0.000099500	0.000111200	0.000104600	0.000124300	0.000101600	0.000092200	0.000130100	0.000122700	0.000121900	0.000119300	0.000129900	0.000131700	0.000111800	0.000100400
C11H17NO7S	307.072692	1.545	0.636	0.09	0.0909	0.0000	0.00	4	0	0	0	0	0	0	1	1	0	1	0	0	0	0	1	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018700	0.000019600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C18H13NO4	307.084450	0.722	0.222	0.06	0.0000	0.0000	0.67	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000035500	0.000000000	0.000000000	0.000025400	0.000022800	0.000025300	0.000022800	0.000025200	0.000019400	0.000021700	0.000000000	0.000000000	0.000018700	0.000022000	0.000000000	0.000000000	0.000024900	0.000024200	0.000000000	0.000028600	0.000023500	0.000024500	0.000024600	0.000025100	0.000023200	0.000025500	0.000033900	0.000030900	0.000028000	0.000027600	0.000018800	0.000041500	0.000042100	0.000027600	0.000025000
C15H17NO4S	307.087820	1.133	0.267	0.07	0.0667	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000055100	0.000000000	0.000074700	0.000075000	0.000051400	0.000041500	0.000043800	0.000020700	0.000019700	0.000021400	0.000000000	0.000022800	0.000018200	0.000047100	0.000046900	0.000080900	0.000076400	0.000035500	0.000032100	0.000063000	0.000061500	0.000095100	0.000084800	0.000036600	0.000030200	0.000041500	0.000045000	0.000072000	0.000070000	0.000000000	0.000000000	0.000061700	0.000062300	0.000000000	0.000000000
C15H17NO6	307.105652	1.133	0.400	0.07	0.0000	0.0000	0.36	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000215600	0.000167900	0.000241800	0.000241800	0.000207100	0.000206600	0.000212800	0.000158900	0.000152300	0.000137200	0.000144000	0.000170000	0.000154400	0.000222500	0.000220400	0.000246700	0.000256300	0.000204600	0.000205300	0.000215000	0.000228100	0.000285800	0.000285500	0.000202700	0.000197800	0.000234800	0.000225200	0.000221000	0.000236200	0.000191700	0.000193000	0.000207100	0.000204100	0.000155400	0.000155600
C14H17N3O5	307.116782	1.214	0.357	0.21	0.0000	0.0000	0.29	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000020400	0.000000000	0.000020700	0.000026000	0.000023200	0.000000000	0.000000000	0.000019400	0.000018000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024400	0.000021100	0.000026000	0.000023700	0.000022900	0.000000000	0.000000000	0.000019300	0.000026100	0.000023500	0.000029100	0.000023200	0.000018400	0.000025400	0.000027000	0.000029400	0.000028100	0.000025100	0.000020600	0.000025200	0.000000000	0.000020700
C19H17NO3	307.120826	0.895	0.158	0.05	0.0000	0.0000	0.58	12	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000000000	0.000000000	0.000000000	0.000021700	0.000019000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000024900	0.000000000	0.000024900	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000000000	0.000018100	0.000000000	0.000000000	0.000023000	0.000020100	0.000021800	0.000000000	0.000000000	0.000023600	0.000022700	0.000000000	0.000000000
C16H21NO3S	307.124209	1.312	0.188	0.06	0.0625	0.0000	0.28	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000000000	0.000019400	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020700	0.000025400	0.000000000	0.000000000	0.000000000	0.000000000	0.000025200	0.000000000	0.000000000	0.000000000	0.000018900	0.000000000	0.000000000	0.000000000
C16H21NO5	307.142031	1.312	0.312	0.06	0.0000	0.0000	0.28	7	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000093000	0.000077200	0.000129000	0.000116700	0.000113200	0.000114200	0.000109100	0.000084300	0.000072300	0.000070000	0.000065800	0.000090200	0.000067700	0.000126100	0.000135100	0.000142800	0.000140100	0.000105200	0.000113200	0.000110000	0.000120200	0.000157800	0.000151500	0.000100800	0.000087600	0.000113300	0.000118800	0.000105400	0.000110700	0.000096000	0.000087200	0.000102000	0.000088600	0.000062800	0.000067700
C17H25NO4	307.178411	1.471	0.235	0.06	0.0000	0.0000	0.21	6	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000000000	0.000000000	0.000020500	0.000023800	0.000022600	0.000020600	0.000025300	0.000024400	0.000025900	0.000000000	0.000000000	0.000000000	0.000000000	0.000022200	0.000028200	0.000026000	0.000024200	0.000021800	0.000021200	0.000018700	0.000025200	0.000033500	0.000035100	0.000018600	0.000000000	0.000029800	0.000028000	0.000023400	0.000024300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H8O5S2	307.981361	0.615	0.385	0.00	0.1538	0.0000	0.65	10	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000019600	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000021300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C13H8O7S	307.999065	0.615	0.538	0.00	0.0769	0.0000	0.65	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000024400	0.000000000	0.000000000	0.000000000	0.000019300	0.000000000	0.000000000	0.000019100	0.000018900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022700	0.000019400	0.000022700	0.000025400	0.000020600	0.000000000	0.000000000	0.000029500	0.000034300	0.000000000	0.000021500
C10H12O7S2	308.002429	1.200	0.700	0.00	0.2000	0.0000	0.00	5	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000027500	0.000000000	0.000000000	0.000023800	0.000020100	0.000028900	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018100	0.000029700	0.000000000	0.000023400	0.000024200	0.000027100	0.000025800	0.000028400	0.000000000	0.000000000	0.000022900	0.000000000	0.000037200	0.000029300	0.000000000	0.000000000	0.000000000	0.000021700	0.000000000	0.000000000
C13H8O9	308.016870	0.615	0.692	0.00	0.0000	0.0000	0.65	10	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000000000	0.000018700	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018200	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000031300	0.000023800	0.000019000	0.000000000	0.000072200	0.000054100
C14H12O4S2	308.017746	0.857	0.286	0.00	0.1429	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000029300	0.000000000	0.000021100	0.000039300	0.000021500	0.000024300	0.000021600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000023400	0.000000000	0.000024700	0.000030000	0.000000000	0.000000000	0.000000000	0.000000000	0.000019200	0.000022600	0.000000000	0.000020800	0.000000000	0.000000000	0.000040600	0.000030100	0.000000000	0.000000000	0.000031400	0.000028200	0.000000000	0.000000000
C17H8O6	308.032104	0.471	0.353	0.00	0.0000	0.0000	0.79	14	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000036500	0.000028400	0.000000000	0.000021100	0.000000000	0.000021300	0.000035500	0.000030700	0.000026500	0.000033300	0.000031800	0.000032200	0.000033300	0.000000000	0.000022500	0.000000000	0.000000000	0.000020100	0.000000000	0.000025400	0.000025000	0.000024500	0.000000000	0.000035100	0.000033200	0.000018800	0.000000000	0.000000000	0.000000000	0.000053000	0.000038400	0.000033000	0.000034900	0.000084300	0.000075500
C14H12O6S	308.035449	0.857	0.429	0.00	0.0714	0.0000	0.50	9	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000162500	0.000076700	0.000135300	0.000174700	0.000117000	0.000111600	0.000113700	0.000072800	0.000073800	0.000063500	0.000060300	0.000064000	0.000071300	0.000116500	0.000091800	0.000157900	0.000145900	0.000104500	0.000081800	0.000126200	0.000122600	0.000151900	0.000153400	0.000114100	0.000128800	0.000108200	0.000094900	0.000193900	0.000184500	0.000035700	0.000029000	0.000164700	0.000171300	0.000049900	0.000038500
C11H16O6S2	308.038819	1.455	0.545	0.00	0.1818	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000050700	0.000022700	0.000099300	0.000080300	0.000050200	0.000054600	0.000057700	0.000025800	0.000019200	0.000000000	0.000020200	0.000000000	0.000000000	0.000044700	0.000035800	0.000067800	0.000075200	0.000045500	0.000042500	0.000079700	0.000087200	0.000106600	0.000119100	0.000047500	0.000035200	0.000072500	0.000062200	0.000074600	0.000072400	0.000000000	0.000000000	0.000048400	0.000059500	0.000000000	0.000000000
C18H12O3S	308.050786	0.667	0.167	0.00	0.0556	0.0000	0.68	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000018800	0.000000000	0.000019700	0.000018600	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000020500	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000
C14H12O8	308.053280	0.857	0.571	0.00	0.0000	0.0000	0.50	9	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000293900	0.000238900	0.000183700	0.000205000	0.000188800	0.000214900	0.000195400	0.000212800	0.000283300	0.000253500	0.000246400	0.000223500	0.000279500	0.000176800	0.000131200	0.000140000	0.000146900	0.000221000	0.000178100	0.000227900	0.000232900	0.000130800	0.000131400	0.000274900	0.000328200	0.000227700	0.000206200	0.000233500	0.000236700	0.000379200	0.000337600	0.000297500	0.000290900	0.000457100	0.000432300
C15H16O3S2	308.054113	1.067	0.200	0.00	0.1333	0.0000	0.39	8	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0	1	0	0	0	0.000027500	0.000000000	0.000025600	0.000020800	0.000020600	0.000000000	0.000018300	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000000000	0.000022000	0.000000000	0.000032400	0.000022600	0.000000000	0.000000000	0.000000000	0.000000000	0.000040800	0.000021200	0.000000000	0.000000000	0.000000000	0.000020200	0.000032900	0.000026400	0.000000000	0.000000000	0.000020700	0.000022000	0.000000000	0.000000000
C11H16O8S	308.056657	1.455	0.727	0.00	0.0909	0.0000	0.00	4	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.000031400	0.000035900	0.000034500	0.000033400	0.000053200	0.000047700	0.000042800	0.000038200	0.000042200	0.000032300	0.000034700	0.000030000	0.000046000	0.000050800	0.000039700	0.000047500	0.000056400	0.000056000	0.000047000	0.000035300	0.000029700	0.000033300	0.000035100	0.000043300	0.000059200	0.000051600	0.000045600	0.000051700	0.000042800	0.000062600	0.000056500	0.000038900	0.000038500	0.000030200	0.000031300
C13H12N2O7	308.064474	0.923	0.538	0.15	0.0000	0.0000	0.47	9	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0.000033100	0.000024100	0.000021500	0.000036300	0.000022400	0.000030400	0.000029700	0.000018500	0.000026900	0.000022900	0.000031800	0.000000000	0.000033300	0.000020600	0.000024000	0.000023800	0.000022400	0.000026300	0.000020900	0.000026500	0.000027100	0.000021600	0.000031100	0.000032900	0.000030700	0.000039400	0.000026300	0.000028800	0.000034000	0.000042400	0.000041700	0.000032400	0.000039200	0.000035800	0.000045500
C18H12O5	308.068468	0.667	0.278	0.00	0.0000	0.0000	0.68	13	1	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0.000108400	0.000079400	0.000064700	0.000069000	0.000078400	0.000068300	0.000073200	0.000088800	0.000097800	0.000078100	0.000075600	0.000072400	0.000074000	0.000057300	0.000048500	0.000048300	0.000047400	0.000048100	0.000059300	0.000087600	0.000083500	0.000052600	0.000045600	0.000087200	0.000108100	0.000065800	0.000057100	0.000082300	0.000083400	0.000093100	0.000099000	0.000119100	0.000121000	0.000141100	0.000144400

Only the first 2000 rows were shown. To view the complete dataset, download it as tab-delimited text. You can still view the full matrix in your browser, but be aware that this may crash the browser due to the huge size.