#DEFINITION	Reference Metabolome for Cucumis melo
#IDENTTFIER	RefMeta-Cucumis melo.R1
#FORMAT	msr
#VERSION	1.0/R1
#KEYWORDS	RefMeta
#ORGANISM	Cucumis melo
#CREATION	31-MAY-2024
#PUBLICATION	CropMetabolome: a comprehensive metabolome database for major crops cross eight categories
#JOURNAL	The Plant Journal
#AUTHORS	Shi H, Wu X, Zhu Y, Chen P, Xu X, and Li X.
#COMMENT	Reference metabolome for Cucumis melo was generated from multi-tissue LC-MS/MS data with redundance removed
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
93.04194641	0.15
108.9251404	0.30
114.9906464	0.18
123.0485535	0.33
127.014267	0.45
149.2478485	0.44
153.1914215	0.28
175.9340363	0.33
187.8336639	0.14
189.770401	0.59
199.3518524	0.39
200.9602966	0.29
204.1251221	0.31
215.1968842	0.82
216.8873749	2.21
218.017868	0.26
219.1372528	0.18
221.125473	0.17
223.995224	0.14
225.0457916	1.11
225.8481903	0.11
227.2223663	0.28
231.1272583	0.44
243.1447906	100.00
244.1075439	0.15
245.2285614	1.37
251.4511871	0.18
261.9351807	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	173.0819
Annotation	Diethyl succinate
Peak:m/z	Relative Intensity
59.0038147	0.12
111.0531616	0.13
113.1178436	2.69
130.9885406	100.00
131.9162598	0.05
154.9109039	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0713
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
120.7997589	0.18
137.140976	0.18
140.9723816	0.20
148.9400024	0.80
150.1665955	0.44
155.007782	0.15
168.7574158	0.33
174.0568085	0.16
178.9433899	0.28
181.1874695	0.08
183.0586853	0.22
191.2433014	0.17
193.0906067	0.57
195.0423889	0.51
206.0623932	0.24
207.0369873	3.38
208.1036224	3.45
209.004837	2.47
222.0879364	4.15
222.7662811	0.89
223.3665924	2.37
224.1249542	1.18
233.2519073	0.08
251.0641632	100.00
252.1126709	24.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	720.2672
Annotation	Unknow
Peak:m/z	Relative Intensity
204.9265900	0.07
250.1435547	2.53
282.6045532	0.14
308.9277344	0.02
338.2189636	0.06
394.4209595	0.09
395.1241455	0.18
396.3016968	0.06
412.1390381	15.47
412.9760742	0.12
426.1509399	0.05
441.4423218	0.06
443.1181030	0.11
480.5320435	0.08
488.2855835	0.07
504.4622803	0.04
514.4581909	0.02
534.0592651	0.16
540.0668335	0.06
555.8009644	0.20
557.5375366	0.46
558.1576538	0.30
567.3728027	0.04
572.3179321	0.06
574.1325073	100.00
574.8012085	0.92
586.2207642	0.04
605.9441528	0.07
608.2328491	0.11
616.3094482	0.04
616.9104614	0.09
628.3004761	0.02
640.8038330	0.22
646.8569946	0.13
654.2015991	0.04
669.6301880	0.13
670.7243652	0.30
684.3660278	0.04
698.0087891	0.10
702.0786743	0.08
702.8452148	0.05
704.5304565	0.04
726.9779053	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	257.14
Annotation	Unknow
Peak:m/z	Relative Intensity
86.1054840	0.56
88.0427628	0.58
94.9661713	0.22
98.9282684	0.40
117.2569885	0.39
128.6997833	0.63
131.0570831	0.62
144.9577637	0.13
146.7248993	0.34
148.8244324	0.75
152.1769562	0.11
155.1978760	1.31
161.1970825	0.28
167.2169342	0.09
168.7210541	0.19
170.0795441	0.21
173.2282715	0.20
183.1404419	5.88
184.1072845	0.95
188.8962097	0.36
199.1460419	2.77
201.0726013	78.02
202.0737152	3.81
210.3404846	0.48
211.0133209	1.15
213.1191711	0.09
215.4791107	1.44
216.1314697	0.70
219.1895447	0.64
222.3083801	3.67
227.0557709	0.56
229.0121307	100.00
230.0554657	7.44
231.4455566	2.71
232.5745697	0.55
233.8442230	1.74
236.1922760	1.17
237.2666168	6.41
238.9703979	2.81
239.5977020	0.08
240.4615936	0.80
241.9246674	1.20
242.7080231	1.72
245.5374603	40.94
246.4354248	0.09
247.3441925	0.99
248.1806183	1.52
251.2214355	8.14
253.7103729	0.34
260.3221130	1.06
262.1953125	13.01
262.8301392	3.67
268.1573486	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	166.0858
Annotation	Gentiatibetine
Peak:m/z	Relative Intensity
119.9342957	100.00
120.8476868	0.03
131.1024475	0.30
137.9857635	0.05
147.9252625	0.60
149.0075684	4.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	529.3928
Annotation	Unknow
Peak:m/z	Relative Intensity
155.1039734	0.47
165.9236145	0.05
172.9881134	1.46
183.1246033	0.11
184.2535400	0.13
195.2660370	0.07
201.0976868	0.70
209.0323486	0.21
237.0803986	1.21
252.3050537	0.11
253.2982788	0.10
265.5269165	0.09
270.1411743	0.17
283.9480896	0.04
288.0571899	0.05
291.2109985	0.20
293.4191284	0.09
297.8607178	0.07
301.1145935	0.25
307.2386475	0.12
311.5342407	0.39
312.1932373	0.17
316.8555908	0.05
320.1129761	0.26
343.3175659	0.07
345.8490601	0.11
349.0919800	0.24
357.0096436	0.16
359.7156982	0.20
360.4794922	0.36
362.4822998	0.09
366.2292480	0.05
366.9906006	0.38
383.1544800	0.17
386.2014160	0.18
387.2800903	0.08
392.2448730	0.06
396.8078003	0.32
407.3040771	0.13
414.3331299	0.14
421.9395752	0.36
424.9873047	0.73
461.4391479	0.51
464.0002441	0.04
468.2557983	0.14
469.2605591	0.30
472.2765503	0.64
475.5483398	0.17
476.5390625	1.32
478.8305664	0.08
482.1999512	0.30
483.3625488	0.33
484.2506104	2.62
486.3756714	0.90
489.9636230	6.94
492.5750732	0.66
493.1814575	1.00
493.9717407	0.59
498.2872925	1.57
498.9797974	0.51
501.0785522	0.51
501.7687988	1.67
504.0070801	1.25
506.7050171	2.55
507.4343872	3.04
508.6102295	0.30
509.7471924	4.93
510.6391602	0.81
511.4915161	1.87
512.1452026	3.68
513.4124146	0.39
514.3078613	2.06
515.1849365	5.44
515.8728638	8.42
516.7555542	1.82
517.3978271	2.03
518.6776733	7.73
519.4849243	2.06
520.4480591	4.16
521.0903320	7.73
522.6067505	24.22
524.0756226	4.82
526.2024536	0.26
530.1600952	0.10
531.9359741	0.75
541.1610718	0.07
546.4743652	0.20
548.7322388	1.05
550.6408691	0.80
553.5287476	0.97
556.2634888	0.95
558.0243530	1.41
558.9541626	0.43
562.0828247	2.03
565.0007935	0.29
565.8391113	0.45
566.4898071	5.99
567.2783813	0.38
571.7448730	0.15
573.1060791	0.55
574.7657471	0.64
577.1795044	1.09
580.2701416	0.44
582.0208130	2.22
583.5709839	0.16
584.8788452	1.84
585.7751465	0.28
586.4219360	0.52
587.0256348	0.49
590.1200562	1.27
591.2919312	0.94
592.1874390	1.15
593.9772949	1.63
594.9630127	3.89
596.2362061	0.63
597.2880249	1.12
597.9775391	0.22
599.0395508	1.19
599.7522583	1.60
600.5509644	2.29
601.2943726	2.35
602.0651855	0.81
603.3585815	1.90
604.6470947	0.52
605.4120483	2.09
607.4660034	22.33
608.2767944	0.92
609.0889282	0.06
609.9100952	0.96
611.7711792	100.00
612.5455933	31.55
614.2241821	3.48
614.9606934	1.13
615.9818115	0.89
616.6937256	1.96
618.5510864	1.64
619.3981934	0.27
620.3454590	2.05
623.1145630	1.28
623.7583618	0.77
625.0514526	1.29
626.2534790	1.18
627.2676392	2.71
629.1823730	2.59
630.3775024	2.87
632.2655640	1.24
633.5740356	2.79
635.7733765	4.30
636.6798096	1.06
637.3575439	2.98
638.1400757	0.62
639.6003418	14.72
640.3268433	9.07
642.4419556	2.08
644.2883301	42.10
646.6047363	5.36
648.6361694	0.28
650.6524048	2.39
651.4143066	1.10
654.9746094	0.25
657.3248901	3.35
657.9280396	3.56
663.2109985	0.48
664.3718872	0.12
669.5242310	0.11
675.4927979	0.17
681.6876831	1.11
683.1539307	0.45
684.0786743	0.73
686.1162109	0.45
688.1716919	1.14
694.7282104	0.48
697.4049072	1.74
702.9135742	1.26
703.9465942	1.05
704.8695068	0.28
707.5953369	0.50
708.8615723	2.08
709.5762939	1.61
720.4609985	0.24
721.6781616	0.35
729.5527954	0.05
731.8211670	0.32
732.8034058	0.05
739.0482788	0.24
743.1282349	0.40
748.4732056	0.34
749.4217529	0.76
754.9788818	0.61
755.7551270	0.36
756.9623413	0.26
759.1307983	0.29
761.7288208	0.44
763.9478760	0.41
769.2015991	0.81
770.1012573	0.26
786.1371460	0.34
789.7879028	0.24
795.2803345	0.43
797.4229126	0.08
798.6464233	0.53
799.4620972	0.05
806.9033813	1.02
809.9898682	0.65
815.8728638	0.52
828.7312622	0.57
846.8952637	0.12
852.5437012	0.43
853.3933716	0.73
868.3044434	0.08
962.0654907	0.29
966.4362793	0.41
1112.3269040	0.07
1135.3399660	0.43
1280.3469240	0.13
1300.7354740	0.19
1807.5939940	3.76
1826.4671630	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.82
Annotation	Unknow
Peak:m/z	Relative Intensity
122.9442596	1.07
167.4311981	0.30
190.9255829	4.28
200.7617188	1.37
206.7952576	7.08
212.8357544	0.20
214.8379517	0.92
232.0206909	3.95
232.9653625	1.12
234.0902710	3.49
251.0576172	1.71
252.0982361	1.24
252.9745483	0.82
258.8898010	1.43
271.1414490	0.23
273.3880920	0.23
274.8205566	100.00
281.0535583	0.14
283.0190430	0.07
290.8136292	50.87
298.9934692	0.30
338.2568970	0.33
342.7196350	23.77
343.3753662	0.45
349.0223083	0.25
358.7741699	8.12
381.0459900	0.30
383.2883301	0.07
391.2920837	0.17
408.0144958	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0197
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
84.9362793	0.19
87.0422440	1.21
101.1701050	0.03
110.8790131	100.00
111.6980896	0.03
129.0469971	2.61
129.8380280	0.02
130.8644714	0.95
147.1523438	0.06
154.8983765	0.15
170.7764740	0.02
172.9270477	19.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	720.2667
Annotation	Unknow
Peak:m/z	Relative Intensity
250.1041565	2.05
258.0774536	0.10
265.0592651	0.05
282.2908630	0.14
283.1811218	0.18
284.2905884	0.19
306.1978149	0.11
310.5354919	0.15
370.9522705	0.07
392.5228271	0.13
412.2092896	16.37
481.0018311	0.08
497.1567383	0.06
501.8928223	0.28
519.5742798	0.14
522.7354736	0.16
540.3938599	0.69
558.1126709	0.23
571.2863770	0.11
574.1078491	100.00
574.7683716	0.60
581.7896729	0.04
618.9013062	0.46
620.6266479	0.32
622.5868530	0.03
654.4832764	0.23
655.6287231	0.33
676.3015137	0.11
681.0630493	0.31
690.0288086	0.11
691.9907227	0.13
701.7442017	0.23
702.3807373	0.36
704.6186523	0.08
710.8641968	1.09
720.2712402	0.06
733.5578613	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
84.89861298	0.33
91.1290741	0.49
92.98524475	0.64
94.87872314	0.87
96.94371796	0.95
98.9225235	1.35
100.9617004	0.10
103.0033875	0.27
104.8728638	0.25
107.082962	0.91
108.9598083	2.43
110.9882736	1.70
114.9591064	0.44
119.072113	0.92
121.0750427	0.97
122.9882355	2.72
124.9914932	1.89
126.26474	0.07
127.0904541	0.62
132.8370667	0.91
135.0168762	1.41
136.0982971	0.40
137.0024567	1.92
138.9265442	17.65
141.0976562	0.65
143.0875549	1.06
145.023468	0.69
147.1095734	1.26
149.1352539	0.53
150.8856201	0.70
153.0408325	0.49
155.3000793	0.34
157.0263672	0.43
161.2292633	0.56
163.1430359	0.81
165.0843201	0.39
167.2170715	0.29
169.1051025	0.98
171.0144501	1.45
171.8968811	0.24
172.9796143	0.14
175.2046661	0.13
177.3158264	0.16
179.0137939	1.05
181.0840759	0.65
183.2241364	2.29
184.1264038	0.16
185.2832642	0.34
186.872406	0.31
188.9490967	0.14
190.9721985	0.16
192.8687439	0.38
194.983902	0.11
197.0968018	7.84
199.1551514	0.90
201.159729	0.21
201.978241	0.22
203.1315002	2.60
205.4353943	0.30
207.2909851	0.77
209.0101929	0.49
211.1339722	2.32
219.3312683	1.10
221.1681824	3.10
223.1452942	0.18
225.264679	2.06
227.0938721	0.37
228.9517517	0.43
232.7669373	0.09
234.9602356	0.11
237.163147	2.41
239.2193298	23.72
241.2521973	0.76
243.3816223	0.63
247.2020264	0.34
251.1022034	1.10
253.2144775	1.35
255.0997314	3.28
256.635376	0.22
257.2916565	0.19
261.1755676	3.46
269.2355957	0.94
279.2330322	100.00
288.2532959	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.0787
Annotation	4'-Hydroxyflurbiprofen
Peak:m/z	Relative Intensity
86.9625549	0.07
96.8589935	0.04
112.6227570	0.04
140.0407410	1.08
144.9707947	1.84
157.8311157	0.12
166.8689117	0.09
171.1469269	0.05
180.9716034	0.03
186.9069672	0.19
196.1362610	4.61
209.3360138	0.08
211.1290436	0.15
213.0606537	100.00
213.9841766	0.86
215.1080475	0.46
231.0875092	15.55
233.1685181	0.15
241.1848755	1.47
242.0671234	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
106.1004257	0.23
107.0795212	0.99
109.0512009	3.24
111.1001587	0.54
112.8580704	0.41
114.6452026	0.30
116.6938019	0.19
119.0143127	0.30
121.0466766	3.03
122.9778366	0.92
125.0454712	0.61
129.1149139	0.38
130.8824768	0.62
133.0288086	1.10
135.0740204	5.19
136.1088562	0.12
137.153656	0.64
138.910614	0.10
141.0463257	0.07
142.941864	0.83
143.9743958	0.09
145.1427155	0.32
146.9931488	1.48
147.8090363	0.40
148.9533386	1.56
151.0257568	0.24
153.0550842	0.21
154.8362122	0.08
156.8683014	0.56
159.147583	0.44
161.0086365	1.72
163.2440491	1.35
164.9725037	0.62
166.9241943	0.81
168.6532745	0.32
171.1148224	0.63
173.0526428	1.58
174.9308472	0.41
176.9994507	0.14
179.3666382	0.51
181.4463348	0.50
182.1027985	0.27
182.9100952	1.01
184.9592133	0.44
187.0286865	1.26
189.0470886	0.87
191.1367188	0.16
193.0381775	0.34
195.1586761	1.00
197.1261749	0.79
198.3363495	0.23
199.1602783	0.05
201.0577393	0.46
203.1326141	1.26
204.9484253	0.90
206.0806122	0.11
207.3453674	0.30
209.2700195	0.78
211.0539856	0.38
213.3309021	0.57
215.0340271	0.27
217.0352783	0.48
219.2026672	0.36
221.2691956	0.43
223.1025696	0.87
223.9298706	0.22
225.3348083	0.08
226.9802551	0.72
228.1220703	0.36
229.1041565	0.28
231.1354065	0.67
232.1657715	0.31
235.3232117	0.53
237.07724	0.63
239.0613098	0.36
241.1907959	1.28
243.2831421	0.75
245.286377	0.75
247.2775269	5.23
249.2084045	0.20
251.3578796	0.19
253.2292175	0.69
253.9780273	0.14
255.4188232	0.69
256.1135254	0.11
257.2936401	0.51
259.0006409	1.39
261.1951294	0.56
262.9882812	0.20
267.1318054	1.45
269.1956482	0.21
271.0296021	0.73
273.4735107	0.53
279.3638306	0.49
281.0615234	0.15
283.2883911	0.96
284.1627197	0.30
285.208252	0.76
287.2758179	1.59
295.2231445	0.36
297.1445007	0.71
299.248291	3.51
300.2296753	0.32
303.2139893	0.09
305.2905273	3.83
306.3701172	0.62
307.2880249	0.33
310.4542847	0.22
311.1080627	0.24
313.2453613	0.22
321.0287781	0.37
323.2312927	100.00
323.9494629	0.67
332.6404419	1.01
341.3200378	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	412.159
Annotation	Unknow
Peak:m/z	Relative Intensity
120.9143448	100.00
121.6826248	0.09
126.8702545	1.16
130.0505981	2.01
138.8988953	9.90
144.9107056	3.32
175.1079865	0.07
204.2412720	0.05
204.9716034	0.19
216.3061066	0.06
222.3354034	0.07
232.0098877	1.46
238.1088867	0.20
246.8191528	0.17
250.1226807	28.63
250.9266663	0.06
265.1369324	29.53
275.8990173	0.16
282.9207153	51.08
320.5407104	0.12
338.0370789	0.22
340.2534485	0.17
350.0640869	0.08
366.1167908	1.58
394.1463318	3.01
395.3360596	0.12
403.1887512	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0615387	0.15
106.9409637	0.41
109.0468597	2.72
111.0678558	0.76
111.6990051	0.05
115.0602798	0.09
117.087059	0.48
119.2252121	0.39
120.9931183	5.24
122.9435043	1.54
124.9776077	0.32
126.5570831	0.10
127.1628265	0.09
128.9894104	0.47
130.9016571	0.46
133.0506134	0.53
135.0697174	3.78
137.0552673	0.33
139.0713196	0.03
140.6648254	0.18
143.0142517	1.03
144.8137817	0.09
147.0162659	2.53
149.0888672	1.73
151.1286621	1.05
153.1278076	0.15
155.2142944	0.41
156.981781	0.83
159.0098267	1.18
160.9465942	2.35
163.0072632	1.31
165.1446838	0.45
166.0339355	0.22
166.7423859	0.19
169.0049591	0.65
171.0616455	0.55
173.0835571	1.43
175.0766296	2.19
177.0527649	0.63
178.768692	0.05
179.3735352	0.05
181.0843048	0.31
183.170578	0.55
184.9977417	0.21
186.9895325	1.42
189.0815582	1.06
190.8432617	0.40
191.5591125	0.11
192.8969116	0.14
195.0142517	0.19
196.6259003	0.06
197.2266998	0.49
198.8545685	0.09
201.1072388	0.09
203.1342316	1.12
205.2166138	0.55
207.3471832	0.23
209.1717224	0.04
210.006012	0.14
211.0887756	0.83
213.1158447	0.63
215.0330811	0.49
215.9377441	0.04
217.1372681	0.93
219.0904541	0.49
221.0643921	0.05
223.2507019	0.95
224.1593018	0.07
225.0365601	0.45
227.1453857	0.29
228.2694397	0.10
229.1796265	0.35
231.1156921	0.67
233.3518982	0.06
235.1997375	0.54
238.9299927	0.26
241.0908203	0.17
243.1031494	0.20
243.9937744	0.07
245.1509094	0.94
246.1312256	0.11
247.2166138	4.44
249.5722961	0.13
251.1920776	0.11
253.0026855	0.19
254.5835876	0.23
255.2416077	0.30
257.137207	0.29
259.3283997	0.95
265.1903076	0.17
267.1793823	0.44
269.5447388	0.04
271.1105347	0.67
272.3114929	0.18
277.0834961	0.33
280.9418945	0.50
282.3912964	0.23
283.161438	0.05
284.7298279	0.08
285.3580933	0.58
287.2965088	0.83
290.0246887	0.07
292.4081421	0.04
295.3217468	0.56
296.5437622	0.60
297.3183594	0.44
299.3194885	1.13
300.1454468	0.16
303.3579407	0.06
305.1059265	2.64
306.7688293	0.04
308.9821472	0.04
312.5543213	0.42
313.3807373	0.26
317.8127441	0.16
321.4331055	0.07
323.247345	100.00
324.368866	0.41
325.5989685	0.03
327.272583	0.08
331.753418	0.60
332.4483337	0.06
340.7591858	0.11
341.3745117	1.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.1127
Annotation	Unknow
Peak:m/z	Relative Intensity
132.0196991	0.07
143.1211548	0.11
161.0816956	0.05
179.0068054	1.19
255.2011108	0.06
272.7783813	0.05
301.1765747	0.11
328.9104614	0.06
341.1411133	100.00
341.8061523	0.55
379.3653259	0.06
383.2927246	0.08
414.9242249	0.05
416.7778320	0.16
418.3245239	0.31
433.0738831	0.07
445.9278564	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
80.71543884	3.49
90.95465088	0.98
94.83953857	5.16
97.13197327	0.25
98.88687134	1.76
102.9515839	1.76
104.8970795	0.50
106.886734	2.69
107.8491211	0.23
108.9271088	1.45
110.9034271	0.73
112.868103	1.87
115.0488586	0.25
118.9254608	1.58
120.9059753	3.55
123.0776978	2.88
125.022995	1.21
127.0958557	4.50
129.0292053	12.87
132.8932343	1.44
134.2170563	1.24
134.9270477	3.89
136.9211273	3.16
138.8848877	1.07
141.028244	3.36
147.1455841	0.82
148.9889984	3.21
151.045578	81.10
152.1300659	5.88
153.0090179	2.34
155.1493988	7.89
156.6488495	1.06
159.3652802	0.75
161.0394592	3.62
163.1936188	0.43
165.0313873	5.00
166.0413666	1.19
167.0372162	6.90
169.0770416	0.21
170.906662	1.97
173.2952118	0.82
175.0069733	4.23
175.8588104	0.38
177.0106812	1.48
178.0969543	0.78
178.8806152	2.43
183.0640259	0.89
184.0328217	0.50
185.0882111	0.93
189.1417999	3.84
191.1873932	3.20
193.1634369	4.47
195.2134705	2.28
197.0784912	8.08
198.0462189	1.19
199.1701965	3.13
203.0909271	0.43
205.2671661	0.38
207.0550385	3.77
209.1622314	3.80
209.9811859	1.07
211.2339935	13.19
212.0852966	3.92
217.2031097	17.04
224.061142	0.48
225.1508026	23.21
226.3968658	0.95
235.1400604	74.37
236.19133	0.55
238.156311	12.07
239.0297852	0.75
241.1780548	0.46
243.5878448	1.60
251.2362213	0.82
253.0888824	100.00
254.1235352	19.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
155.2435913	0.53
158.9771881	0.23
163.2476044	0.61
165.0413666	0.29
173.1320953	2.83
175.214386	0.40
177.0789642	0.68
188.649704	0.46
192.7593536	0.57
200.9872284	0.78
202.9066772	0.35
215.1101227	0.90
216.9393463	1.96
225.2489166	1.19
225.9893036	1.18
227.2593231	0.72
231.1928864	0.46
232.076004	0.50
232.791275	0.21
243.1390839	100.00
244.045639	0.75
244.8778687	1.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	803.2968
Annotation	Korolkoside
Peak:m/z	Relative Intensity
245.2071838	0.30
289.2811279	1.31
303.0958862	0.08
315.3277588	1.20
331.4526672	0.25
357.2075195	0.08
430.3993530	0.31
433.1552124	0.04
451.2116699	3.66
451.8873291	0.27
477.3752441	0.05
484.5764160	0.07
495.0747681	0.07
518.5927734	0.22
521.0877686	0.08
530.9877319	0.05
579.3871460	0.55
589.4076538	0.55
593.1756592	0.07
597.3026733	39.66
613.3707886	0.65
614.9353638	0.18
623.2319946	2.92
628.5748901	0.12
639.5206909	0.46
641.2223511	23.24
641.8584595	0.07
647.4826660	0.09
653.1741333	0.23
656.6825562	0.27
665.6999512	0.04
680.8856201	0.20
683.2639771	0.17
694.1547241	0.25
700.0736694	0.05
709.3367920	0.08
715.4472656	0.35
720.8112183	0.10
721.4262695	0.24
728.4055786	0.39
736.9474487	0.44
739.1627808	0.08
741.2933350	0.18
743.4011230	0.37
744.0072632	0.56
759.3320312	100.00
763.9784546	0.08
765.1912231	0.04
767.6205444	0.05
783.8997192	0.68
784.7504883	0.52
785.4699097	3.41
786.0968628	0.17
788.2809448	0.40
789.6390991	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	562.3149
Annotation	Unknow
Peak:m/z	Relative Intensity
237.8880615	0.07
248.2202759	0.08
277.4148865	0.38
294.9388428	0.18
338.8941040	0.07
341.4660034	0.03
413.1814575	0.23
446.4537354	0.08
466.3176880	0.16
489.5586548	0.26
502.4273071	100.00
503.4625854	0.05
516.1167603	0.74
518.2823486	0.40
526.0673828	0.69
526.7924194	0.12
530.4688721	0.05
535.1763306	0.21
543.6454468	0.22
545.3976440	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
127.1941986	0.37
147.5228882	0.84
154.8144226	0.73
156.9502869	0.28
171.0503387	2.70
173.0723572	3.06
177.0171051	0.35
184.8780823	3.19
187.0540466	2.95
197.0640869	0.83
199.1452637	0.65
201.1898804	3.05
211.0103455	1.25
213.1293945	1.37
215.0532837	3.49
217.1517334	1.17
223.355835	0.85
225.2215576	0.21
227.2572021	1.25
229.0966492	5.75
230.9866943	3.81
241.3922729	1.81
243.1958008	6.48
245.0751038	1.10
255.1986389	1.78
257.0739136	4.38
259.0149231	1.20
263.2236023	2.45
269.357666	1.57
271.3812256	1.67
273.3039246	0.99
275.2766724	0.42
283.3308411	1.62
285.1699829	11.15
287.2621765	1.38
293.3399048	0.32
295.2705383	2.10
297.3402405	5.26
299.1945801	9.90
301.2496643	1.85
309.1343994	0.32
311.2206421	3.83
313.2329407	1.75
315.3605652	5.70
319.3042603	0.15
321.2301636	2.16
322.2332458	0.42
323.2987366	10.53
327.2680054	0.66
329.1609497	0.39
330.9441528	0.43
337.2416687	0.21
339.25	100.00
340.255188	1.35
341.3338318	19.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
151.1653137	0.21
156.90448	0.79
165.0742798	0.27
171.2541809	1.28
173.1951294	0.93
178.8892212	0.32
185.0036011	0.63
187.1781921	1.16
195.2095032	1.31
199.33461	0.60
201.0527649	3.56
203.2147675	1.32
209.2889862	0.17
213.1767273	1.93
215.2107239	3.26
227.1285095	0.41
229.3117676	1.29
231.3170776	0.73
237.1940308	0.34
239.0557556	0.45
241.2232056	3.83
243.3027039	4.61
245.0964355	2.54
253.2682495	0.48
255.3673706	1.25
257.1558533	4.76
259.2556152	2.06
261.3411865	0.78
263.2243347	0.75
267.2301636	0.25
269.369812	0.45
271.1281128	7.03
273.2860107	1.25
283.1605225	1.33
285.2757568	4.68
287.1383057	0.96
293.3343506	0.29
295.0083313	0.51
295.6781311	0.26
297.3424683	2.37
299.0211792	5.85
299.7742615	1.07
301.2146606	0.80
309.3641357	0.49
311.6678772	0.38
313.0716858	3.81
315.2307129	5.89
319.1728821	0.63
321.3577576	2.24
323.2385864	4.00
325.4267578	0.47
337.1437683	0.35
339.2389526	100.00
339.9244995	0.12
341.3465576	32.86
357.217865	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.9622345	0.05
102.9387207	0.10
105.0132751	0.07
107.0212479	1.85
109.0199127	3.82
111.1759186	0.26
116.8428879	0.24
118.9201431	0.16
121.0297089	2.64
123.0089645	1.42
124.9903717	0.29
128.9279938	0.24
131.040329	0.28
132.7841034	0.34
135.0574036	3.90
137.1354065	0.40
139.1719055	0.27
140.83638	0.13
142.985672	1.23
145.1517334	0.14
146.9381714	1.82
149.0540161	1.35
151.1517029	0.53
152.0152588	0.09
154.517868	0.25
155.2524261	0.04
157.1467896	0.59
159.1004944	0.15
161.0684814	2.39
163.1369019	1.38
165.1533203	0.71
167.05896	0.17
169.0425873	0.61
171.0593414	0.79
173.0637512	1.11
174.737854	0.76
175.3786316	0.51
176.8892059	0.25
179.0082245	0.77
181.0800781	0.34
183.2298889	0.22
185.1299896	0.30
187.0822449	1.17
189.0381775	1.61
190.507019	0.09
191.3179321	0.13
193.2425537	0.17
194.9695282	0.48
197.049408	0.70
198.9904785	0.30
201.034729	0.07
203.0684509	0.92
205.0808105	0.88
207.3274841	0.48
209.2025452	0.24
211.0385132	1.65
213.0396423	0.34
215.1532898	0.54
217.2460632	0.47
219.3344116	0.16
224.0299988	0.24
225.1984253	0.28
226.9648438	0.24
229.3783875	0.06
230.6141968	0.34
231.2188416	0.66
233.1295166	0.13
233.9711609	0.06
234.8305969	0.07
237.3945007	0.15
239.3183289	0.45
243.2244263	0.11
245.037384	1.57
247.117157	5.93
248.2191467	0.13
251.1312256	0.14
252.13797	0.52
253.2615662	0.98
254.118042	0.32
255.00354	0.33
257.1864624	0.33
258.0668335	0.05
259.1770935	0.33
261.1845093	0.05
263.1250305	0.09
264.2420959	0.21
264.8504028	0.10
265.4739685	0.07
267.1446533	0.35
269.2929688	0.52
271.0924072	0.59
273.2466431	0.15
275.3494263	0.10
277.1609497	0.15
279.5844421	0.13
281.2879333	0.36
283.3288574	0.42
285.2095337	0.90
287.2689514	0.47
290.0044556	0.69
291.2425232	0.25
292.1081238	0.29
293.1276855	0.17
295.4650269	1.33
297.1142578	0.40
299.2857666	2.26
300.1873779	0.53
303.271698	0.10
305.26297	3.42
307.2131958	0.49
310.1150513	0.17
311.0245056	0.08
313.036438	0.77
318.9705811	0.06
319.8444824	0.24
323.238678	100.00
323.9661865	0.16
325.0872498	0.04
332.4420776	0.42
341.1773987	1.01
343.1896362	0.04
351.4591064	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	714.5085
Annotation	1-Palmitoyl-2-linoleoyl PE
Peak:m/z	Relative Intensity
255.2951965	30.96
261.2198486	2.01
279.227356	100.00
382.3867798	1.16
394.4967651	3.10
416.2981567	3.64
417.3007202	3.33
422.2896118	2.48
432.4221191	2.64
434.2044067	4.66
437.6818237	3.03
452.3392334	7.40
467.633667	4.88
468.416748	1.70
476.4706421	5.98
538.3373413	1.31
552.5613403	1.78
569.0515747	2.55
586.3760376	2.48
615.3926392	0.85
644.302124	1.41
659.0690918	1.62
686.7989502	1.16
696.1640015	5.22
696.9630737	2.32
697.9818115	2.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0137634	0.08
107.0202332	1.11
109.0340652	1.64
111.0437469	0.19
112.9466248	0.12
116.9850616	0.22
121.0570221	3.06
123.018364	1.05
124.8801575	0.02
128.9891968	0.16
130.8992462	0.43
132.8937836	0.74
135.0066223	2.89
137.046051	0.45
139.0397186	0.09
141.0137024	0.04
142.9892578	1.14
145.0133972	0.26
147.0391541	1.58
149.0863647	1.82
151.0547028	0.54
153.0445557	0.08
154.0509644	0.06
155.0492096	0.06
157.0757751	1.34
159.0872192	0.37
161.067627	2.72
163.0617371	1.08
165.0984497	0.29
165.884613	0.03
166.964798	0.15
168.9359436	0.37
171.0433197	0.64
173.0545349	0.88
175.0691681	1.70
177.1168518	0.79
179.1647644	0.11
180.1997528	0.03
181.102417	0.06
181.9335022	0.04
183.1280823	0.41
184.9369507	0.25
187.1008453	0.73
189.0722961	0.95
191.1485596	0.73
193.1148071	0.21
195.0110168	0.16
196.3738556	0.17
197.1673889	0.36
199.0385132	0.24
201.0965881	0.63
203.0933228	1.01
205.1366425	0.68
207.171051	0.10
209.2462158	0.38
211.1270142	0.77
213.1636047	0.23
215.124054	0.24
217.1575623	1.49
217.8536987	0.07
219.2182922	0.15
221.3505859	0.13
223.1263123	0.48
225.2372131	0.31
226.0745544	0.03
227.0940247	0.35
229.132782	0.26
231.1953735	1.64
233.0837708	0.10
235.1877136	0.25
236.9772034	0.10
237.7734985	0.02
239.1064453	0.14
241.2973938	0.26
243.3513794	0.54
245.1901855	0.94
247.3210754	5.34
253.1459351	0.18
255.274231	0.11
257.3914185	0.19
259.1439819	0.61
260.919342	0.05
263.2494812	0.03
267.2504272	0.37
269.1234436	0.34
271.3826904	0.24
275.3050537	0.18
277.31073	0.03
279.1968079	0.36
281.2564087	0.72
283.3209534	0.22
284.1270752	0.08
285.3563843	0.21
286.1552124	0.12
287.342041	0.51
293.2645874	0.03
295.2090454	0.98
296.1639099	0.09
297.0764465	0.36
297.9328613	0.02
299.2572021	0.82
303.2484741	0.06
305.2503662	3.05
306.0839539	0.08
311.363678	0.08
313.2394409	0.99
318.5884399	0.03
320.6298218	0.07
321.5598755	0.02
323.2407532	100.00
323.9956055	0.46
324.6082153	0.21
325.2555237	0.04
332.2192993	0.02
337.1057434	0.10
341.1095886	1.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	635.2186
Annotation	Coelovirin C
Peak:m/z	Relative Intensity
283.1464844	1.90
293.3688354	0.05
310.9373169	0.21
369.1727905	0.05
377.0420532	0.08
387.3912354	0.10
415.7491455	0.11
424.1987305	0.08
431.5543213	0.05
443.0157471	0.05
468.5694580	0.04
487.0111084	0.59
491.4009399	0.07
503.8660278	0.38
530.9874878	0.73
547.1480713	0.30
549.3990479	0.62
575.3060913	0.50
576.9039917	0.15
588.8165283	0.08
591.1942749	100.00
591.8379517	0.27
593.4050293	0.34
597.3004150	0.04
605.5726929	0.16
613.1093140	0.29
617.1876831	1.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1021.5206
Annotation	Aeruginopeptin 917S-C
Peak:m/z	Relative Intensity
305.3437500	0.26
382.3161011	0.07
420.2564697	0.14
439.0759277	0.05
452.0151062	0.14
453.1740723	0.15
493.2750244	0.13
504.7496643	0.15
546.4677734	0.13
549.2279053	0.09
567.3461914	1.68
568.3688965	1.38
626.9350586	0.81
647.0521851	0.09
660.5879517	0.82
673.4389648	0.53
682.1347656	0.73
682.7458496	0.14
719.9960938	0.30
720.9384766	0.62
728.3076172	0.20
735.3905640	0.76
777.7120972	0.33
778.4999390	0.15
786.6618652	0.10
787.6337891	0.15
791.9731445	0.07
792.7077637	0.04
793.8098145	0.10
798.1833496	0.09
799.8789062	0.21
800.5095215	0.11
806.6425781	0.05
819.6243896	0.05
820.4724121	0.10
821.7255859	0.38
834.5435791	1.12
840.6950684	1.03
841.6535645	0.08
849.5556641	13.49
850.6273193	0.21
858.1442871	0.37
865.4964600	0.13
915.1170654	0.41
916.5203857	0.07
921.3762207	0.25
927.4783936	0.25
935.6868896	0.10
947.4113770	0.20
948.3518066	0.09
948.9604492	0.39
956.5527344	4.03
957.4238281	0.37
958.9479980	0.09
961.9235840	0.18
966.0964355	0.14
978.5020752	0.21
981.8686523	0.21
985.1170654	0.54
986.3879395	0.26
990.8242188	3.88
991.5095215	4.61
1000.0101320	100.00
1000.6391600	45.68
1001.6320800	0.19
1004.0190430	2.58
1004.7817380	0.62
1005.7016600	0.32
1013.0234380	0.83
1013.6915280	0.06
1014.3480220	0.20
1072.5526120	0.12
1076.5786130	0.08
1130.3129880	0.23
1131.6704100	0.56
1150.0170900	0.22
1202.5109860	0.14
1205.1557620	0.06
1206.6248780	0.24
1251.7969970	0.09
1255.7469480	0.04
1273.9179690	0.12
1303.7493900	0.27
1319.7231450	0.07
1341.6567380	0.09
1345.6400150	0.14
1347.6158450	0.74
1360.6068120	0.08
1365.5740970	0.29
1388.7935790	0.08
1431.5804440	0.66
1432.5939940	1.90
1433.5292970	0.62
1434.6010740	0.17
1457.5307620	0.19
1458.6126710	0.90
1459.3737790	0.07
1470.1986080	0.04
1471.7625730	0.18
1472.8198240	0.16
1475.3422850	0.35
1476.6512450	1.21
1477.9259030	0.23
1485.9179690	0.04
1528.7128910	0.58
1529.7113040	0.77
1530.5274660	0.48
1555.4459230	0.47
1556.6594240	0.24
1572.5939940	0.23
1574.2686770	0.75
1588.0502930	0.08
1601.1273190	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	295.14
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
84.9167175	0.30
86.9952545	0.09
90.9698410	0.12
92.9383240	0.04
96.8947372	0.12
98.8860245	0.01
102.2895432	0.07
102.9891205	0.11
103.9324799	0.01
104.7568359	0.08
107.2883148	0.10
108.9665146	0.12
109.9008865	0.05
111.8151855	0.02
114.8270798	0.02
120.0003204	19.43
124.7473450	0.01
126.9176941	0.67
130.0200653	0.19
131.1248322	0.16
132.8567963	0.63
135.9328308	0.72
140.1446228	0.01
144.9699707	1.96
146.0911865	0.02
148.0406799	0.21
148.9444885	0.90
150.1388855	0.15
160.7543030	0.04
162.8459167	3.28
165.9607086	100.00
167.0036774	0.02
169.3369446	0.07
181.7121124	0.02
183.2175140	0.09
185.9075470	0.10
193.1247559	0.10
203.3347168	0.13
208.9997864	0.07
211.2974854	0.04
212.9732361	0.04
218.8752441	0.01
223.5141296	0.20
224.6268921	0.03
230.9313965	0.13
232.0773926	1.36
235.1253357	0.05
236.8902893	0.01
240.9003906	0.09
243.2062988	0.05
249.0485840	0.54
250.0845337	0.13
251.1369019	0.06
254.2255249	0.03
258.9463501	0.61
268.9375610	0.08
272.2681274	0.07
277.0364685	1.95
278.1422729	6.69
286.2732544	0.03
293.8561707	0.05
320.4956665	0.11
371.8131714	0.23
417.0320435	0.02
442.2629089	0.02
458.1725769	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	333.2052
Annotation	Rabdokunmin D
Peak:m/z	Relative Intensity
109.0953445	0.05
115.7877808	0.06
116.9080734	0.18
121.6928177	0.12
123.0687408	0.25
130.0737457	0.04
135.0812988	0.02
137.2275085	0.10
139.2054138	0.09
141.0796204	0.09
151.3822327	0.02
158.9547119	0.10
162.9921570	0.05
166.1556396	0.33
171.1918335	0.05
174.7590332	0.10
177.2622986	0.08
182.0557251	0.15
186.8849945	0.08
191.0439911	0.20
193.0574951	0.80
199.0695496	0.15
202.0144043	0.03
203.0052185	0.04
204.8818970	0.05
207.1646729	0.17
209.0636902	0.06
211.1098633	0.08
219.1147766	0.09
221.0710754	0.08
225.0186768	0.12
227.0575562	0.17
229.0900879	0.03
230.1962585	0.05
231.2116699	0.56
240.1994324	0.15
241.6332092	0.24
242.6950989	0.05
244.0617371	0.20
245.1954041	0.10
249.1643066	0.15
252.2822571	0.11
255.0409241	0.05
256.9813843	0.60
259.1758728	0.61
267.0046692	0.06
269.1418762	4.97
270.1621704	0.04
271.2440796	0.28
273.4732361	0.14
275.3945312	0.08
284.0360107	0.13
285.3231201	0.29
287.1398010	48.28
287.9245605	0.02
288.9484253	0.12
291.7006226	0.26
297.1384888	1.36
298.3072815	0.03
299.3680420	0.08
303.1206055	0.26
305.0537109	0.44
307.0842590	0.15
308.0161133	0.04
309.5679932	0.06
311.3056641	0.04
315.0949097	100.00
316.1872559	1.21
318.2604065	0.16
333.2443237	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	632.2092
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9353790	1.81
187.1700134	0.29
188.0552979	0.21
203.1733551	0.06
214.9612122	0.64
215.9798584	0.37
221.1453552	0.19
233.0498047	1.34
238.0441284	0.48
241.2374115	0.10
242.4161072	0.06
245.2232361	0.27
266.1858215	0.29
271.9531250	0.12
273.3375549	0.09
288.6274719	0.15
290.0597534	0.79
291.0959167	0.22
308.0740356	100.00
317.9483032	0.16
323.2369385	0.14
324.2394409	0.38
326.3942261	0.12
340.4568481	1.28
341.0963745	1.73
345.0193481	0.15
347.3489380	0.07
350.1064453	0.33
358.7015381	0.10
383.2080688	0.05
386.2241821	0.07
387.8068848	0.07
395.1219482	0.48
398.3759155	0.11
400.0444946	0.47
407.3916016	0.19
409.1900024	0.28
415.7128296	0.08
416.3265381	0.14
428.1986694	1.41
434.1203613	0.79
446.2251587	0.12
452.1851807	1.73
453.1674805	0.22
462.0833740	0.11
468.1826172	0.07
470.1176147	58.00
480.2806396	0.04
484.8363647	0.36
487.9331665	0.04
503.0027466	0.99
510.2958374	0.28
514.6973877	0.18
519.1581421	0.09
534.1438599	0.03
548.4803467	0.72
556.0291138	0.16
557.2287598	0.73
565.3459473	0.11
569.4063110	0.15
577.3743286	0.31
578.3301392	0.25
585.7891235	0.05
588.1381226	0.10
592.3476562	0.10
596.0594482	0.27
604.0255737	0.06
607.4141235	0.32
609.8438110	0.03
614.2047729	0.68
615.1472778	0.05
633.4183960	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2209
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
94.89248657	2.52
108.9098511	2.21
118.8769989	0.99
119.8518524	4.45
125.9184113	5.59
133.2339172	3.22
139.0891266	2.58
140.790802	3.98
142.9920044	6.69
144.9093628	1.62
149.2528687	1.60
152.96875	1.19
157.0345459	1.49
171.1496887	4.16
180.9779816	3.37
195.0101929	2.68
197.4869843	7.22
198.7390137	6.55
207.2281189	5.18
210.1929321	1.76
210.8635254	1.85
217.4012451	4.35
223.4369507	1.57
229.2756958	5.41
239.2632751	6.97
240.5735779	3.67
242.7994385	5.73
247.2711792	3.42
250.3583984	0.90
253.1882935	1.22
255.308075	0.90
265.0751953	6.21
270.1304016	1.20
275.0390625	12.92
276.0835571	1.60
283.4253235	2.08
293.2103271	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.99804688	0.09
100.9296265	0.05
102.8172989	0.07
104.8864975	0.21
107.1018219	0.91
109.0453644	3.95
110.9795837	0.88
112.9619217	0.08
116.8902435	0.49
119.1055756	0.03
120.9596329	4.56
123.0982819	1.59
125.1004105	0.27
127.1124573	0.05
131.0982666	0.35
133.0291443	0.70
133.9414368	0.04
135.0473633	3.27
136.9700317	0.74
140.7233124	0.18
143.0833588	0.83
145.065979	0.18
147.0039368	2.16
149.06073	3.88
150.9169006	0.54
153.2440796	0.05
155.1784058	0.23
157.0726318	0.69
159.0164185	0.93
161.0354004	2.60
163.1612549	1.17
165.1386719	0.88
167.0039673	0.25
169.0785522	0.53
171.1425018	0.40
171.7909546	0.04
173.0613251	0.97
175.0741577	1.45
177.1240997	1.04
179.1592712	0.27
181.0454559	0.04
183.0507202	0.62
185.0965271	0.38
187.1211548	0.92
189.0851288	1.85
191.1131439	1.06
193.2829437	0.15
197.2357635	0.28
198.0872192	0.12
199.1014099	0.27
200.5862427	0.14
201.1896973	0.35
203.0664978	1.20
205.2208099	0.54
207.1121674	0.14
209.2156372	0.31
211.0720215	0.96
213.195343	0.29
215.3565674	0.29
217.1231689	2.21
219.1375122	0.05
223.2059326	0.76
225.4139404	0.03
227.0968933	0.33
228.2268066	0.11
229.3128662	0.39
231.1253357	0.84
233.1413269	0.21
235.6309204	0.08
239.4257507	0.05
241.2480774	0.24
243.0812988	0.15
245.195343	1.35
247.2088928	5.44
248.8925476	0.06
251.0767517	0.15
253.3893738	0.12
255.2789001	0.37
257.3094482	0.39
259.1119385	0.65
263.2020264	0.24
264.3198242	0.05
265.2027588	0.07
267.0164185	0.25
269.2484741	0.18
271.133728	0.55
277.4765015	0.11
279.0678711	0.31
280.276123	0.21
281.2831726	0.34
283.2763672	0.15
285.2820435	0.96
287.2823792	0.40
295.1517639	0.82
297.3288574	0.48
298.597229	0.19
299.2567139	1.65
300.0476074	0.03
303.4020386	0.20
305.2583008	1.97
307.4262695	0.03
310.0653687	0.10
313.359375	0.55
314.6896362	0.06
323.2302551	100.00
323.8813171	0.98
324.7118835	0.05
340.7713013	0.48
341.3713074	0.81
342.4476013	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	522.1827
Annotation	Herbicidin E
Peak:m/z	Relative Intensity
148.8025208	0.16
161.0755157	0.31
179.0714264	1.49
180.1285400	0.48
330.1341553	0.09
341.1281128	100.00
342.1798096	0.04
360.3829956	0.46
388.0674438	0.34
423.9908447	0.07
450.1389771	0.11
478.4258423	0.04
486.1007690	0.05
503.9467163	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	630.8779
Annotation	Unknow
Peak:m/z	Relative Intensity
228.7768555	0.04
244.9614868	0.05
247.1282501	0.08
271.2669678	0.03
272.9904785	2.10
274.1144104	0.01
289.0022888	4.17
290.2714844	0.04
304.9282532	0.09
311.0167236	0.02
346.8253784	0.07
387.0143433	1.96
402.9922485	20.27
404.2407227	0.02
405.2703247	0.04
443.0243530	0.03
457.4326172	0.03
470.7927246	0.03
477.4208984	0.07
490.2499390	0.05
500.2092285	0.02
501.0730591	0.55
515.2333374	0.12
516.8173218	100.00
517.4385986	0.42
529.0317993	0.09
541.0366211	0.03
545.1019897	0.04
547.0303345	0.05
554.5962524	0.03
556.5825806	0.03
575.0607300	0.04
584.0555420	0.14
584.9194946	0.55
587.0117798	0.19
598.7755737	0.26
600.9605103	0.05
602.8229370	0.09
604.8735352	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.9529114	0.80
106.9240723	1.03
108.9987793	1.70
110.9001465	0.22
116.9784088	0.59
119.0011597	0.04
120.9752197	2.87
122.9963531	1.14
125.0823898	0.25
126.5185318	0.16
127.1202087	0.10
128.9969788	0.04
130.9627991	1.06
132.9151611	0.20
134.5089417	0.38
135.1195679	4.02
137.1346436	1.54
138.0801392	0.10
142.8879547	0.27
144.0001221	0.16
145.0501099	0.52
146.8802795	3.22
148.1347961	0.25
149.0309143	1.76
150.8892365	0.19
152.8183746	0.14
155.0931549	0.63
156.8198395	1.43
158.8717041	0.97
160.9910583	2.36
162.9787903	0.80
165.1163635	0.70
166.2481537	0.21
169.1187897	0.88
171.0496674	0.36
173.0263367	1.66
174.9149475	1.34
176.9898071	0.71
179.0502472	0.22
181.0112457	0.29
183.0567627	0.36
185.2176819	0.19
187.10672	1.06
188.9390869	0.94
190.6494446	0.28
191.2732849	0.80
193.0444336	0.50
195.0767365	0.24
197.0783386	1.21
201.1122437	0.71
203.0406799	0.90
205.0980988	0.34
207.1743164	0.04
209.2720642	0.31
210.0188904	0.09
210.9547119	0.92
212.3230591	0.09
213.2063904	0.13
215.2628479	0.33
217.2362976	1.03
218.0345154	0.10
219.1896667	0.56
220.9776001	0.16
223.0391235	0.83
224.9762878	0.07
229.153656	0.13
230.10495	0.31
231.2021484	1.57
233.2142029	0.30
235.2444458	0.07
237.1533203	0.03
239.1099243	0.12
241.1860352	0.17
242.2984619	0.12
243.1564636	0.51
245.1725769	2.72
247.2843018	4.69
250.5558167	0.27
251.3324585	0.30
253.1086731	0.51
254.0410156	0.07
255.2162476	0.28
256.459137	0.14
257.0748596	0.26
259.2301636	0.56
263.3275146	0.09
265.2572632	0.33
267.4251404	0.09
269.2058105	0.03
270.3122559	0.28
271.1838684	0.64
275.1520081	0.11
277.4434204	0.24
278.3829651	0.06
279.225647	0.08
281.2429199	0.74
283.2124023	0.37
285.1414185	0.61
287.2808228	0.41
288.9824829	0.06
293.1289368	0.06
295.0944824	1.20
296.5064697	0.52
297.4622803	0.16
299.3875427	1.79
300.4507751	0.12
303.4532776	0.04
305.3117676	2.79
306.2359314	0.29
313.2831421	0.42
323.2467957	100.00
324.1801147	0.19
325.3603821	0.14
332.4916382	0.12
341.2274475	0.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Lactulose
Peak:m/z	Relative Intensity
110.7404861	0.01
161.1042480	0.02
165.3775940	0.03
172.8807526	0.02
191.1115417	0.47
213.0787354	0.08
234.1000366	0.03
283.0441895	0.05
284.6955566	0.03
324.9405518	0.03
326.2034912	0.03
341.1428833	100.00
342.8949585	0.57
368.9772034	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	442.1288
Annotation	Unknow
Peak:m/z	Relative Intensity
128.1006470	0.23
143.0421600	0.32
146.1820984	0.06
159.9811707	0.52
170.9634399	0.11
177.1302490	0.84
178.9132690	0.58
207.8462830	0.14
210.1088867	0.57
212.9241943	0.04
228.3518219	0.05
242.2379456	0.11
254.0763855	5.71
272.1293030	7.30
288.1481628	10.76
299.0598755	0.12
306.0867920	100.00
306.9471130	0.03
313.1261902	0.15
344.0238342	0.36
345.0240784	0.08
349.4867554	0.04
352.2693787	0.04
354.4000854	0.04
355.1679688	0.18
380.9305115	0.28
394.9553833	0.06
396.1147156	0.16
398.1488342	0.29
406.2435913	0.19
412.1032104	0.12
424.0426331	0.60
424.9320984	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	548.8523
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9189758	0.02
175.0377808	1.95
215.1224518	0.06
230.9562988	0.14
245.0148926	0.08
246.1950684	0.05
259.8124695	0.02
261.0576172	0.04
273.3145142	0.04
274.9683228	0.02
277.0481873	0.16
289.0128479	8.94
289.9449158	0.05
301.0663452	0.08
304.9865723	20.13
363.0755005	0.04
393.0327759	0.05
402.9516602	3.09
403.9774170	1.22
404.9358521	0.07
416.8719482	0.03
418.8773193	31.28
419.5152588	0.08
423.3203125	0.03
432.2835083	0.02
433.0313721	0.38
434.8458862	100.00
435.9223633	0.02
449.2991333	0.04
451.9859009	0.09
458.0430298	0.04
459.0656738	0.07
463.2072754	0.03
473.8081665	0.04
474.8701172	0.45
475.7235718	0.15
476.7030029	0.07
488.1498413	0.06
489.1289062	0.09
501.9755249	1.15
502.9505005	1.82
503.6657104	0.07
504.3613892	0.06
505.7604370	0.10
530.6940308	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	Lys Pro Ile
Peak:m/z	Relative Intensity
108.233757	0.07
109.9908752	0.18
113.8114853	0.09
115.1567154	0.06
123.9898224	2.01
125.0017242	0.05
127.1916656	0.12
128.9909821	1.55
129.9893188	0.14
142.0614777	5.34
143.1648865	0.20
152.0027466	3.79
154.8800964	0.23
156.2290344	0.14
161.1409302	0.08
165.1678772	0.09
169.1372375	0.57
170.002655	2.81
171.2261963	0.04
175.1270752	0.17
176.8816376	0.23
179.109848	0.17
181.2817535	0.08
187.6696472	0.03
191.0871735	0.03
195.9950409	0.06
197.1432495	0.56
198.3244629	0.07
201.0937653	0.12
207.1657104	0.14
209.1937256	0.04
210.154541	0.04
211.1531067	0.20
211.9588623	0.06
212.9026337	0.84
215.0612793	3.28
223.0511169	0.13
224.1660461	0.53
224.973114	0.04
226.1907959	0.66
227.1055908	0.07
229.1486511	100.00
230.2088318	0.10
240.3210144	0.44
242.1483459	0.57
250.9657593	0.21
252.0890503	0.77
258.2267456	7.06
262.1950378	0.20
270.2107849	0.75
270.9065552	0.04
272.2840881	0.65
273.0221558	0.30
280.1962891	2.15
281.2319336	0.22
283.0351257	0.15
284.1582336	0.04
288.6619873	0.04
294.1744995	0.31
298.2702332	27.04
299.3411865	0.05
310.3929443	0.12
311.0588074	0.36
312.3867188	0.20
313.0297546	0.10
319.8327637	0.16
326.5296631	0.10
339.230896	1.86
340.1537476	0.35
341.9247131	0.09
343.3072205	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	282.1189
Annotation	2'-O-Methyladenosine
Peak:m/z	Relative Intensity
81.9639740	0.03
84.9603500	0.01
98.1175003	0.01
133.0438080	0.05
133.9821167	0.08
149.9574890	100.00
162.2419434	0.02
190.8003693	0.08
192.1773376	0.58
200.2393188	0.35
201.2496948	0.07
206.9000244	0.02
210.8424683	0.01
222.2497864	0.01
227.1698608	0.06
234.5512390	0.01
236.0787354	0.20
238.1258545	0.03
246.9090576	0.05
250.8848877	0.05
254.0026855	0.02
261.1385498	0.01
264.0671997	0.64
265.8929443	0.01
272.8588257	0.14
273.4907227	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Didymocalyxin C
Peak:m/z	Relative Intensity
119.1694641	0.02
142.9458008	0.11
148.6912994	0.02
161.0830688	0.41
162.0712433	0.09
179.0835114	0.71
181.3350525	0.06
197.1506958	0.05
199.1053009	0.54
215.0783691	0.78
215.9397430	0.12
217.0630035	8.98
220.9802551	0.04
263.0910950	0.25
280.9538574	0.06
323.4527893	0.03
324.9727173	0.11
341.1419067	100.00
342.1830139	2.33
343.2461548	9.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
106.1659851	0.11
106.9258728	0.97
108.9894409	3.38
111.0473938	0.32
111.7731781	0.20
117.2114105	0.07
120.9757538	3.52
122.9358215	0.95
124.3296204	0.14
129.0684814	0.69
130.9336395	0.17
133.1776733	0.31
135.0705261	2.97
136.8922729	1.44
142.937149	0.50
144.8221436	0.12
146.9420776	1.63
148.0442505	0.11
149.0355225	1.74
151.1228027	0.29
153.0230408	0.58
153.9682312	0.08
155.3868866	0.08
157.098114	0.42
159.1048737	0.38
161.0231323	3.65
162.9405975	1.11
165.106308	0.47
167.0505371	0.34
169.1044312	1.90
170.1390381	0.11
171.1362915	0.18
173.1085205	2.60
174.9943542	0.95
177.1948242	1.14
179.2457886	0.15
180.9528961	0.48
183.0918732	1.46
185.0589905	0.19
187.1043396	2.26
189.0512695	1.11
191.1980743	1.13
192.140564	0.10
193.3069763	0.35
195.2513885	0.35
196.0723419	0.08
197.2307434	0.67
198.8656006	0.27
201.236145	0.13
202.9888916	1.20
205.0997467	0.34
209.0540771	1.02
210.6907043	0.08
213.0077515	0.45
214.0865479	0.19
217.1618652	0.67
219.1526794	0.06
219.9767456	0.07
221.2600403	0.24
222.9093323	0.41
224.8035278	0.09
227.021759	0.75
228.8139648	0.44
230.9985657	0.21
233.0820312	0.12
234.8999634	0.85
237.1886902	0.42
239.0931702	0.85
241.3137512	0.62
243.187439	0.09
245.0930786	1.87
247.1778564	7.20
248.0724182	0.20
248.8679199	0.73
251.0801392	0.29
253.1802063	1.40
257.1691895	0.59
259.3422546	0.97
263.1633911	0.65
265.1924438	0.09
266.206604	0.29
267.2562866	0.32
269.2920837	0.74
271.2191772	1.05
277.2447205	0.32
279.3600159	1.08
281.127655	0.24
283.1520691	0.72
284.600647	0.09
285.2638855	0.45
287.2138062	0.51
292.1847229	0.08
294.9893799	1.42
297.2767944	1.14
299.2568359	1.64
300.1216431	1.10
300.8970642	0.10
303.1403198	0.12
305.1322632	1.84
310.2044067	0.24
313.3172302	1.10
320.9532776	0.65
323.2387695	100.00
324.2974854	0.92
332.0977783	1.25
341.4234314	1.97
342.2710266	0.13
346.575531	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.98012543	0.12
98.86564636	0.41
102.8615646	0.11
104.8714218	0.30
106.9200439	3.16
108.9759979	2.35
110.9615707	0.40
113.0460739	0.26
115.1235123	0.06
116.2281952	0.17
117.0722656	1.02
119.073143	0.45
121.0527878	3.43
121.934906	0.07
123.1170044	1.70
125.0312958	1.32
127.0666656	0.11
129.0018311	0.98
130.87883	0.83
132.9775696	1.57
135.0613403	1.69
137.0505371	1.00
138.9678192	0.17
141.144043	0.27
143.0095215	3.98
144.9360352	0.36
147.0744629	0.54
149.1512451	1.34
150.928833	0.92
152.03302	0.98
153.1429138	0.10
155.0158997	0.48
156.9926758	2.18
159.0066223	1.95
161.1065369	1.02
163.0743256	0.33
164.9872894	1.95
166.863678	1.75
168.4573822	1.18
169.0662384	3.54
170.5858459	0.08
171.2295532	0.17
172.9987793	6.66
175.0321655	1.71
177.1307831	0.60
179.2697449	0.30
181.0467224	0.29
183.0735168	2.15
183.8986969	0.05
185.1377411	0.77
186.9608765	1.27
189.085434	0.43
190.0591736	0.19
191.1565552	0.21
192.978302	0.97
195.2005615	0.36
197.0470428	1.63
201.074585	0.97
203.217865	0.81
205.2025604	1.18
207.0813599	0.33
209.0288391	0.31
210.9554749	1.73
213.1375122	0.10
215.1033325	1.95
216.2416992	0.24
216.8738098	0.16
222.062439	0.14
223.2069702	3.95
225.1653748	0.19
227.0641785	0.75
228.0993652	2.70
229.0452271	5.97
230.1596985	0.47
231.3191528	0.55
233.131012	2.15
234.0333252	0.32
236.1968079	0.34
238.4516296	0.12
240.5119324	0.37
241.1414795	0.27
243.3101807	0.74
244.3201599	0.23
245.1435242	1.81
247.1494446	11.37
248.075531	1.16
250.9913025	0.23
255.0269775	0.24
255.9196777	0.31
257.162323	0.47
259.1217041	0.08
260.7024231	0.09
265.1793518	0.79
267.3846741	0.32
271.3431702	0.67
273.2347412	0.09
274.1789551	0.14
275.0189514	0.25
277.2980042	0.51
278.9739075	0.06
281.2996216	0.10
283.4586182	0.22
287.382782	0.63
292.9772339	0.28
295.3164673	3.45
296.7388916	0.11
299.3280029	2.06
300.0069885	0.61
301.1962891	0.15
303.1541443	0.11
305.2705994	4.76
306.0219421	0.49
310.3665466	0.06
313.1970215	1.39
318.0526733	0.06
320.100647	0.17
323.2417908	100.00
324.2209473	1.16
325.0711975	0.12
326.4283447	0.18
341.3844604	0.74
342.3334045	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.2631
Annotation	linoleamide
Peak:m/z	Relative Intensity
81.01376343	0.69
83.02009583	0.27
85.00437164	0.03
86.09395599	0.02
88.17815399	0.06
90.97593689	0.08
93.04501343	0.27
94.98744965	2.11
96.38825989	0.08
97.04011536	0.56
98.04247284	0.10
99.9591217	0.50
104.903595	0.22
106.998497	0.51
108.8977814	1.78
111.013504	0.60
113.1680908	0.18
114.0269318	1.05
119.0450821	0.22
121.0551682	1.99
123.0542908	1.54
124.0394592	0.09
124.9260864	0.68
126.0045624	0.20
127.1398315	0.58
127.9846954	2.44
131.3564758	0.08
133.0698853	0.66
135.0856323	3.35
137.1073914	2.08
139.0309143	1.49
140.3537598	0.30
142.0792236	3.97
145.0018921	0.13
147.1178284	1.67
149.1115417	4.22
151.0293579	2.18
153.1703796	1.11
154.1753387	0.59
156.0082245	3.06
156.9361725	0.05
158.3540955	0.20
161.0319977	2.35
163.0206451	2.74
165.0350037	4.86
166.9706726	1.47
168.1413269	1.39
170.1494598	2.91
173.1639557	0.08
175.1150818	2.29
177.16539	0.51
179.1208954	3.52
181.075119	0.50
182.0792847	1.33
184.1066589	4.16
189.1725922	1.45
191.0423279	0.34
193.0856934	1.22
196.1274719	1.71
197.0622253	0.05
198.2050781	3.28
202.1048889	0.04
203.2122498	1.16
205.1659241	0.72
206.0722656	0.08
206.9828491	0.23
208.3868713	0.05
210.1331787	2.15
212.3101196	0.03
217.1753845	0.32
219.136261	0.52
220.2355347	0.02
221.1600342	1.11
221.8388977	0.04
224.164917	2.00
231.015625	0.03
232.0982666	0.04
235.0812683	0.08
238.2405396	0.61
238.9770508	0.07
245.2358398	48.22
249.1535339	7.38
253.2775269	0.07
263.2457581	100.00
265.0574036	0.21
280.4235535	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.18
Annotation	Tanzawaic acid E
Peak:m/z	Relative Intensity
96.90802002	0.28
100.8878784	0.29
130.8819275	0.15
134.9928589	0.50
144.8404999	0.73
156.934845	0.14
159.0753479	0.20
161.0815887	0.21
175.2253571	0.37
201.0347595	0.44
209.2400818	0.22
216.8105469	0.25
227.0544434	1.06
228.3189697	0.39
232.8400574	0.23
239.2707214	0.17
243.1108398	0.24
245.1090088	2.21
247.0314941	0.33
250.8587646	0.30
252.9580383	0.44
259.1416016	0.37
260.2263794	0.18
262.0290527	0.70
269.0259705	0.25
271.1607361	100.00
272.3426208	0.27
273.1477356	1.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	257.144
Annotation	Unknow
Peak:m/z	Relative Intensity
80.8936920	0.04
84.0889435	0.01
85.9568405	0.02
108.8883820	0.01
113.0365448	0.02
115.9168854	0.01
116.7496796	0.01
121.2076263	0.05
128.7602386	0.04
130.1077118	0.04
131.1558990	0.04
141.0305328	0.07
144.8813019	0.03
146.9560089	0.06
150.9898224	0.03
155.1606293	0.08
156.0206451	0.05
159.0399323	0.04
165.1404114	0.01
168.9306030	0.02
176.2150421	0.01
180.6669312	0.06
181.2874603	0.03
183.0979614	1.07
183.9835968	0.06
186.9347076	0.01
188.0229340	0.04
192.8724060	0.08
193.9924622	0.02
195.0559540	0.03
196.8889618	0.06
199.3030090	0.39
201.1204071	11.52
202.1088257	0.63
210.9078064	0.39
211.8741913	0.04
212.9754486	0.01
218.9555511	0.04
222.1511230	0.69
228.9812317	14.77
230.0622864	0.89
231.5151825	0.08
233.3623199	0.05
234.9063110	0.04
237.1351166	1.69
238.9697418	0.39
241.1956177	0.02
242.8958740	0.64
245.5019989	5.97
246.2922363	0.14
247.1942139	0.14
248.1864166	0.06
251.2117157	1.31
252.0333405	0.01
260.1356812	0.03
262.1594238	1.47
262.8870850	0.06
264.2003174	0.05
268.0907898	0.05
271.2140503	100.00
272.4185791	0.10
273.5768127	0.05
282.2425842	0.13
321.2436523	0.11
327.9588928	0.36
337.6076050	0.05
338.3298645	0.14
339.4352722	0.05
347.0466003	0.05
352.1400757	0.17
355.2578125	0.12
367.7895203	0.36
395.3161926	0.02
397.4283142	0.29
400.2595825	0.02
414.7015991	0.07
435.3639221	0.03
477.1624146	0.01
484.1945190	0.01
541.5592651	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	346.1483
Annotation	Leptoclinidamine A
Peak:m/z	Relative Intensity
116.8385544	0.08
118.0390244	0.18
120.1119461	0.24
132.0106354	0.88
134.1116333	0.36
138.0094604	0.15
145.1919098	0.19
148.0391846	7.15
149.8387451	0.24
151.1718140	0.11
151.9703979	0.09
153.1994019	0.08
162.9275818	0.64
165.0982666	0.39
166.2423401	0.17
179.1257629	0.49
181.8991394	0.05
183.9249878	0.81
185.0304108	0.34
187.0708771	0.06
213.0139160	0.99
214.1727600	0.10
218.2178955	0.17
231.1247864	0.32
234.0306396	0.14
238.9700928	0.15
246.3746338	0.05
247.1734619	0.48
255.6214905	0.06
256.3231812	0.12
264.9767456	0.11
272.3311768	0.36
274.9461365	0.22
281.3176270	1.43
282.1491089	0.28
292.2160645	0.50
300.0678406	0.67
302.1235962	0.27
304.9639282	0.15
310.1195984	0.24
311.1810303	0.28
314.7832336	0.30
317.5664062	0.19
318.2164612	0.36
328.0983887	100.00
329.1886902	0.07
336.7280579	0.24
337.8342285	0.29
339.9536743	0.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.0477066	0.22
102.6719208	0.06
104.8964386	0.17
107.0060425	1.37
108.9495773	2.46
111.1377029	0.25
113.1833649	0.14
116.7820129	0.35
117.6623535	0.23
119.074379	0.11
121.0547714	3.88
123.0530853	0.69
124.9029236	0.25
129.1103668	0.08
129.8175659	0.06
131.0862732	0.89
132.9152222	0.38
135.0777893	4.10
137.1859741	0.26
140.7811127	0.15
143.0439911	1.00
144.9606934	0.41
147.0783386	2.01
149.02565	2.31
150.1578064	0.17
151.130249	1.29
151.9446411	0.12
152.8790131	0.21
155.0906982	0.38
157.1414185	1.25
159.0776978	0.77
160.9534302	2.05
163.176712	0.47
165.0835114	0.33
168.9871826	1.61
170.9921265	1.28
173.0965729	0.78
174.0883789	0.09
174.9309692	0.55
177.1792908	1.03
178.0008698	0.04
179.0526886	0.30
183.042984	0.88
184.0694275	0.09
185.1639862	0.09
187.0836792	1.42
187.9028625	0.13
189.102951	0.95
190.454895	0.07
191.1153412	0.64
193.0767822	0.12
195.0530701	0.39
196.1887207	0.05
197.1571503	0.64
199.2007751	0.16
200.9759979	0.06
203.0589142	0.79
205.0798645	0.99
207.323822	0.12
211.0147095	1.50
213.1634827	0.49
215.1583252	0.45
217.1291199	1.06
219.252533	0.08
220.4197998	0.11
221.144928	0.20
222.2151794	0.04
223.2017822	0.32
224.1538391	0.33
225.0907898	0.27
226.9289246	0.50
228.1322632	0.29
229.0580444	0.19
229.9732971	0.05
231.2573853	1.17
232.7337036	0.09
235.1320801	0.66
238.8739929	0.33
241.1324768	0.30
243.0505066	0.35
245.1852417	0.90
247.1942749	4.87
250.0650024	0.04
251.1737366	0.20
253.1317749	0.83
255.3211365	0.78
257.0029297	0.83
257.6186829	0.09
259.1172485	0.84
263.1269531	0.04
265.5382385	0.18
267.0042114	0.72
271.1254883	0.18
276.8315735	0.15
279.4109497	0.16
280.1234741	0.14
281.0973206	0.59
283.1115112	0.63
285.3288269	0.20
286.3565369	0.06
287.2610474	0.30
288.1789551	0.14
292.7129517	0.13
295.2753296	0.88
296.2043762	0.05
296.9786072	0.76
299.2696533	1.14
301.146698	0.32
305.2961121	3.75
307.2662659	0.07
309.206543	0.06
313.3145752	0.53
316.8665771	0.14
317.5291138	0.03
320.8312073	0.34
323.2291565	100.00
324.1929321	0.22
325.2402344	0.07
332.1450806	0.22
337.1098328	0.05
341.1486511	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	308.0901
Annotation	Glutathione
Peak:m/z	Relative Intensity
115.9688644	0.75
130.0868530	0.40
130.9176636	0.03
143.9542236	2.47
151.1522827	0.12
161.9007568	25.36
174.8368073	0.08
178.9673920	100.00
192.7842560	0.03
204.7095032	0.07
212.1223755	0.50
215.0800171	0.63
233.0025635	15.58
233.7602844	0.02
239.5694885	0.05
243.5899048	0.05
245.0795288	0.99
262.0561829	0.07
264.1207886	0.04
272.1232300	1.35
273.1466980	0.02
277.2254639	0.03
290.1160278	5.19
291.1826172	1.28
291.9835815	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Unknow
Peak:m/z	Relative Intensity
119.0696106	0.04
143.0074005	0.11
161.1263275	0.06
178.4816284	0.05
179.1092072	0.68
197.0258331	0.58
198.9056549	0.04
199.5613403	0.02
215.0830078	8.70
230.2360840	0.03
242.9877930	0.04
248.2233887	0.04
263.0718994	0.09
273.2632446	0.04
315.3555908	0.03
333.1150513	0.17
341.1296997	100.00
355.8005676	0.03
359.0129089	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1117
Annotation	D-Fructofuranose 1,2':2,3'-dianhydride
Peak:m/z	Relative Intensity
96.9775238	1.84
103.0298309	0.10
108.9748840	0.57
119.0729370	0.11
123.0232697	0.22
126.9944839	5.67
135.1904449	0.18
136.2569580	0.07
138.9625549	0.06
144.9183960	11.22
147.8756409	0.07
149.1121216	0.06
153.2199402	0.04
162.7758026	12.85
163.8941345	0.51
164.9040833	0.10
166.0386963	0.09
171.1349487	0.11
179.0544739	0.19
181.0670013	0.21
184.1185303	0.40
185.0071106	0.70
186.8962708	0.06
188.8945007	0.22
192.8238220	0.42
194.8496704	0.09
196.0782166	0.06
198.9845581	1.27
201.3523865	0.08
204.9183960	0.19
207.1673584	0.49
208.0228882	0.09
210.5024414	0.59
212.0591431	2.82
213.1343079	1.73
216.8048096	1.42
221.7434082	0.11
222.9700623	1.23
225.0907288	1.05
228.9835205	0.25
233.9081116	0.23
234.9214783	0.57
237.5439453	0.18
239.3061829	0.04
240.0482788	0.40
241.1883240	0.60
243.2464600	0.20
244.5587463	0.55
245.8752136	0.32
246.9815369	1.80
250.1324768	0.13
252.5488281	0.97
253.1537170	2.77
255.1012573	0.09
258.7600708	8.53
259.4367065	0.27
264.9653931	0.32
266.1457520	0.10
268.1546021	80.85
269.1567383	100.00
270.9936523	14.65
277.0277710	0.20
278.8893127	0.07
280.7412109	0.22
281.4921570	0.15
283.8131714	0.98
287.1935425	0.21
288.2586670	6.69
288.9098816	46.28
294.9688110	0.31
297.1809387	0.28
301.4941406	0.17
303.1690063	0.12
305.3375549	0.13
307.0883179	6.36
308.3260498	0.08
309.3325500	0.82
325.1284180	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.1038
Annotation	Phenylalanyl-Serine
Peak:m/z	Relative Intensity
89.1933594	0.06
101.0005493	0.04
109.0357971	0.51
127.0557098	3.62
127.9788818	0.42
130.7671661	0.03
145.0057526	100.00
146.0206299	0.04
161.0449524	0.13
166.7900391	0.05
171.1831207	0.14
179.0880890	0.04
191.0148773	0.05
193.1304932	0.08
204.0959625	0.22
205.0780792	0.45
207.0985413	0.11
208.1364136	0.04
209.1807251	0.04
223.0634613	0.05
232.9694977	0.12
234.2134247	0.03
251.0752716	0.45
252.3339844	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	747.08
Annotation	Unknow
Peak:m/z	Relative Intensity
232.0523376	0.48
258.7890625	0.18
274.3167114	0.14
274.9626160	0.64
281.8701477	0.24
290.8012390	0.71
322.9817505	0.31
341.0251770	0.11
354.9342041	0.21
356.5170593	0.13
358.7276306	2.37
374.3663330	0.44
383.9744873	0.06
390.5737915	0.57
411.0106201	0.12
422.7259521	0.13
426.7977295	5.23
436.9137573	0.33
442.1813965	0.09
442.7859497	2.51
465.9039917	0.08
483.0219116	0.33
486.3814087	0.08
492.7999878	0.33
494.7791748	10.52
503.2290649	0.22
510.6170044	32.14
511.2531738	0.11
520.3811646	0.48
525.1022339	0.17
526.6890869	6.81
535.0291748	0.13
538.6506958	0.71
546.7985840	0.17
547.9823608	0.17
550.8446045	0.79
556.6829224	0.16
563.1726074	0.28
566.8826294	0.06
570.6493530	0.30
572.7993774	0.64
576.6362305	0.58
578.6710815	30.71
580.7536011	1.84
584.7543945	0.82
588.0200806	0.16
590.6998291	0.15
593.0010376	0.31
594.4705200	36.59
595.0888062	1.89
600.7932739	0.40
603.0244751	0.05
610.5282593	6.10
615.0535889	0.25
616.9614868	1.89
633.0095215	0.16
640.5558472	10.42
642.9295654	0.63
649.0692749	0.11
660.6301880	3.61
662.5135498	100.00
663.5015259	0.92
664.2484131	0.61
677.9678955	0.79
678.7536011	6.96
679.5574341	0.09
686.7309570	0.18
693.5774536	0.11
700.7477417	18.10
701.5405884	0.20
703.5506592	0.55
704.2204590	0.17
704.9662476	1.74
722.6369019	0.19
723.6945190	1.13
727.5936279	0.13
729.3655396	0.19
730.4801636	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	798.8
Annotation	Unknow
Peak:m/z	Relative Intensity
227.1973877	0.18
288.8622131	0.03
369.3705139	0.18
396.3692017	0.07
498.3071289	0.06
507.0799561	0.26
508.0290527	0.10
581.8355713	0.16
589.7194824	0.34
620.6157227	0.29
636.1027832	0.77
637.1067505	0.11
638.1183472	0.12
668.8454590	0.19
670.1477051	0.05
690.3048706	0.09
702.8790283	0.29
717.5279541	0.05
724.8789673	0.35
735.5068970	0.56
736.7886353	0.24
743.7278442	0.13
754.3790894	0.30
755.4602661	0.08
762.7766724	0.03
764.2313232	0.08
765.1411743	0.10
766.5867920	0.35
770.2097168	100.00
771.2005615	2.76
771.8651123	0.71
772.6906738	0.69
773.8513794	0.13
774.6442871	0.26
776.0226440	0.16
777.0682373	0.16
777.9450073	0.13
779.9122314	0.23
784.3646851	0.27
791.3948364	0.38
824.2332153	0.12
824.8405762	0.15
825.6448975	0.08
877.1303711	0.28
877.9700317	0.09
881.3980103	0.64
884.5276489	0.13
891.4281616	0.14
901.7996216	0.52
905.6743164	3.58
906.4052124	1.35
907.1223145	0.17
908.4622192	0.06
911.2322388	0.14
920.8730469	0.28
937.7203979	0.76
938.8695679	0.13
940.1218262	0.09
962.2038574	7.00
962.8826294	5.46
964.0949097	0.30
965.1061401	0.20
1043.9582520	0.88
1045.0896000	0.24
1052.5595700	0.07
1054.5803220	0.43
1056.6984860	0.03
1062.7663570	0.06
1129.6308590	0.11
1159.0971680	0.26
1166.2548830	0.34
1191.5124510	0.14
1202.0959470	0.37
1255.2550050	0.10
1288.6083980	0.06
1417.9739990	0.10
1534.7514650	0.07
1559.5858150	0.08
1616.2683110	0.03
1807.5734860	28.84
1884.2415770	0.08
1978.6755370	6.61
1988.9791260	1.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	475.1524
Annotation	Dorsmanin F
Peak:m/z	Relative Intensity
225.0552063	0.06
253.1282654	0.12
261.4076538	0.21
272.9913025	0.18
287.0881958	0.14
341.5137024	0.06
357.3309326	0.22
376.3068542	0.09
395.1868286	0.10
415.5965881	0.37
429.1068115	1.05
439.2720032	100.00
441.8786011	0.13
455.0872803	0.07
457.2757568	0.24
475.0571594	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
78.88066864	0.78
80.97758484	1.52
82.98861694	1.49
83.96865845	0.53
85.12493896	2.02
86.91163635	0.19
90.89161682	0.46
93.17051697	0.37
95.03406525	3.16
97.06898499	1.88
99.10693359	0.29
102.9576111	0.85
103.9695892	0.22
104.8334503	0.32
106.881958	0.79
108.9608765	2.89
111.0802612	0.80
113.026535	0.80
118.8842316	0.98
120.9946136	1.52
123.04953	2.76
124.9325409	0.70
127.0113373	1.11
128.8992157	5.62
129.9556274	0.92
131.0227814	0.20
133.0576019	1.93
133.9690094	0.53
135.0587006	1.59
137.164032	0.90
138.9855194	1.87
140.0208893	0.46
140.9411316	0.61
147.193985	2.43
149.1734161	1.88
151.0078125	64.24
151.8950348	4.25
152.9728241	0.66
154.982254	3.09
156.7539825	0.24
158.9680634	0.14
161.1040039	2.15
163.1374054	0.39
164.9711151	2.52
165.9504852	1.32
167.0709381	2.79
169.0033264	4.59
169.8548889	0.36
171.0838165	1.12
173.3858185	0.15
175.1279297	3.05
177.0219116	1.46
179.0957031	0.88
182.071701	2.75
183.067276	1.40
185.1504364	1.42
189.1816406	1.48
190.1951904	0.61
191.4032135	0.49
192.2591705	0.34
193.2123566	1.61
194.1406708	0.46
195.0960999	3.85
197.1415863	3.89
198.0715332	0.41
199.0720673	1.29
204.9099274	1.02
207.1302032	4.46
209.0559387	2.41
211.069397	7.27
211.9942474	2.85
217.1979523	16.84
223.1013031	0.70
224.1864471	0.34
225.125473	12.62
226.2279205	1.57
230.712326	0.12
235.1835327	46.29
236.2302704	0.45
238.0790253	15.53
244.1607056	1.54
251.0968018	0.39
253.0807495	100.00
254.0823822	22.26
255.8692627	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
72.71065521	0.23
76.96333313	0.72
78.96524811	1.04
81.13476562	4.28
81.89393616	0.57
82.74809265	1.03
84.91740417	3.09
87.16520691	0.40
88.75727844	0.49
90.9213562	0.47
95.0100708	6.09
99.13002014	0.58
103.0167389	2.18
104.7993927	1.53
107.0290527	10.80
108.980484	2.66
110.2062531	0.71
111.0267181	2.68
112.8309631	0.91
114.9990082	1.08
117.1607208	0.18
118.867569	2.78
120.8010406	0.85
123.0480652	5.56
124.9887543	1.57
127.0689697	3.43
129.02948	5.97
131.1511536	0.21
133.0327148	6.34
134.993042	5.42
136.9555359	5.48
138.9027863	4.14
139.943924	0.23
140.9209442	4.89
142.7707825	2.82
145.1577606	0.76
147.0232849	2.63
149.1721802	4.84
150.9152374	79.66
152.0544281	9.50
154.1879425	1.61
154.8377838	2.50
157.0469208	0.73
159.14888	2.33
161.0661316	1.24
161.8741302	1.06
163.1459045	0.81
165.0576477	0.89
166.0567017	0.47
168.4038696	0.59
169.1153412	4.25
171.0688324	1.83
173.1004333	0.68
175.1821136	1.91
176.2619629	1.64
176.9198914	1.48
179.1286469	5.76
181.0523987	2.81
182.9214325	11.50
185.0004425	2.42
188.9679718	1.46
190.0965576	0.91
191.3798065	0.68
193.224472	2.81
194.074234	0.94
195.1730042	4.68
197.0183105	11.76
199.1179199	2.02
205.1122894	2.24
207.1557465	7.34
207.9465332	0.66
209.0239716	0.73
210.0757904	1.49
211.0867615	8.24
213.0331116	0.33
217.0875397	23.70
217.7726898	0.63
223.1980438	1.00
224.2498779	4.55
225.1972198	10.11
229.8912811	0.39
233.0917969	0.29
235.1671753	59.84
236.347229	1.55
238.0504913	9.77
239.1264038	1.92
244.0998993	2.27
253.0769043	100.00
254.1920624	23.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	333.205
Annotation	Blumiolide A
Peak:m/z	Relative Intensity
105.1799774	0.07
108.0880432	0.08
110.7521439	0.06
117.0916901	0.85
122.3400574	0.07
122.9683685	0.10
127.1742401	0.12
134.7448425	0.04
137.0450439	0.11
138.6736145	0.09
140.8179779	0.37
143.0317078	0.03
150.9908142	0.11
157.1284485	0.23
166.1581573	0.06
175.0434265	0.05
177.1619568	0.12
181.1240540	0.12
185.2748566	0.12
186.7057037	0.06
190.8726349	0.11
193.1521301	1.44
197.3281097	0.09
199.0338898	0.24
201.2747955	0.26
203.2074432	0.05
206.9870605	0.11
219.1700439	0.12
223.0086060	0.04
229.1513672	0.20
231.1028137	0.12
241.3571777	0.06
243.2366333	0.10
245.1625977	0.27
245.8826904	0.08
249.1235657	0.19
256.0592041	0.06
257.0627747	0.59
259.3267212	0.39
262.1033325	0.18
269.1283569	0.82
270.2579956	0.05
271.2775879	0.16
273.1590576	0.45
275.1854858	0.11
279.2246704	0.09
283.3469543	0.10
285.5444946	0.05
287.0802917	13.38
288.0819397	0.27
288.8695984	0.49
291.3089600	0.07
292.0349731	0.16
297.1700439	0.57
303.2034607	6.37
305.4581299	0.32
306.5562744	0.06
313.2210693	0.25
315.0798950	100.00
315.9979553	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	251.1384
Annotation	Paucine
Peak:m/z	Relative Intensity
76.7988434	0.10
78.9041824	0.49
83.8126678	0.08
94.6795960	0.08
101.0314178	0.05
102.9611206	0.69
104.9176331	52.21
115.2128143	0.04
116.6014404	0.19
117.2467346	0.07
120.1708527	0.03
121.9361572	100.00
123.1030579	0.09
129.9667358	0.18
133.1022339	0.08
134.7060394	0.03
144.9588776	0.02
146.9607849	0.04
153.1704865	0.07
157.1428986	0.07
159.2194366	0.09
163.3159027	0.07
171.2357941	0.19
173.1500092	0.05
174.8928528	0.45
177.2579193	0.10
180.7595367	0.12
190.8063507	0.18
205.1372833	8.78
207.2539215	0.05
208.2587738	0.07
209.1984558	0.09
210.0758972	0.82
215.1020660	0.08
219.3089905	0.11
223.0875549	0.04
230.9807281	0.07
234.0526733	90.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	526.76
Annotation	Unknow
Peak:m/z	Relative Intensity
185.0869141	0.24
190.7661743	0.67
206.8307037	1.08
274.8665771	2.91
290.8605347	14.79
318.7187500	0.09
322.8449707	0.36
347.1715698	1.06
351.0174561	0.33
352.9146118	0.17
358.6806030	9.06
360.9276733	0.24
363.8909912	0.23
365.1929932	2.66
374.8678589	22.03
375.6043091	0.13
378.8408203	0.07
390.8372803	0.38
398.9821167	0.44
406.8869629	0.90
417.1754761	0.14
420.7925415	9.87
440.7647095	0.12
442.6937256	100.00
458.7582397	5.95
462.3973389	0.87
463.0505371	0.17
466.7504883	5.17
480.6779175	14.43
481.5176392	0.05
483.8885498	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
112.837616	0.58
115.2565384	0.86
129.0141602	1.51
146.7219543	0.13
148.0714417	0.44
148.7693176	0.54
170.9446106	0.75
173.0693359	0.59
187.1363983	1.25
189.1489105	0.71
199.2312622	1.33
201.3568878	1.17
203.0438538	0.29
209.0321808	0.48
213.1244812	0.25
214.9577942	1.70
217.2270203	0.49
218.0415039	0.25
219.8195801	0.52
227.1479187	1.11
229.2224426	1.74
231.1438904	1.26
241.1859436	1.15
243.0450439	1.86
245.2082214	0.23
251.1485901	0.31
255.4155579	0.46
257.2502747	0.43
261.4847107	0.49
262.090332	0.39
263.4251709	0.94
265.2127075	0.82
269.4141235	1.13
271.0895081	5.20
273.2155762	0.25
278.1773987	0.15
283.2651062	0.39
283.8858337	0.90
285.2936401	4.12
287.0983887	1.80
293.1528931	0.64
294.9825439	2.73
297.249939	3.63
299.3254089	0.68
301.5140076	0.54
311.2130737	2.00
313.2871399	12.48
315.1508484	0.62
316.5140381	0.29
319.0314331	0.50
321.3322754	1.46
323.2880554	7.81
325.0865784	0.50
329.1418152	0.75
330.9732666	0.53
339.2389526	100.00
340.0296631	0.19
341.3501282	13.51
342.4640808	0.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	367.1487
Annotation	Tetrahydropentoxyline
Peak:m/z	Relative Intensity
116.0965042	0.06
122.7702866	0.06
156.0702820	0.08
157.0844421	0.05
159.1384888	0.05
168.7657471	0.03
192.9911652	0.09
196.0615845	0.04
201.2261200	0.05
202.0947876	0.10
203.0954132	0.07
205.2381287	0.08
205.9091034	0.06
209.0481567	0.08
217.1736755	0.17
229.1894836	11.49
230.1654968	0.20
232.9754028	0.06
235.9593506	0.06
240.1062317	0.05
244.1199341	0.18
246.9421692	0.17
249.0439758	0.06
251.2169495	0.23
254.2648621	0.07
257.1912842	0.05
259.0892944	1.12
262.1790771	0.03
271.0828247	3.90
276.1974792	0.49
277.1387634	0.13
281.0977783	0.20
296.3163452	0.06
298.4306030	0.19
305.1976929	0.20
307.0136719	0.55
313.1289978	0.42
319.2698975	0.17
321.1069946	0.18
322.2518311	0.11
323.1149902	0.12
325.1119995	0.04
326.0735474	0.22
326.8750000	0.06
331.2208862	12.39
337.2699585	0.06
347.1216431	0.06
349.1129456	100.00
349.8974609	0.73
350.5036926	0.04
352.2032776	0.39
357.7193909	0.08
358.3860474	0.40
361.4449768	0.15
366.2347717	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	386.9393
Annotation	Unknow
Peak:m/z	Relative Intensity
115.0622177	0.04
158.9456329	0.46
199.0214233	0.04
201.0584869	0.01
229.0875549	0.14
244.9691467	0.01
257.3349915	0.03
270.2623291	0.02
271.1483765	0.05
272.9450073	100.00
301.8784180	0.05
313.0469360	0.14
323.1169434	0.02
328.8952026	0.02
341.1559143	0.27
342.4398193	0.07
343.0632324	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	673.1885
Annotation	Nallaflavanone
Peak:m/z	Relative Intensity
237.0457153	0.05
264.9169922	0.17
283.3521118	0.12
322.3543701	0.04
337.7575378	0.07
340.1394958	1.91
349.3348389	0.05
352.1029663	0.06
385.3624878	0.06
393.7838745	0.04
399.9727783	0.11
407.2865601	0.15
423.2982788	0.18
425.2085571	0.14
431.3553467	0.06
467.1375122	0.14
469.2005005	100.00
491.4247437	0.23
523.4111938	0.16
526.5390015	0.05
549.1782837	0.05
557.2741699	0.07
576.2453613	0.19
595.6720581	0.04
599.0225830	0.18
611.5027466	0.12
612.4389038	0.05
613.4110718	0.28
625.2597656	0.14
628.5081787	0.14
635.1990356	0.09
639.9474487	0.24
643.4512939	0.09
655.3250732	2.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	340.1017
Annotation	6-hydroxyindole-3-carboxylic acd 6-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
96.9589996	0.02
100.9557190	0.02
102.9416809	0.06
104.0390472	0.03
107.7399750	0.04
115.7264252	0.05
121.0480042	0.06
127.1790390	0.05
137.7814484	0.22
141.1366272	0.03
142.7959290	0.03
148.9458160	0.04
156.0182495	0.10
170.1431580	0.04
175.3799438	0.05
176.0269318	0.03
177.0919647	0.02
177.9019623	0.37
185.1310883	0.11
191.9887543	0.02
196.2285461	0.03
209.7019043	0.73
212.2000732	0.08
214.3428040	0.07
219.1646729	0.02
227.0308533	0.03
228.1827087	0.19
229.0805054	0.11
232.2513733	0.02
233.1321716	0.03
235.5537415	0.03
237.2686157	0.03
251.0794067	0.05
252.3213501	0.12
262.1990967	0.03
267.1362915	0.03
268.2091675	0.09
269.1860657	0.07
273.4135132	0.05
274.3460388	0.02
276.1119385	1.26
280.2579346	0.07
281.2174072	0.08
283.9708862	0.03
285.9683228	0.45
290.8734436	0.12
294.0333252	68.62
294.6669312	0.05
296.5317078	0.08
299.0455017	0.22
304.0317993	4.40
305.9566040	0.07
309.0517273	0.14
311.5906982	0.05
321.9616699	100.00
323.0974121	0.12
324.9826660	0.04
331.2751465	0.17
339.4888611	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
77.01605988	0.17
80.8276825	0.28
82.99252319	0.26
94.75888824	1.71
96.90856934	0.60
98.94535828	0.35
103.0301819	3.55
103.8432312	0.31
105.0803986	0.41
105.7983704	0.26
106.9846802	1.48
109.0961151	1.29
114.8940582	0.56
117.6587219	0.24
118.8744812	0.13
122.3085785	0.42
122.9940948	1.08
125.0735931	0.46
126.9513855	0.62
128.9075623	8.29
129.9437103	1.00
133.1062775	0.62
135.1031036	0.55
137.1805878	0.43
141.147522	0.75
143.0254974	0.41
147.0244904	0.26
147.6261444	0.35
150.9091797	64.28
151.9597931	6.56
153.025177	1.39
155.1364441	0.86
156.9534302	1.05
161.162674	0.11
163.2598724	0.33
165.0484161	0.39
166.3967133	0.76
167.0618591	0.87
169.2196198	0.73
170.1656799	0.33
170.8842163	0.11
173.2815399	0.24
175.2827759	0.37
177.1074371	0.30
178.3263397	0.74
178.9370422	1.88
181.9759674	0.49
183.022644	0.37
185.019455	3.69
185.9239044	0.40
189.151825	0.31
190.0813751	1.19
193.2826385	0.89
194.1289825	1.13
195.2737427	0.33
196.1751862	0.12
197.194931	2.75
198.5977936	0.13
207.1765747	0.65
208.0557556	0.12
209.1804657	0.31
210.6886292	1.71
211.4978333	0.29
214.989624	0.29
217.1440887	2.33
225.1252594	7.36
226.2848358	1.26
235.0873566	9.14
238.0249481	12.06
239.0646515	0.46
243.852478	0.51
251.3567505	0.17
253.0803223	100.00
254.2234039	20.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.16073608	0.02
99.04203033	0.04
105.2128601	0.14
107.070694	1.14
108.9115753	0.89
110.9998016	0.23
111.7297211	0.03
117.0554886	0.33
118.0264053	0.08
119.1049423	0.12
121.0311813	1.84
122.9391327	0.48
124.98423	0.35
127.0117035	0.08
128.9908752	0.29
130.9986572	0.71
133.0018005	0.64
135.0202942	2.19
136.192276	0.02
137.1330261	0.16
140.9554138	0.21
143.0888672	1.91
145.1088562	0.40
146.9938049	0.37
148.9943237	0.72
151.0671997	0.81
152.200119	0.07
152.9589691	0.19
155.052948	0.28
157.0735168	1.58
159.0071716	0.91
161.0055847	0.32
163.1234436	0.52
165.1176758	0.36
165.9672241	0.04
167.114212	0.32
168.9830475	0.93
171.0733185	0.71
173.0610809	2.01
174.8943176	0.22
175.5042114	0.14
176.5702209	0.11
177.1720428	0.20
179.0970459	0.11
180.9512787	0.22
183.0695038	1.28
185.079483	0.21
187.0195465	2.39
189.0489197	0.30
191.276001	0.35
193.335022	0.15
194.9634705	0.24
196.306488	0.15
197.1205292	0.64
198.9855957	0.22
201.2708588	0.26
205.2203827	0.86
209.1304016	0.47
211.0318298	1.11
213.4311523	0.03
215.1036377	0.60
217.1854858	0.46
218.4449768	0.05
219.2790833	0.14
221.3319092	0.04
223.2326965	0.99
225.2399597	0.34
227.0946655	0.17
229.2499695	0.20
231.0708008	0.07
233.3035278	0.19
235.1708374	0.21
238.9188843	0.04
241.0048523	0.04
243.1089172	0.09
245.3315125	1.53
247.3240967	3.83
249.2359314	0.06
251.3626099	0.25
252.1445618	0.08
253.3804321	0.17
254.0770874	0.08
255.1260376	0.24
256.3316345	0.03
257.1884155	0.17
259.208252	0.55
262.9243164	0.14
265.2880859	0.20
267.3206177	0.05
269.3118896	0.10
271.3977661	0.15
273.3400269	0.15
277.2572632	0.35
278.1176147	0.09
281.278595	0.47
283.2689819	0.14
285.1464844	0.17
287.2796631	0.42
291.5679932	0.07
295.1989746	1.02
296.1967773	0.16
297.209259	0.02
299.3216858	1.70
300.3631592	0.05
301.4165955	0.03
305.2661743	3.59
311.1994019	0.02
313.2808838	1.28
321.1912231	0.07
323.2461548	100.00
323.9197693	0.71
324.7243042	0.03
325.598938	0.06
326.4458008	0.09
341.1922302	1.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	677.28
Annotation	Hv-NCC-1
Peak:m/z	Relative Intensity
337.3706665	0.15
354.7968750	0.13
365.1516113	0.16
376.9776001	0.12
393.6708984	0.09
402.4295044	0.37
444.2211914	0.12
448.3034668	0.08
450.3255615	0.18
462.4573364	1.00
488.2600098	1.86
489.4109497	0.09
502.3314819	0.22
508.6755371	0.06
515.1874390	0.17
520.3114624	6.60
524.5065308	0.05
541.4156494	2.61
546.8086548	0.20
548.2481079	0.26
581.1821289	0.06
583.2316284	1.84
583.9091797	0.09
585.3474731	18.37
589.2271729	0.25
601.4172974	2.25
617.3309937	57.39
621.3152466	0.07
627.2605591	12.85
627.8618164	0.46
630.6807861	0.07
633.4688110	0.48
635.6682739	0.08
645.2775269	100.00
646.1920166	0.09
659.2516479	22.49
659.8615723	0.55
677.7490845	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.3383
Annotation	PC(18:2(2E,4E)/0:0)
Peak:m/z	Relative Intensity
165.9083557	0.48
183.9891357	100.00
197.0328217	0.04
207.2059631	0.05
227.1685181	0.05
258.1521606	0.33
275.3814087	0.09
296.8860474	0.10
303.2872314	0.11
311.0790405	0.04
326.9436646	0.16
337.0035400	0.07
361.1593018	0.14
380.2023926	0.15
398.6212769	0.12
410.5455322	0.05
421.5204468	0.09
423.2058105	0.05
427.9068604	0.21
453.2908936	0.12
457.2338867	0.05
460.3059082	0.05
466.5640869	0.11
468.6127319	0.06
471.3630981	0.27
475.5926514	0.11
485.3379517	0.06
486.5230103	0.05
489.2874756	0.04
489.9286499	0.06
502.4039917	59.34
503.4254150	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.2594
Annotation	2-Hydroxyoctadecanoic acid
Peak:m/z	Relative Intensity
114.9199371	2.66
142.975769	7.32
145.1355286	0.49
163.2138672	1.33
169.3270874	1.04
171.134552	3.49
183.0318298	4.47
185.097229	8.26
186.0257416	2.32
199.0298462	14.98
201.1376343	2.93
205.1656799	0.69
210.7639771	0.69
215.2722473	1.12
221.1930237	0.54
225.2660522	18.18
227.3376465	8.75
229.1391602	0.90
230.9450684	0.44
231.9023743	0.84
235.2099304	1.68
237.1797791	5.51
239.2038879	0.74
240.1129761	1.69
241.2183228	1.38
251.2497864	0.84
253.2605896	58.55
255.1832275	17.77
256.5027466	2.62
257.1908264	1.88
263.1560669	13.86
263.9563599	2.17
267.2575073	2.93
271.1966248	0.54
279.4853516	5.45
281.2425842	100.00
283.1511841	15.45
283.9506531	0.84
299.4509277	3.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	729.0286
Annotation	Unknow
Peak:m/z	Relative Intensity
230.1508331	0.03
299.0296021	0.05
322.9046021	0.08
324.1951904	0.04
333.1454468	0.15
341.3146973	0.08
351.1676636	0.10
368.9780273	0.20
387.9822388	0.15
468.7798462	0.12
497.4673462	0.31
500.3660278	0.22
511.2487793	0.08
518.3613892	0.11
547.1156616	0.06
583.0561523	0.02
596.5683594	0.04
602.4303589	0.05
607.1017456	0.78
624.3286133	0.12
627.0988159	0.08
637.6119385	0.07
650.1896362	0.18
657.4143677	0.07
662.6952515	100.00
663.6348267	4.18
664.7172241	0.78
665.5348511	0.53
666.2763062	0.80
667.1165161	0.05
668.1417847	0.14
671.3944702	0.17
690.2063599	0.15
693.3362427	0.43
705.8850098	0.41
706.7944946	0.33
707.8167725	0.12
717.4050903	2.53
718.0192261	0.80
720.4602661	0.37
742.4423218	0.12
759.3845825	0.09
764.8405151	0.22
766.2501831	0.05
774.4497681	0.04
777.5835571	0.08
788.6390991	0.11
838.3705444	0.16
840.2307739	0.04
847.3832397	0.05
857.5864868	0.10
862.2847290	0.18
881.9933472	0.26
886.6909180	0.06
902.5958862	0.29
905.5817261	0.04
909.2628784	6.13
910.0282593	2.19
910.7778320	0.24
917.9506836	0.19
933.3662720	0.06
944.8430176	0.46
945.5310059	0.61
946.3651733	0.12
958.5722046	0.10
962.7467651	0.29
976.8810425	0.12
978.3076172	0.03
984.6006470	0.04
989.6524048	0.20
993.3129883	29.60
994.0671387	6.64
994.7651978	0.93
995.8240356	0.53
997.3750000	0.20
1005.8374020	0.20
1027.4233400	0.21
1028.1065670	0.09
1033.7430420	0.33
1034.6986080	0.05
1049.1879880	0.16
1198.3917240	0.08
1213.7017820	0.12
1222.7974850	0.13
1229.5086670	0.30
1430.2203370	0.04
1543.2064210	0.10
1544.9367680	0.10
1790.5528560	0.05
1914.8043210	1.06
1953.1531980	1.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.14
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
176.9933472	0.21
179.0912933	3.22
182.9034882	0.13
184.9983063	0.23
197.1196747	0.67
207.9664917	0.35
208.9830933	0.06
210.0406952	2.67
213.2114258	0.36
225.9925232	0.55
228.0813751	0.37
231.0493469	0.24
242.0551758	0.07
252.3313904	0.15
254.1294098	13.60
262.9274902	0.13
272.1552429	33.68
286.1486206	0.79
288.0833435	3.32
304.1925659	14.79
306.0643921	100.00
320.1401367	0.17
329.4645996	0.33
338.1478882	33.66
353.4586182	0.13
361.1895752	0.13
398.3840942	0.15
435.9302979	0.14
464.1562500	0.51
482.2036743	25.79
496.4424438	0.16
498.0953369	0.18
575.1917725	0.07
593.2473755	15.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1244.2188
Annotation	Unknow
Peak:m/z	Relative Intensity
354.3262634	0.06
377.2919617	0.06
378.9640198	0.30
383.1810913	0.09
398.2667236	0.10
405.3866577	0.16
415.3644104	0.16
422.6296692	0.13
439.2430725	1.06
440.2357178	1.20
443.8663330	0.18
449.3139038	0.12
452.4811401	0.28
475.8794250	0.25
499.5588684	0.12
500.1800537	0.37
506.9718018	0.29
509.3958130	0.08
512.4132690	0.22
513.2575073	0.05
515.4813232	0.22
518.2413330	0.10
524.4645996	1.00
525.5048218	0.40
528.7648315	0.18
532.9692993	0.11
534.2410278	0.49
538.4248657	0.19
540.8980713	0.18
544.4154663	0.08
550.4754028	0.10
552.2791748	0.39
554.4680176	0.06
560.7459106	0.23
562.3604126	0.18
568.1884766	0.05
578.9166260	0.11
582.0300293	0.11
587.2213135	0.09
589.1003418	0.05
590.1204834	0.14
591.6500244	0.35
604.8919678	0.21
609.4536133	0.70
623.9232788	0.38
627.4960938	0.07
628.4002686	0.21
634.5396118	0.14
641.2062378	0.10
651.1323853	0.06
655.2230225	0.09
659.3234863	0.10
660.1845703	0.11
663.3908691	0.26
667.2781982	0.08
675.3653564	0.09
704.5544434	0.16
710.3883057	0.25
714.3969116	0.09
715.4559326	0.05
721.3372803	0.11
733.5362549	0.10
741.2518921	0.19
743.1095581	0.21
744.1439209	0.16
748.1276855	0.18
753.0247192	0.06
754.2997437	0.23
757.8464355	0.06
762.1906738	0.11
764.0440674	0.07
772.3588257	0.64
773.7564087	0.06
774.4830933	0.12
775.7071533	0.13
789.3489990	0.14
790.4443359	0.09
793.1782837	0.05
803.4632568	0.11
804.1468506	0.34
805.5449219	0.10
812.0263672	0.13
813.1069946	0.19
814.8822021	0.16
816.3216553	0.27
819.9805908	0.54
820.8378906	0.09
828.4029541	0.20
830.4370117	0.23
839.3355103	0.09
843.3796387	0.60
864.5511475	0.10
865.4122314	0.32
867.3968506	0.36
878.4111328	0.21
887.4344482	0.18
888.9909668	0.55
890.7525635	0.27
902.9259033	0.25
919.3009033	0.11
921.3354492	0.22
927.4902344	0.05
931.0145264	0.25
937.5422363	0.76
940.5936279	0.47
963.7437744	0.09
966.7918701	0.94
970.5111084	0.23
971.3713379	0.31
972.9755859	0.50
975.8883057	0.15
977.7883301	0.35
980.0882568	0.17
980.8786621	0.51
983.3270264	0.84
988.9705811	0.42
993.0617676	0.63
996.9171143	0.78
998.5549316	0.57
999.8566895	0.05
1004.0961910	0.10
1010.3500980	0.10
1011.1676030	0.70
1012.3385010	0.09
1013.3247070	0.27
1014.2796630	0.31
1016.2255860	0.16
1017.2404790	0.90
1018.4429930	0.13
1019.5765380	0.19
1020.7866210	0.73
1021.5673830	1.13
1022.4067380	1.22
1023.9199220	0.36
1024.7894290	0.31
1026.2485350	0.58
1027.2270510	0.08
1029.3166500	0.47
1030.6215820	0.19
1032.3466800	0.17
1033.8302000	0.41
1034.7409670	0.30
1038.0614010	0.39
1038.9150390	0.90
1040.8596190	0.27
1041.6602780	0.33
1043.6739500	0.99
1044.5412600	1.96
1045.1889650	0.17
1046.8061520	0.72
1049.9787600	0.48
1051.7078860	0.15
1053.6506350	0.31
1054.3322750	0.09
1055.8084720	1.09
1056.5214840	0.75
1061.0378420	1.12
1061.6844480	0.10
1062.3745120	0.67
1063.1518550	0.34
1063.8386230	0.30
1065.8056640	0.23
1067.2546390	0.36
1067.9263920	0.17
1069.2578120	0.99
1069.9243160	0.65
1073.0827640	1.29
1074.0585940	0.47
1076.2216800	0.14
1077.0183110	0.08
1078.0612790	1.67
1079.9489750	1.21
1081.1473390	0.96
1082.8712160	0.84
1083.5065920	0.11
1084.4367680	0.55
1085.8687740	0.67
1087.4648440	2.18
1089.3948970	0.90
1090.1199950	1.11
1092.1793210	1.66
1092.9743650	0.27
1094.2453610	1.33
1095.6713870	2.14
1096.2874760	0.72
1097.5192870	0.12
1098.5744630	1.96
1099.4208980	0.43
1100.5450440	1.11
1101.4141850	0.79
1102.2568360	1.41
1104.6398930	0.32
1105.6256100	0.81
1106.5759280	2.84
1107.5496830	0.25
1108.8383790	0.19
1109.9830320	1.14
1111.0480960	0.40
1112.2465820	1.52
1114.4152830	3.79
1115.1700440	1.71
1116.2773440	2.30
1117.9719240	1.69
1118.9168700	3.01
1119.9277340	0.74
1120.5351560	0.11
1121.5450440	0.52
1122.1555180	0.69
1123.4985350	1.19
1124.4896240	3.47
1125.4355470	3.23
1127.0100100	4.83
1127.8413090	1.18
1128.9223630	0.43
1129.8918460	2.48
1130.9136960	2.22
1131.7761230	3.00
1133.0920410	11.22
1134.2463380	2.36
1134.9787600	0.19
1135.8712160	2.99
1136.7734380	1.11
1137.9956050	1.62
1138.8482670	1.11
1139.8812260	2.23
1140.9643550	2.56
1141.8618160	0.74
1142.9255370	2.33
1143.6809080	1.53
1144.7983400	4.58
1145.9714360	2.73
1147.1450200	0.80
1149.0339360	3.33
1149.8762210	0.42
1150.8952640	0.61
1152.2164310	12.56
1152.9560550	4.15
1154.1975100	3.07
1155.0228270	2.34
1156.0617680	0.53
1156.7122800	1.19
1157.5255130	1.99
1158.7946780	3.29
1159.7901610	2.68
1160.7021480	0.48
1162.4870610	5.15
1163.1669920	2.44
1163.7725830	9.06
1164.6053470	1.03
1165.7028810	1.85
1167.1424560	4.15
1167.8898930	5.63
1168.9001460	6.99
1169.8614500	3.96
1170.9924320	1.79
1171.8548580	1.88
1173.1660160	2.58
1174.3914790	3.76
1175.2681880	1.99
1176.3414310	1.39
1177.0769040	3.72
1178.1774900	2.83
1179.6879880	0.73
1180.4719240	1.76
1181.0725100	0.04
1182.6354980	7.32
1183.4306640	4.32
1184.1970210	1.85
1185.1042480	2.45
1185.9160160	12.21
1186.8022460	2.85
1187.4296880	1.66
1188.5734860	2.20
1189.5583500	1.44
1190.5380860	3.98
1191.7315670	42.93
1192.6093750	43.43
1193.6940920	3.99
1195.2546390	25.60
1196.0373540	2.94
1196.9447020	0.98
1197.9442140	0.30
1199.5322270	0.65
1200.8074950	20.61
1201.4460450	100.00
1202.7108150	5.87
1204.0058590	1.77
1205.8013920	3.95
1206.9102780	10.16
1207.5748290	8.81
1208.1899410	0.59
1209.2128910	0.78
1209.8850100	1.21
1210.9116210	2.09
1211.9262700	10.31
1212.7519530	2.80
1215.1193850	1.15
1216.0435790	1.69
1216.9150390	0.40
1217.7349850	0.15
1218.4785160	1.41
1219.3925780	0.27
1220.2445070	0.78
1220.9597170	0.90
1221.8979490	0.29
1223.7587890	4.12
1224.6534420	1.39
1225.4387210	0.87
1226.5939940	0.91
1227.3793950	0.56
1229.6130370	11.43
1230.8588870	0.53
1232.9722900	0.13
1246.3972170	0.51
1248.0847170	0.07
1249.5297850	0.64
1253.6816410	0.06
1259.6474610	0.53
1261.1972660	0.20
1266.5683590	0.09
1269.2507320	0.32
1272.2572020	0.20
1275.3707280	0.22
1278.9738770	2.48
1279.8618160	0.61
1280.6838380	0.65
1281.5517580	0.17
1286.8187260	0.21
1288.5490720	0.11
1290.0998540	0.49
1291.2432860	0.26
1294.5982670	0.34
1295.5815430	0.06
1297.6964110	0.22
1300.5560300	0.24
1301.9820560	0.45
1302.8797610	0.08
1304.8535160	0.13
1308.7976070	0.30
1309.5683590	0.33
1310.7182620	0.73
1313.3974610	0.44
1314.0433350	0.72
1314.6555180	0.61
1315.5970460	0.38
1316.4694820	0.36
1317.5635990	0.28
1318.9803470	0.20
1319.7902830	0.21
1321.7687990	1.70
1322.3881840	0.19
1324.0991210	0.25
1324.7564700	0.22
1327.0966800	0.62
1328.8049320	0.33
1329.5758060	0.41
1330.4936520	0.14
1333.4559330	0.22
1335.1763920	0.12
1336.0355220	0.13
1337.0942380	0.46
1337.7490230	0.29
1338.8300780	0.44
1339.5308840	0.37
1341.6502690	0.64
1342.4776610	0.60
1343.0914310	0.12
1344.4489750	0.42
1345.5156250	0.76
1347.0107420	0.09
1349.7875980	1.01
1350.6844480	0.79
1353.7501220	0.65
1356.8594970	0.48
1360.5510250	0.31
1361.4602050	0.33
1363.0010990	0.29
1363.6259770	0.56
1366.2741700	1.38
1370.5767820	0.13
1373.7814940	0.72
1374.5170900	0.43
1375.3229980	0.11
1376.1613770	0.23
1379.3741460	0.92
1380.4085690	1.20
1381.7847900	0.63
1384.0490720	1.07
1384.7653810	0.05
1387.4780270	0.46
1388.5501710	1.80
1390.0275880	0.44
1391.4935300	0.16
1392.6507570	1.04
1395.0340580	0.39
1397.1707760	0.38
1398.7054440	0.07
1399.9414060	0.60
1402.0227050	0.35
1403.2292480	0.26
1403.8721920	0.29
1407.6318360	0.78
1408.3917240	0.42
1410.2779540	0.21
1411.5367430	0.70
1412.5467530	0.46
1414.8322750	0.47
1415.7933350	2.00
1416.6462400	1.57
1417.5106200	0.15
1418.4340820	0.69
1421.4862060	0.48
1422.7548830	1.52
1424.1674800	1.71
1426.3143310	0.33
1426.9200440	0.16
1428.8041990	1.15
1430.9807130	0.36
1431.9587400	1.15
1434.2332760	0.61
1439.9278560	2.40
1441.3363040	1.20
1443.7645260	1.06
1444.6623540	0.08
1445.5169680	0.24
1447.3034670	2.33
1448.9805910	0.46
1449.7491460	0.20
1451.0401610	0.67
1452.0120850	0.36
1452.7048340	0.34
1453.6239010	0.66
1454.5734860	0.31
1455.9471440	1.29
1456.9005130	1.20
1461.3684080	0.42
1462.8248290	0.59
1463.6586910	0.29
1465.0325930	0.50
1466.0026860	0.38
1466.7364500	0.51
1467.5416260	0.81
1468.2215580	0.53
1469.2596440	0.14
1470.3697510	0.78
1472.1607670	0.26
1473.0861820	0.53
1473.7823490	0.44
1475.7115480	0.61
1477.1468510	1.96
1479.2287600	0.67
1480.7172850	3.12
1481.4975590	0.67
1483.1546630	1.35
1484.0794680	0.22
1484.7022710	2.24
1485.3905030	0.21
1487.2055660	0.77
1488.6551510	0.52
1489.5589600	1.20
1490.4688720	1.46
1491.1601560	0.19
1492.8668210	0.85
1493.9948730	0.59
1497.3720700	1.34
1498.2825930	1.43
1499.0941160	1.24
1500.0367430	0.87
1502.6439210	0.10
1503.6629640	0.47
1504.4886470	0.22
1505.3520510	0.75
1506.3801270	0.61
1507.7414550	0.79
1508.9064940	0.80
1510.2442630	1.03
1512.4227290	2.18
1513.1094970	0.20
1513.9113770	1.08
1514.7312010	0.25
1516.6970210	2.03
1517.7175290	0.57
1520.3065190	0.67
1521.4440920	1.81
1522.1812740	0.04
1523.0369870	0.46
1523.6810300	0.24
1525.3446040	1.68
1526.2436520	1.46
1528.2130130	1.90
1529.7651370	0.55
1530.5374760	0.48
1532.0170900	0.39
1533.0795900	1.56
1534.0994870	0.97
1535.0823970	0.19
1536.9283450	1.75
1538.0400390	1.09
1539.2354740	1.43
1540.6791990	0.82
1541.5020750	1.24
1542.5635990	1.56
1543.9030760	1.37
1545.3333740	1.33
1546.2514650	0.15
1547.1829830	0.08
1548.3695070	1.03
1549.2442630	1.41
1550.3023680	2.21
1551.7244870	0.63
1553.6029050	0.68
1554.5599370	0.79
1555.2591550	2.10
1556.3179930	1.04
1557.2078860	1.83
1558.0150150	0.07
1559.0491940	1.37
1559.6990970	1.31
1560.4376220	1.15
1562.1179200	3.57
1563.4426270	1.54
1565.7575680	1.46
1566.4450680	1.31
1567.2323000	0.08
1568.1260990	0.44
1568.7445070	0.29
1569.5684810	0.17
1570.1893310	0.63
1571.2375490	0.40
1572.7493900	3.75
1573.4793700	1.45
1575.6795650	0.76
1576.7152100	3.08
1577.9041750	1.30
1581.5648190	5.36
1582.4296880	2.87
1583.1120610	2.68
1583.9271240	0.19
1585.3006590	2.13
1586.1274410	2.15
1586.8555910	0.13
1588.9154050	0.88
1590.7824710	7.82
1591.6347660	9.15
1592.4423830	0.65
1593.4267580	1.08
1594.4467770	0.91
1595.3311770	0.82
1596.1459960	0.27
1597.4300540	0.27
1598.2943120	0.42
1598.9517820	0.16
1600.4483640	0.96
1601.7047120	0.33
1602.8078610	1.30
1603.8883060	0.89
1604.7280270	0.64
1605.8195800	2.17
1607.0987550	3.51
1608.1821290	1.56
1608.9515380	0.40
1610.0008540	0.76
1610.9294430	0.79
1611.6073000	1.59
1612.4346920	0.29
1613.2170410	0.25
1614.6805420	0.07
1615.4266360	0.12
1616.7694090	0.54
1617.7054440	0.65
1618.5722660	0.72
1620.8364260	1.22
1621.6380620	0.49
1622.4439700	0.96
1623.2015380	0.64
1624.0437010	0.41
1624.7744140	0.66
1625.6943360	1.87
1626.5224610	0.06
1630.3215330	2.00
1631.2095950	1.39
1631.9749760	0.66
1632.7918700	1.03
1633.6932370	0.72
1634.6698000	2.64
1635.4731450	2.24
1636.1910400	1.15
1637.0909420	0.20
1638.0316160	0.84
1638.9708250	3.75
1640.5383300	1.33
1641.7117920	1.12
1642.7575680	2.42
1643.8764650	1.56
1644.7786870	0.56
1646.1710210	2.38
1647.1038820	3.60
1647.8302000	8.63
1648.8454590	1.71
1650.0848390	1.63
1651.2512210	0.85
1652.0573730	1.05
1653.2562260	0.78
1654.4464110	0.69
1655.4349370	1.01
1657.6472170	1.90
1658.5643310	2.36
1659.5568850	4.79
1660.5373540	0.40
1662.2415770	0.50
1663.0185550	0.61
1663.9412840	1.59
1664.7202150	0.69
1665.3443600	0.34
1666.2952880	1.80
1667.3199460	2.20
1668.2518310	2.79
1669.2325440	0.93
1670.1514890	1.02
1671.5618900	2.21
1673.0411380	0.79
1673.7122800	0.17
1675.0499270	0.27
1675.6829830	0.10
1676.5922850	1.00
1677.3068850	1.22
1678.4515380	1.31
1679.4699710	1.29
1680.4916990	1.50
1681.5611570	0.23
1682.2144780	0.14
1683.0550540	1.24
1683.8831790	0.61
1684.9438480	1.03
1686.4101560	1.47
1687.2457280	1.83
1688.2362060	0.45
1689.0441890	0.69
1689.9166260	1.23
1691.0106200	1.81
1691.8824460	0.61
1692.9271240	0.96
1695.2926030	1.99
1696.1453860	5.61
1696.9578860	4.76
1698.8303220	10.70
1699.6981200	10.18
1700.4719240	0.61
1701.4636230	1.04
1702.9338380	1.33
1703.9021000	1.57
1705.0308840	6.98
1706.0137940	1.71
1707.5421140	1.92
1708.4981690	8.87
1709.3182370	6.63
1710.2764890	1.17
1711.0714110	0.83
1711.9476320	0.34
1713.5953370	0.71
1714.9216310	0.77
1716.0499270	3.03
1716.9901120	0.79
1717.9027100	1.88
1718.9398190	2.56
1719.6331790	0.48
1720.2503660	0.82
1722.2479250	1.09
1723.0920410	0.58
1724.0552980	3.12
1724.8204350	11.09
1725.6260990	1.25
1726.9141850	5.53
1727.9201660	11.84
1728.7469480	2.09
1729.7364500	1.09
1730.6793210	0.75
1731.9056400	0.82
1735.3005370	0.61
1736.7879640	3.75
1737.8426510	3.84
1738.9525150	0.98
1740.0389400	0.72
1742.3571780	0.57
1743.2082520	0.09
1744.2606200	1.60
1745.1275630	2.90
1745.8402100	0.38
1748.3924560	0.46
1749.4993900	0.42
1752.3004150	3.20
1753.3529050	2.10
1754.0412600	0.65
1754.8400880	0.46
1757.2327880	1.18
1757.9899900	1.14
1759.4862060	0.48
1760.2904050	0.65
1761.0816650	1.20
1762.0679930	2.88
1762.8751220	0.65
1763.5715330	0.15
1764.7025150	2.80
1765.5335690	2.28
1766.2419430	0.49
1768.8963620	1.85
1770.8015140	0.17
1773.9240720	13.17
1774.6317140	4.38
1775.2779540	2.37
1776.5900880	0.11
1777.9923100	0.28
1778.9039310	0.30
1780.1212160	1.09
1784.4779050	0.70
1787.1535640	0.29
1788.5046390	1.36
1789.2526860	2.98
1790.0505370	0.98
1792.0845950	0.40
1793.3643800	0.94
1794.0817870	1.00
1795.6573490	0.47
1799.6541750	0.62
1800.9339600	4.63
1802.0054930	4.80
1802.8375240	4.33
1803.7327880	1.62
1805.6075440	0.08
1808.2713620	0.23
1809.9348140	1.30
1811.0872800	0.74
1813.7384030	0.25
1816.8138430	0.21
1818.2702640	0.77
1819.1229250	0.08
1823.4993900	0.30
1825.0340580	0.23
1827.4759520	0.04
1831.8250730	0.37
1854.3409420	0.19
1856.9595950	0.23
1874.5919190	0.95
1883.7459720	0.10
1896.4593510	0.09
1900.1662600	0.18
1903.6687010	0.25
1913.5548100	0.16
1915.8128660	0.29
1921.5682370	0.09
1923.3685300	0.11
1929.9771730	0.08
1943.0241700	0.12
1948.9898680	0.14
1958.2474370	0.07
1976.9992680	0.09
1979.7535400	0.07
1984.7481690	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2496
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.89558411	0.34
98.94351196	0.14
105.0317764	0.85
107.0876694	0.80
108.9481735	1.57
110.1325378	0.14
111.0670929	2.06
112.0418701	0.18
113.1097107	0.10
116.9039001	2.50
118.9672394	0.88
120.966507	2.82
123.0385437	0.74
125.0005646	0.71
128.9551697	0.59
130.9661713	2.12
133.0557251	0.67
134.9605408	3.61
137.1513062	1.00
140.8722229	1.08
143.1315308	4.57
144.1431274	0.15
144.9583435	1.54
146.8929138	1.75
149.2212982	1.11
151.0729218	1.77
152.3265991	0.28
153.0546875	0.18
154.8974304	0.58
156.9639893	1.88
159.0602722	4.76
161.0923157	0.95
165.1513062	1.28
166.1738281	0.26
167.0660095	1.22
168.0127258	0.15
169.0467834	5.29
170.2608795	0.27
171.1463776	0.66
173.0233307	3.70
175.0872955	0.92
177.1228485	0.83
179.3454285	0.48
181.0554199	0.50
182.039856	0.51
182.9568481	1.66
183.9021301	0.26
185.0556946	0.14
187.1538544	2.42
191.2870178	0.77
193.1887207	0.54
194.2423401	0.23
195.1410828	0.36
196.148468	0.12
196.9909515	1.75
199.1860352	0.88
201.0730133	1.69
203.0776367	0.12
205.1597595	1.88
206.3207092	0.29
207.2138977	0.18
211.0312195	4.41
213.1394958	1.26
215.149231	2.73
218.6210327	0.27
220.0169678	0.23
221.5219116	0.87
223.1428833	1.65
224.0864868	0.11
226.9563599	0.66
228.3710327	4.99
229.1418152	4.27
230.1697388	0.49
233.0712891	1.59
235.2182617	0.11
237.160553	0.74
239.2410889	0.25
241.6702271	0.57
243.2011414	2.26
243.8747559	0.18
245.2003479	1.72
246.2041016	0.37
247.3062134	11.64
249.5415039	0.09
251.2279053	1.62
253.2733154	0.55
255.9039917	0.07
259.0975952	0.16
263.2279053	0.22
264.9747925	0.45
267.1827087	0.20
269.0996704	0.56
271.3063049	0.48
274.2929688	0.14
277.3090515	1.05
279.0376282	0.54
281.168396	0.38
282.8538818	0.26
285.4013062	0.33
287.112854	0.72
291.0691223	0.07
295.1735535	2.83
296.4666443	0.47
297.3716736	0.28
299.2437439	3.49
300.0490112	1.08
305.3537598	5.98
307.3327637	0.36
313.2850342	0.33
321.5075989	0.32
323.2352295	100.00
324.1832275	2.94
325.1762695	0.32
341.2982483	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.69
Annotation	Unknow
Peak:m/z	Relative Intensity
190.8374786	0.17
206.9617004	0.07
212.8548279	0.09
290.7301025	1.74
374.4937134	0.82
399.8271484	0.11
412.6809082	0.22
414.9745483	0.06
419.1713867	0.11
421.0478516	0.09
421.7537231	0.14
430.9463501	0.16
446.9454956	0.07
452.7688599	0.54
456.5144653	0.34
457.9874878	0.69
458.6444092	15.86
468.4505005	0.07
469.9009399	0.11
474.0739136	0.06
484.0357666	0.24
484.8789673	0.26
486.0256958	0.05
488.4892578	0.19
491.2705078	0.26
496.9800415	0.11
512.0310059	0.07
520.6867065	0.23
528.9005737	0.42
540.5728149	1.42
542.4972534	100.00
543.4644165	0.49
551.0413208	0.21
558.7529297	0.33
568.7367554	0.06
570.8159790	0.21
578.7371216	0.44
580.6652222	5.25
582.4683838	0.14
585.0646973	0.24
590.7859497	0.39
603.7233887	0.26
608.8123169	1.40
609.8438110	0.04
626.8032837	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	2859-88-3
Peak:m/z	Relative Intensity
89.22522736	0.09
146.1386566	0.59
148.895752	0.20
152.8521881	0.35
167.1485901	0.24
174.4884796	0.41
178.164566	0.07
179.0853424	0.41
180.2268219	0.11
181.1316681	0.14
189.1642761	0.13
190.9581757	0.24
191.8146973	0.45
193.2360535	0.14
194.1785889	1.01
195.0463104	0.12
203.3277435	0.10
205.3288269	0.30
205.9435883	0.08
207.1078491	1.55
208.0445709	2.96
209.1551666	0.76
210.2568817	0.14
215.3335114	0.10
220.8747406	0.15
222.117157	2.06
223.1119537	3.72
224.2793427	0.11
233.054184	1.25
235.1018677	0.25
251.0657806	100.00
252.1710663	20.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.94872284	0.04
98.90821075	0.12
103.1849213	0.15
105.1500626	0.06
107.0477982	1.93
109.0447464	1.99
110.9646454	0.38
116.9352341	0.46
118.0522461	0.11
119.0294724	0.14
120.9218597	6.86
123.0307465	0.88
125.0090637	0.20
126.7094269	0.15
128.9538269	0.22
130.9915009	0.41
133.0487061	1.74
135.0780182	6.59
137.1373749	0.84
138.9905701	0.10
140.7457886	0.06
142.8221741	1.03
143.9687805	0.03
144.984375	0.34
147.0401917	2.20
149.0809631	3.67
151.0781403	1.60
153.0329132	0.15
155.0690002	0.10
157.0499878	1.89
159.0408936	0.61
160.9600525	1.37
163.1148529	1.07
164.0042419	0.08
165.0816956	1.18
167.2058716	0.17
169.0071869	1.24
171.125061	1.04
173.0440369	1.63
174.997818	0.88
177.0569916	0.64
179.0927734	0.30
181.170105	0.05
182.9771729	1.66
183.6936035	0.10
185.0622101	0.23
187.0932617	2.21
189.0760345	0.42
191.0088654	0.32
192.215683	0.03
192.8923035	0.05
193.9974365	0.27
197.0784302	0.47
197.8231659	0.07
201.1033936	0.45
203.0875702	0.43
205.1701965	0.57
207.0764008	0.14
208.2761536	0.12
209.3685608	0.12
211.2673035	0.39
213.1739807	0.40
214.1477661	0.21
215.1201172	0.78
217.0249023	1.16
219.1438904	0.47
223.27771	0.33
225.3678589	0.18
227.0819702	0.47
228.1329956	0.63
229.1665955	0.68
230.0293884	0.03
231.2322083	4.58
232.9666443	0.62
235.5406494	0.08
239.2055054	0.24
241.0342712	1.06
243.3002014	0.36
245.0876465	2.22
247.2835693	8.21
248.7294312	0.04
251.119873	0.15
253.1734619	0.12
255.1238403	0.30
257.1888428	0.49
259.1550293	1.25
263.0733337	0.13
267.2125854	0.39
269.2574768	0.12
271.1252441	1.26
273.2029724	0.12
275.6386108	0.07
277.3590393	0.22
281.3226624	0.47
282.239624	0.03
283.3078613	0.26
285.3009033	0.42
287.2670898	0.27
295.1994934	1.35
297.1837158	0.43
299.3037109	2.73
300.9577637	0.14
303.273407	0.07
305.3045044	3.15
307.2837524	0.05
310.8349915	0.22
312.1462402	0.09
313.2948608	0.60
316.6321716	0.06
321.4637756	0.09
323.2425842	100.00
323.9417419	0.34
324.548645	0.04
325.3255005	0.04
341.0541687	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.05
Annotation	UDP-L-rhamnose
Peak:m/z	Relative Intensity
163.9393463	0.02
192.8132935	0.01
211.0253601	2.04
216.8599396	0.05
225.0680084	0.09
234.9643555	0.03
237.3082123	0.02
239.0914612	0.02
262.1687317	0.04
276.8757935	0.55
280.1744995	0.68
297.0226440	0.12
305.1532898	0.12
308.7629700	0.14
310.7202759	0.02
323.1647339	100.00
323.9514771	0.04
374.8982544	4.41
378.9899902	0.06
380.4776001	0.13
385.0719604	0.61
392.7644043	0.22
393.9622803	0.06
403.0897217	0.31
410.9582520	0.02
412.8228149	23.27
413.9246826	0.55
428.8372803	0.18
430.9349976	0.07
431.9661865	0.04
437.2728882	0.02
450.8233643	0.38
452.8483276	0.02
462.7476196	1.36
464.7671509	4.01
481.1381836	0.04
488.8395996	0.03
502.5620117	0.07
503.1959229	0.44
521.2023315	0.04
531.1353149	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	603.0034
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
176.0463104	0.05
176.8418274	0.03
193.1331940	0.48
196.6650848	0.04
210.9479370	2.92
214.8702393	1.01
222.9023743	0.05
232.9017944	0.21
237.8130188	0.04
241.1250916	4.60
243.8723450	0.08
245.8789368	0.20
253.9011536	0.11
255.9414062	0.04
256.9045410	1.58
259.0381470	0.17
262.1650391	0.30
265.0334167	0.03
269.1424866	0.10
280.1425781	0.74
280.9624023	0.11
287.1675415	0.10
292.1666870	0.22
293.0476074	0.21
299.1646118	0.30
305.0810547	0.17
310.9932251	0.70
314.5268555	0.11
315.9602661	0.13
318.0661621	0.08
323.0670166	100.00
326.3656006	0.10
329.0377808	4.46
333.0852051	0.12
334.1729126	1.60
339.1469116	0.20
345.9410400	0.06
349.8773193	0.23
352.1894531	0.56
354.1677246	0.12
359.0315552	5.30
361.1729126	0.42
370.2566528	0.10
371.0335083	0.29
372.1941528	0.67
377.1140747	8.94
380.1827393	0.44
382.2754517	0.05
382.8939209	0.06
386.0399170	0.05
388.1597900	0.43
390.9929199	0.57
393.1191406	0.19
398.0610962	0.43
400.3496704	0.13
400.9808350	0.09
404.1107178	0.06
406.0303345	0.33
414.0480957	0.14
416.1970215	0.04
419.0341797	2.61
423.0808105	2.61
424.2123413	1.28
426.0343628	0.04
428.8202515	7.50
429.7793579	0.04
431.0579834	0.21
432.6165161	0.06
434.2113647	0.23
434.8930664	1.46
440.0481567	2.26
441.0960083	37.16
443.9373779	0.05
445.8868408	0.30
446.9061890	0.43
447.7673340	0.05
449.0881958	0.71
450.9069824	0.13
452.0307617	0.51
453.0903931	0.35
458.1959229	0.09
462.0371704	0.55
465.2452393	0.06
466.7692261	61.70
467.8187256	1.32
470.0484619	9.93
470.6785278	0.08
473.0573120	0.17
474.3342285	0.07
481.8357544	0.12
483.0856934	29.55
485.9010620	0.10
488.1398926	1.40
491.0798340	3.10
499.5493774	0.27
500.1959229	0.25
502.9010620	0.05
504.9932251	0.27
507.1395874	0.08
514.0995483	0.03
516.1817017	0.12
517.0886230	0.06
518.7123413	73.12
519.3207397	0.21
524.1880493	3.03
532.0913086	0.05
534.6828003	3.74
542.2158813	1.81
557.0416260	0.61
558.8273315	0.05
560.0171509	55.62
560.6250610	0.71
585.0638428	21.28
750.7335205	0.06
754.3976440	0.05
784.1229858	0.05
864.7058716	0.09
934.4221802	0.19
944.8093872	0.20
972.3432617	0.24
1050.6204830	0.04
1074.4375000	0.18
1076.0336910	0.04
1092.2946780	0.71
1107.7668460	0.25
1108.5329590	1.95
1117.3503420	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	371.1016
Annotation	Unknow
Peak:m/z	Relative Intensity
106.8272018	0.03
118.9793015	0.01
131.4677429	0.06
143.0354919	0.10
148.9802246	0.01
160.9473877	0.04
165.2272034	0.02
173.0913696	0.03
178.9319000	0.29
206.0557251	0.03
210.9727478	0.01
244.9318848	0.04
249.3001099	0.01
281.0838318	0.02
285.1272888	0.02
297.4356689	0.02
309.0281372	0.03
313.1148682	0.04
321.0662842	0.05
323.4215393	0.03
325.1067505	100.00
328.0090637	0.03
343.4109497	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	312.1646
Annotation	Ethyl (S)-3-hydroxybutyrate glucoside
Peak:m/z	Relative Intensity
84.9144745	0.02
97.0307922	0.06
98.9675903	0.03
104.5046844	0.09
126.8086700	0.18
129.0471191	0.02
130.1443024	0.03
132.9321899	1.08
137.1695709	0.06
144.9425049	0.91
150.0162659	0.04
150.9027405	0.02
153.9163055	0.05
161.3869019	0.01
162.9060822	5.19
180.0153503	0.46
191.0196991	0.04
192.7294006	0.11
206.0981750	0.02
207.2691956	0.02
212.3146057	0.05
223.2628479	0.04
228.4127502	0.01
230.5227051	0.02
239.2394104	0.02
240.8209839	0.03
248.8502808	0.07
251.8781738	0.10
258.9508057	1.50
270.7848511	0.03
272.3981934	0.08
275.0177612	0.06
276.8751526	0.16
282.4348450	0.05
292.8810730	0.10
294.8444824	100.00
295.5925293	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	305.1697
Annotation	Unknow
Peak:m/z	Relative Intensity
87.8726349	0.52
93.9152145	0.31
96.0096893	0.36
96.8790054	0.31
98.2129822	0.06
99.0236130	0.45
106.7891846	0.02
107.9459610	0.03
114.0243835	0.63
117.0557175	0.03
122.9750595	0.04
125.0348358	4.60
141.1184998	0.03
143.0116577	100.00
146.2826385	0.03
147.9785004	0.06
151.0083008	0.03
153.2398682	0.03
155.1162567	0.13
164.9191284	0.14
185.1498718	0.14
187.0841675	0.04
191.0482178	0.03
196.9888916	0.05
200.0309753	0.01
208.9818726	0.02
217.0553589	0.02
219.0256958	0.06
223.0291443	0.05
224.9819946	0.02
234.2586670	0.03
239.1047058	0.12
240.9570618	0.07
241.7698975	0.03
244.7713318	0.03
250.2612610	0.10
251.2251587	0.04
258.7240906	0.08
261.1527100	0.08
263.8592529	0.08
269.0542297	0.08
277.2293091	0.01
285.1531067	0.02
287.3394165	0.76
288.1023560	0.06
295.7017822	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.5608
Annotation	Unknow
Peak:m/z	Relative Intensity
96.1239624	0.14
96.9161682	0.05
105.9064255	0.61
108.1459732	0.08
114.0259857	0.23
115.9184036	0.14
120.9991684	0.14
122.9504471	99.62
124.0809250	0.15
131.8713379	0.17
136.0165558	4.25
148.0165100	0.17
150.7550049	0.13
152.0101013	0.77
153.0954895	0.14
163.0473938	0.13
163.9897156	0.07
170.0234070	1.78
173.1573334	0.21
174.2093506	0.18
181.1010895	0.25
184.2088623	0.15
185.0160217	0.17
188.0291443	0.10
188.8177032	0.04
192.9147034	0.15
200.9090424	0.03
202.0129242	0.06
202.7547150	0.22
222.3299561	0.06
231.0096741	0.10
232.0621643	4.67
232.7275391	0.14
235.2601929	0.13
238.2028198	0.23
242.0286560	0.45
242.7798462	0.13
245.0820618	0.18
248.2034607	0.10
251.0369263	0.10
254.9595947	0.08
256.2821045	0.10
258.8481140	0.24
264.8217773	0.07
272.0756531	0.08
272.9679871	0.06
274.1051636	0.05
276.6158447	0.06
281.6488037	0.23
283.0299072	0.20
284.9280090	0.07
285.6952515	0.05
287.3991394	0.08
288.1178284	0.10
290.2363281	0.46
304.2532959	0.17
312.2266846	0.55
314.3479004	0.55
315.0880737	0.47
316.2790527	0.20
322.9663696	0.14
324.1856995	0.22
348.1131287	0.18
366.3071899	0.39
370.8957520	0.14
389.0116272	0.14
410.3123169	0.19
427.9892273	2.15
437.8471375	0.20
441.7726440	0.14
444.1045837	0.84
470.4801331	0.14
483.0679626	0.09
511.1040649	0.11
524.0958252	49.68
525.0448608	0.69
527.9491577	0.20
529.0130615	0.56
542.0319214	100.00
543.0695801	2.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	538.75
Annotation	Unknow
Peak:m/z	Relative Intensity
173.3135071	0.07
188.9219055	0.03
203.1691589	0.06
241.0672913	0.07
258.8942566	0.06
286.8135376	1.72
292.9221802	0.09
302.9973755	0.18
308.9627075	0.22
325.6995239	0.14
328.9332886	0.04
341.3414917	0.02
346.3374634	0.12
356.9162598	0.21
359.1385498	1.50
362.2843628	0.52
363.7582397	0.08
364.5119629	0.13
366.0579834	0.12
368.8295288	0.22
370.7600098	10.44
377.1668701	0.95
386.6692505	0.44
401.2093506	0.07
418.7877197	0.15
426.1762085	0.04
430.7980957	0.26
436.9322510	0.05
448.9506226	0.14
451.1274414	0.11
452.8467407	0.40
454.7487183	100.00
456.2738647	0.07
470.6080933	1.31
478.8413696	0.10
491.9804077	0.11
492.8269043	0.59
521.1788940	0.22
521.9214478	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.97763062	1.41
78.74872589	0.17
80.9105835	0.34
82.8520813	0.31
91.13885498	0.18
95.03317261	2.03
98.95397949	0.63
102.8056488	1.24
104.0527802	0.47
105.0149384	1.52
106.9749908	0.60
108.8275146	0.96
110.9371338	0.86
112.8471069	0.74
114.8963165	0.67
118.9881439	1.50
120.9852448	1.15
123.0973969	1.74
124.0715179	0.29
129.0480499	5.85
130.1644745	0.23
131.0586853	0.22
133.073349	1.19
134.9649811	1.43
137.0804596	1.30
139.2164459	0.86
141.1493073	0.18
145.0730743	0.11
147.0190735	3.04
151.0335999	58.46
152.057724	4.10
153.2098236	0.39
155.2116547	0.76
157.0285187	0.64
161.0411377	0.20
162.0160522	0.31
165.1265564	0.54
166.9604645	1.78
169.1329803	1.73
170.9722443	0.28
175.0862885	0.75
177.166153	1.13
178.9328461	2.50
180.012558	0.39
181.0799255	0.19
181.9513397	1.57
183.1014252	0.81
185.0431824	2.44
189.1078644	0.38
189.9891815	0.74
191.0328674	0.36
192.9742432	1.34
193.9362488	1.51
195.1433411	1.27
197.0374908	3.70
198.1557465	1.18
199.1612701	0.20
206.9296722	1.75
209.0586548	0.27
210.5854645	0.10
211.1867828	2.72
211.9905548	0.72
216.110672	0.89
217.1849213	5.37
223.1299744	0.47
225.1097107	12.29
225.9194946	0.67
228.9150238	0.21
235.081131	21.61
236.1707611	1.07
238.0276031	5.15
239.0921783	1.72
244.1744843	0.15
251.3803558	0.58
253.0802155	100.00
254.0379791	16.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	382.1695
Annotation	Trans-Zeatin-9-glucoside
Peak:m/z	Relative Intensity
129.8040161	0.83
130.9579163	1.04
133.8890991	0.27
156.3492432	0.11
176.144577	0.20
177.1203308	0.13
182.1826782	0.20
199.7986145	0.07
201.0897217	1.39
201.9412689	2.33
205.2084351	0.25
208.1257629	0.16
209.7387085	0.84
213.2355347	1.84
214.0211487	2.21
214.9287415	0.36
215.9119415	0.12
218.4984741	0.85
220.1221619	100.00
234.988739	0.28
236.0114136	0.26
242.1993103	0.25
244.9865723	0.75
252.92099	1.11
261.866272	0.19
263.1676025	0.84
264.405426	1.15
267.2275085	0.28
271.1817932	0.17
274.7160339	0.26
277.1414795	0.19
287.2002563	0.29
291.963562	0.62
293.1032715	0.46
296.2712402	0.29
300.6361084	2.14
306.9822998	0.44
310.2337341	0.47
311.1867676	0.75
337.0061951	0.28
341.3289795	0.75
346.3650208	1.01
349.8873901	0.25
350.8128967	0.25
352.4720154	0.82
364.1811218	4.33
368.6468201	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	470.1515
Annotation	Unknow
Peak:m/z	Relative Intensity
142.9505157	0.36
161.1202087	0.09
178.9494629	0.92
289.5839233	0.45
307.2825623	0.11
308.1493835	0.14
341.1925049	100.00
379.9485474	0.09
452.3922424	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	756.3408
Annotation	Unknow
Peak:m/z	Relative Intensity
227.0853577	0.14
229.6198120	0.08
296.1413879	0.62
353.1708984	1.44
379.2877808	0.15
386.0610962	0.04
397.3032837	0.50
413.3091431	1.06
415.8654175	0.36
416.5413818	0.05
425.3291016	0.13
426.4821167	0.22
427.6812134	0.08
432.2864990	0.08
440.6950073	0.14
441.3796387	1.61
457.7202148	0.16
459.2475586	0.10
460.1580200	0.23
471.3874512	0.06
484.4523315	0.40
506.3039551	0.04
520.3599854	0.06
524.2783813	7.76
526.1593018	0.49
534.3603516	0.04
542.4809570	0.66
544.2249756	0.45
549.2518311	0.17
552.3778076	0.44
553.3728638	0.13
563.4157715	0.19
569.4913940	0.06
570.4712524	0.19
581.2011719	0.54
588.1126099	0.23
589.0740967	0.10
597.3791504	0.25
607.3930054	0.39
619.8489380	0.12
622.7443848	0.04
625.3967896	3.25
637.1330566	0.07
641.3179321	0.07
641.9606323	0.11
643.4196167	0.15
650.3341675	0.12
665.9420776	0.29
669.8951416	0.55
670.7183838	0.17
688.3792114	0.05
691.8348999	0.21
692.5037231	0.08
694.4429932	13.63
695.9124146	0.20
696.5726318	0.14
698.3407593	0.14
708.4370728	0.05
712.3937988	100.00
713.4276123	0.37
714.5311279	0.33
720.4495239	0.31
723.2082520	0.20
726.6929932	0.04
736.3202515	0.18
738.3757935	13.68
739.3033447	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.15062714	0.12
100.9129257	0.04
104.9091492	0.06
106.9380493	1.38
109.0581665	2.40
109.8028259	0.12
110.9025421	0.59
113.1197662	0.12
114.9700546	0.06
116.9992371	0.26
119.1324615	0.10
120.9782715	3.45
123.0823517	1.20
124.9739532	0.15
128.8869171	0.10
130.9868774	0.26
132.8809509	0.81
135.1459351	4.12
137.0058899	0.74
139.0998383	0.17
141.0361481	0.04
142.9572754	1.46
145.0411072	0.32
147.0153503	2.34
149.0721893	2.85
151.1489563	1.03
154.91745	0.16
157.0550079	0.53
159.0315247	1.02
160.988205	2.63
163.0505066	1.10
165.0658112	0.71
167.8231049	0.02
169.0538025	0.96
171.0344543	0.85
173.001709	1.57
175.0580902	1.46
176.1685181	0.17
176.9937286	0.46
178.0803528	0.03
178.9489136	0.08
181.0789795	0.26
183.1585083	0.30
184.9770508	0.20
187.0996399	1.02
188.9224243	0.81
191.125885	1.01
193.288147	0.31
195.0341187	0.11
197.0840454	0.64
199.0946045	0.45
201.16716	0.86
203.0610046	0.93
205.1234741	0.88
209.074585	0.50
210.883728	0.66
213.2344666	0.44
214.9756165	0.36
217.1156311	1.01
219.2518616	0.14
220.3171082	0.08
221.0827026	0.30
222.1250916	0.03
223.2001038	0.51
225.0872803	0.57
227.2295532	0.26
227.9182739	0.04
229.1341858	0.85
231.1228027	0.67
232.7909241	0.06
235.5491638	0.15
236.8733521	0.07
239.0498352	0.08
241.1867065	0.26
243.2565918	0.17
245.2375793	1.00
247.3215027	5.42
251.0056152	0.07
253.0328064	0.29
255.1516418	0.20
256.5797119	0.25
257.2987061	0.14
259.168457	0.73
260.113739	0.17
263.1383667	0.17
265.4317017	0.05
267.1048279	0.16
269.2563477	0.16
271.1858521	0.73
273.4710083	0.06
275.4918518	0.16
277.3383789	0.18
279.2786865	0.07
281.4031372	0.41
283.1721191	0.73
284.7974854	0.21
285.4842224	0.47
287.100708	0.52
291.0949097	0.05
292.0552063	0.19
295.2836914	0.99
297.1497498	0.68
298.6095886	0.60
299.2995605	1.70
300.2313538	0.10
303.1468811	0.07
305.2604065	2.95
306.8098755	0.09
311.1197815	0.27
313.4957275	0.67
317.9690247	0.43
323.2437744	100.00
324.308075	0.20
324.9795532	0.09
328.6783447	0.10
331.6975708	0.34
341.2030945	1.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	470.1514
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0106049	0.16
161.0236511	0.22
178.9421082	1.07
200.0519104	0.13
221.1830139	0.16
260.0176697	0.05
289.9993591	0.26
308.0924988	0.65
341.1976929	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
77.01787567	0.74
81.04408264	4.10
83.03253174	0.70
85.18891144	0.14
90.7631073	1.23
93.05265808	1.26
94.9927063	6.98
96.985672	2.48
103.0810852	1.88
104.9324799	1.46
107.0961761	2.13
108.0562439	0.45
109.0246735	2.23
110.8505554	2.27
111.8621368	0.16
112.8712921	0.80
119.0490265	2.31
121.1085052	1.97
122.9193878	2.19
124.9251862	1.59
126.9621887	4.81
127.986084	0.57
128.9818878	6.81
132.862442	0.63
134.1974792	0.53
135.1565247	2.44
137.0958099	3.00
141.1012421	0.91
142.0919189	0.47
142.8628235	1.22
146.937088	1.28
149.12323	1.06
150.9738312	56.20
152.0444031	7.03
152.9252472	1.30
155.0074005	4.59
157.145401	2.30
158.9121552	1.15
160.9105682	1.37
162.2561951	0.66
163.0011902	0.70
164.9908447	0.88
166.842514	3.59
168.9516449	1.19
171.1019745	1.19
173.2081451	0.84
174.2816772	0.88
175.1698914	1.14
177.1227722	0.94
179.0810394	4.34
182.12323	2.55
182.9983063	3.27
185.1420746	0.89
189.1266022	2.02
192.1044617	0.20
193.0808258	3.06
194.0985718	0.27
195.1510773	2.25
196.1339264	1.26
197.1713104	6.35
199.2571869	0.82
203.1430817	0.22
204.9244232	0.72
206.0995789	0.41
207.0479431	9.58
208.006012	1.73
208.8327179	1.06
209.7812347	2.08
211.0296783	6.93
217.154007	13.75
222.8555756	1.01
225.1170807	12.86
235.1563873	47.03
236.423233	0.63
238.0411835	7.87
244.1799774	1.67
250.9417114	0.24
253.0789337	100.00
254.0948639	15.66
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	864.105
Annotation	Unknow
Peak:m/z	Relative Intensity
257.4037476	0.07
264.5465393	0.27
274.1139832	0.30
279.3653564	0.54
280.2494507	0.56
289.0789795	0.26
295.1940918	0.23
299.5326233	0.27
307.3640137	0.11
325.3421021	0.07
326.4174194	0.40
387.3497314	0.13
393.2218933	0.40
421.0502930	0.71
439.3110962	0.14
449.2402954	0.08
506.4295654	0.07
515.8686523	0.31
525.8087769	0.19
550.1343994	0.29
552.5927124	0.34
553.4310913	0.17
591.6701660	0.25
609.5822754	0.41
619.4716187	0.07
631.9353027	0.10
658.5154419	0.19
659.2769165	0.24
678.9093628	0.92
690.8682251	0.16
696.2255859	0.44
715.0032349	0.08
719.7456055	0.28
734.8222656	0.32
738.3710938	0.21
739.2593384	0.13
743.3955078	0.10
744.1183472	0.88
745.5149536	0.30
748.9805298	0.30
754.2741089	0.15
761.9096680	0.52
762.8500977	1.15
763.4771118	0.56
768.0746460	0.24
772.4266968	0.76
774.0608521	1.82
776.9349365	0.95
778.9393921	0.11
781.3308716	0.55
782.7828369	0.16
786.3568726	0.30
792.1880493	0.57
793.2611694	0.81
793.9469604	0.35
794.8957520	0.19
796.4923706	1.58
797.6864624	0.61
799.1997681	1.86
799.9763794	2.66
801.9326172	1.61
802.6106567	0.53
804.3395386	1.15
806.5615845	2.18
807.4550171	0.87
810.0681152	0.91
812.7268677	1.74
813.9601440	0.86
815.1366577	0.04
816.2116699	0.54
817.1842651	0.08
818.0722656	1.58
819.2951660	0.90
819.9813232	0.92
820.9203491	0.69
821.5277100	0.10
822.1858521	0.72
823.5022583	2.37
824.6633301	14.36
825.3099365	4.93
826.6978760	1.44
827.5385132	5.20
828.4019775	0.91
829.8662720	0.24
831.5964966	5.01
832.2479858	30.38
833.2188110	1.46
834.5108032	0.98
836.1895142	2.23
836.9076538	4.32
837.6434937	0.24
838.8576050	0.05
840.6460571	1.55
841.7377319	0.93
842.5922241	1.35
844.1484985	0.24
845.8239136	8.62
846.7589722	0.35
847.7997437	0.13
848.9230347	0.64
849.8693237	0.38
851.1765747	0.84
852.8706665	2.52
853.5462646	0.84
858.7203979	0.11
879.5709839	0.11
880.5476074	0.25
894.8198853	0.53
897.6428833	0.52
900.8757324	0.91
905.6942139	0.39
922.4429321	0.12
924.9492188	0.43
930.6904907	0.15
932.2964478	0.46
935.2954102	1.05
936.0587769	0.08
936.9478149	0.76
939.0756226	0.08
940.9522095	0.38
941.6272583	0.46
943.5119629	0.86
945.0400391	0.17
946.0646973	0.63
949.4603882	0.09
950.4067993	0.73
952.0256348	0.30
954.3268433	0.76
955.1398926	1.60
956.3218384	0.70
956.9238281	0.24
958.5020142	1.35
959.4709473	0.87
961.9338989	0.15
962.9147949	0.26
963.8728638	1.24
966.2305298	0.34
968.6293945	0.61
970.2370605	0.27
971.7593384	1.42
974.6351929	1.14
976.1999512	0.59
978.4270630	1.06
979.4436035	0.60
983.2749023	0.76
988.7291870	0.18
989.8997192	1.05
992.1096802	0.51
993.2763672	0.51
995.2633667	1.75
996.2351685	0.54
997.1137085	2.68
997.8732300	2.37
998.9123535	0.05
999.7588501	1.47
1001.3717650	1.33
1002.3998410	0.99
1003.5495000	0.67
1005.1076660	0.62
1006.5570680	2.61
1007.4221800	0.28
1008.3333130	0.08
1009.4398800	0.10
1011.1213380	1.90
1011.8482060	0.86
1014.5815430	2.24
1016.1193240	2.73
1016.8659060	2.24
1017.8273930	1.04
1018.6151730	0.79
1019.2206420	0.70
1020.1821290	0.60
1021.6410520	0.89
1022.5297850	0.76
1023.4514160	1.82
1024.0812990	0.20
1025.4837650	1.32
1026.4218750	0.19
1027.7099610	3.08
1028.5212400	0.86
1029.2220460	1.13
1032.3820800	3.18
1033.2553710	4.80
1034.1711430	0.84
1035.1285400	2.34
1035.8505860	1.21
1037.3586430	1.52
1038.2524410	2.84
1039.4968260	2.40
1040.6940920	7.17
1041.4616700	2.03
1042.2879640	0.51
1042.9544680	0.10
1044.4093020	4.27
1045.7407230	1.29
1046.7523190	4.67
1047.7779540	4.40
1048.8653560	0.52
1049.9245610	0.73
1050.5810550	0.71
1051.3905030	1.26
1052.6684570	0.84
1053.4807130	2.25
1054.4981690	1.78
1055.4475100	1.51
1056.2260740	1.40
1057.1203610	1.38
1057.9345700	0.78
1059.0992430	1.98
1059.7900390	17.30
1060.7939450	2.68
1061.7767330	4.31
1062.7338870	0.39
1065.4648440	25.74
1066.2785640	10.51
1067.5192870	1.54
1068.7723390	0.33
1069.7919920	1.29
1070.5104980	4.75
1071.2927250	10.19
1072.3779300	4.90
1073.0338130	0.14
1074.2374270	1.20
1076.0937500	10.46
1076.9707030	9.95
1077.7687990	0.23
1078.6464840	0.89
1079.5767820	1.52
1080.6431880	0.42
1081.9028320	0.60
1083.3728030	3.47
1084.3979490	3.06
1085.2592770	3.21
1086.4431150	0.71
1087.1242680	1.48
1087.7304690	0.91
1088.4875490	0.04
1090.2612300	8.22
1090.9147950	8.79
1092.1435550	1.93
1092.9512940	0.43
1093.8701170	1.19
1095.2896730	0.15
1095.9123540	0.27
1096.9810790	1.83
1097.8725590	4.72
1098.8178710	3.65
1099.6337890	4.93
1102.6336670	4.45
1103.4318850	2.52
1104.1511230	2.22
1105.9276120	1.08
1107.8951420	2.44
1108.7384030	100.00
1109.6547850	24.77
1110.7717290	0.61
1111.7368160	0.94
1112.4178470	0.18
1114.7717290	23.31
1115.4881590	1.29
1116.2557370	0.79
1117.1035160	1.02
1119.7542720	0.59
1124.0445560	0.38
1127.4431150	4.00
1128.2083740	0.93
1129.5167240	0.07
1131.0649410	0.15
1140.4594730	0.82
1141.1380620	0.18
1151.2937010	0.10
1165.9497070	0.98
1175.2739260	0.57
1176.0778810	0.36
1180.4562990	0.35
1185.5809330	0.34
1187.9033200	0.34
1198.4710690	0.37
1226.0750730	0.41
1230.4969480	0.59
1233.9643550	0.18
1239.6250000	0.64
1240.6645510	0.78
1242.4255370	0.22
1246.5820310	0.29
1248.3090820	0.08
1254.3145750	0.31
1258.2274170	0.34
1260.9349370	0.62
1269.1394040	0.61
1270.3028560	0.18
1271.9985350	0.08
1273.5950930	0.05
1275.9947510	0.60
1277.1557620	0.68
1301.2684330	0.51
1305.1118160	0.44
1308.2530520	0.20
1313.9862060	0.44
1322.1336670	0.32
1330.9162600	0.15
1332.5291750	0.55
1337.6767580	0.84
1341.4871830	0.36
1342.8701170	0.72
1345.1256100	0.07
1346.0749510	0.40
1350.7027590	0.05
1358.6634520	0.23
1364.4661870	0.34
1378.8261720	0.62
1379.8052980	0.92
1382.2004390	0.30
1387.6413570	0.58
1389.8455810	0.25
1392.5155030	0.09
1396.4576420	0.29
1398.8372800	0.98
1414.1977540	0.16
1417.9744870	0.61
1419.2384030	0.41
1419.8959960	0.36
1421.3641360	0.26
1427.2644040	0.67
1432.5671390	0.27
1435.3448490	0.38
1440.2330320	0.05
1443.1004640	0.12
1445.1368410	0.40
1446.5989990	0.37
1448.3143310	0.21
1450.9404300	0.18
1452.4349370	0.96
1453.2486570	0.26
1454.8620610	0.42
1456.2646480	0.45
1458.7742920	0.60
1460.3006590	0.28
1464.2785640	0.84
1466.2440190	0.55
1467.2797850	0.33
1468.6815190	1.17
1476.3247070	0.19
1477.0313720	0.45
1478.2659910	0.22
1479.2530520	0.26
1481.7636720	0.08
1482.7614750	0.29
1483.6274410	0.24
1484.6976320	0.35
1487.5355220	0.48
1488.9678960	0.07
1491.3358150	0.35
1493.1756590	1.32
1493.9650880	0.42
1496.2188720	0.35
1498.7423100	0.10
1501.1190190	0.57
1508.7320560	0.19
1510.9753420	0.43
1513.2948000	0.85
1516.1474610	0.06
1518.7520750	0.64
1519.8133540	0.70
1520.7958980	1.12
1521.7813720	0.12
1526.2811280	1.11
1527.7727050	0.14
1533.6187740	0.11
1544.5855710	0.15
1548.1546630	0.28
1559.4434810	0.11
1560.7470700	0.31
1562.1586910	0.10
1566.4575200	0.19
1569.7753910	1.38
1570.8760990	2.54
1578.5772710	0.34
1602.3341060	0.26
1605.3391110	0.91
1613.0819090	0.20
1646.3552250	0.07
1659.7298580	0.07
1682.0036620	0.24
1703.4969480	0.12
1714.5939940	0.14
1733.4324950	0.22
1760.4484860	0.17
1768.7288820	0.09
1779.6032710	0.08
1807.7567140	0.12
1865.9608150	0.09
1915.4327390	0.14
1923.9520260	0.23
1933.1458740	0.16
1942.4919430	0.22
1947.0002440	0.26
1980.0208740	3.81
1991.0008540	0.68
1993.4797360	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	267.2678
Annotation	(9Z,12Z)-Octadeca-9,12-dien-1-ol
Peak:m/z	Relative Intensity
76.81460571	0.76
78.71957397	0.44
81.02072144	8.89
82.94535828	22.40
84.94764709	1.23
90.88745117	0.13
93.12507629	0.34
94.99028015	28.39
96.97148132	29.50
98.91668701	0.25
107.0669708	0.72
108.9799347	29.71
111.0072174	20.52
112.9505005	0.31
119.7716217	0.07
120.9730072	1.38
123.036972	18.62
124.9967346	4.33
126.4597778	0.10
127.118927	0.82
128.8091583	0.16
131.041626	0.07
133.1859589	0.46
134.1441956	0.45
135.0608215	0.32
136.0012054	0.19
137.1030273	12.26
139.0315552	4.35
140.9494476	0.82
142.9522095	0.36
147.0966949	0.23
149.0450592	0.72
151.0660095	12.82
152.8405457	3.34
154.9726105	1.07
157.0447693	0.54
159.1023254	0.32
163.0881653	0.16
165.0592499	11.36
166.9375	3.72
169.0039368	0.13
171.1054382	3.92
174.7658539	0.25
178.9842987	8.26
182.9806213	0.55
185.1343231	7.32
189.209137	0.65
191.0901947	0.78
193.2033234	6.18
194.0042725	0.53
196.937027	0.26
198.1397247	0.28
203.023056	0.95
205.1677094	0.32
206.2853088	0.25
207.2711334	0.82
209.3511963	1.68
210.0658722	0.41
211.3645477	1.79
213.3101196	0.46
221.0571442	0.53
223.3223419	0.40
224.0667877	0.33
225.0356293	1.19
226.0956879	0.52
228.2073517	0.26
231.1583862	2.77
239.1772614	0.86
240.2916412	0.77
249.2630615	100.00
250.2552643	1.21
251.094162	0.44
252.1697998	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
77.0486145	0.35
78.9732132	0.96
80.97442627	1.92
83.03424072	0.66
85.04970551	0.62
94.97303772	2.41
97.06655884	1.21
98.99320984	0.75
102.848526	0.74
104.2471924	0.12
105.1353302	0.36
108.8834381	2.54
109.7983246	0.70
110.8675842	0.76
112.9932709	0.51
118.963028	1.87
121.0093079	2.90
123.0280151	1.03
125.1833344	0.12
127.1364136	2.23
128.8758698	6.76
130.1115112	0.41
132.1550751	0.19
133.0185089	1.81
135.0941467	0.76
137.0848694	2.21
138.0176849	0.15
139.0718536	1.36
141.0256958	1.03
142.9329529	0.29
143.7369537	0.29
144.9868317	0.38
146.9481049	2.68
148.9468536	2.41
150.9874725	62.60
151.9473419	3.55
152.9171448	3.30
154.9239502	2.68
156.9238281	0.87
159.1578064	0.70
160.3917999	0.51
161.2159576	0.88
163.0521851	0.88
165.4501343	0.99
167.0479584	0.89
169.0465546	2.91
171.1167145	0.08
173.0765228	0.21
175.0981598	3.49
177.0683136	0.70
179.0696869	0.78
179.9321442	0.35
181.2073059	0.25
182.1631775	0.82
183.1721802	3.26
185.0986176	1.91
186.384613	0.32
189.1630859	1.04
191.0926514	0.85
193.1952057	0.93
195.1541595	3.11
196.1443787	0.31
197.1748047	11.98
198.0375824	0.33
199.0072021	0.39
200.2587891	0.57
201.2270203	0.42
202.1840973	0.24
205.1716309	0.28
206.6173706	0.94
207.2273407	1.06
208.186676	0.17
209.8840027	0.28
211.1621857	7.37
212.0977173	0.27
217.2848053	10.72
223.2047577	0.47
225.123703	11.89
226.2430878	1.00
230.0367584	0.13
232.1024628	0.44
235.1687775	32.85
236.2366333	0.62
238.0453949	9.22
239.258606	1.70
243.311264	0.55
251.0289917	0.33
253.0910645	100.00
254.1935883	18.15
264.8121948	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	291.1431
Annotation	Unknow
Peak:m/z	Relative Intensity
89.9084625	0.26
98.8907242	0.13
105.0637970	0.23
106.9522552	0.13
109.0758896	0.17
113.0539093	0.05
115.0401230	0.08
122.8410873	0.38
125.0396500	0.29
126.9866486	0.25
133.1039886	0.38
136.8902893	0.28
140.3814087	0.52
141.0715790	2.47
142.9521179	0.14
144.1813660	0.18
147.0923157	0.11
150.9525146	3.53
155.1515808	0.41
156.9339905	0.34
160.9503632	0.16
161.9341125	0.37
163.0396423	0.38
165.0861816	0.07
167.2674103	0.47
169.0359039	1.12
175.2849274	0.16
177.1564941	0.59
177.7949219	0.06
178.9354248	0.58
181.8878784	0.12
183.1324921	0.10
184.3950195	0.42
186.8631134	3.16
194.1195068	0.19
195.0997925	0.42
196.2251282	0.17
198.3019409	0.26
199.2305298	0.23
200.2581177	1.47
202.0006104	0.30
203.1537476	0.72
204.9962158	0.12
212.9669800	0.30
215.1476135	0.53
217.0707703	0.32
219.1441040	0.10
220.0987244	0.51
222.0788269	0.34
224.1371765	0.10
225.8231506	0.16
226.8020325	0.20
227.7599792	0.21
229.4825134	0.60
230.4342041	0.74
231.1691284	0.23
232.0919800	0.30
233.1399231	0.15
242.3123779	0.21
244.9492188	1.35
249.0915833	0.52
249.8463745	1.14
253.0980225	0.49
253.9430847	0.15
255.0441284	1.95
256.2304077	0.43
267.0629578	0.19
270.6210327	0.13
271.8268433	1.69
273.0032043	100.00
274.1054993	0.90
282.0228577	0.84
289.3011475	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2783
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
139.9727173	0.07
153.0682831	0.18
195.9690857	2.37
214.0845490	1.73
237.1274414	0.06
242.0573425	0.03
248.2196350	0.05
255.2206116	100.00
255.8543091	0.25
359.0156555	0.02
389.4678650	0.04
390.1260681	0.01
391.4027405	0.29
433.2810364	0.04
434.3351746	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	522.78
Annotation	Unknow
Peak:m/z	Relative Intensity
154.0333405	0.07
172.7470093	0.11
187.1150360	0.07
251.9917603	0.13
254.9512329	0.07
260.8081055	0.08
270.9098816	0.64
285.2102051	0.17
286.8648376	0.17
293.0262146	1.28
308.6716309	0.23
309.3131104	0.04
310.9868164	0.68
339.1806641	0.04
346.1384277	0.12
349.9689331	2.92
354.8372803	12.64
362.3795776	0.12
365.8688354	0.28
367.9238892	0.03
370.6988525	1.62
402.8540649	0.37
411.1937256	0.07
412.1394653	0.23
412.8899536	0.04
429.1955566	0.09
435.8656006	0.05
436.8795166	1.05
438.6978149	100.00
452.7795410	0.11
454.6477661	3.15
455.4249268	0.03
461.2514648	0.15
477.1985474	0.30
478.5614014	0.03
481.1530151	0.05
504.3482056	0.04
505.9785767	0.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	649.1967
Annotation	Esperamicin A1
Peak:m/z	Relative Intensity
210.8751831	0.05
222.9885254	0.04
231.1585083	0.08
235.1353302	0.20
241.1009521	0.11
247.2589722	0.12
257.0908203	0.11
257.9324036	0.05
258.9090271	0.79
271.0247192	0.33
273.4477234	0.15
275.7578735	0.13
277.1025085	0.23
287.7869873	0.03
288.8872375	0.91
307.1766357	16.73
308.5032959	0.05
312.4669189	0.18
324.8729248	7.61
341.3316040	0.47
342.3208618	1.64
342.9733887	7.93
355.0940552	0.83
358.7230835	0.10
360.6619873	3.68
361.5191040	0.21
371.0340576	0.09
374.1281128	0.04
409.4511108	0.03
464.6838989	0.07
471.0818481	0.03
478.0159912	19.93
479.1903076	0.58
480.2363892	0.21
481.0858765	0.12
482.5329590	0.30
483.2313843	0.03
484.2226562	1.76
486.7559204	0.44
487.3961792	0.11
499.1606445	0.06
501.8385620	0.10
503.6726074	0.49
504.5821533	1.16
505.2733154	0.06
514.1245728	0.05
515.4808350	0.14
520.7340698	0.24
521.8547363	0.30
522.7466431	0.82
527.2934570	0.10
538.3416138	0.06
548.2284546	0.03
550.4573364	0.13
559.1567993	0.28
561.1984863	0.21
567.8008423	0.05
578.6226807	0.10
595.3546143	0.25
613.1790771	100.00
618.7205200	0.10
631.4277344	0.22
632.5396729	0.04
666.6728516	0.06
682.8654175	0.20
683.9459839	0.79
684.6947632	0.49
951.5239258	0.06
954.1764526	0.89
955.0255737	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
84.91514587	0.63
88.92240143	0.06
90.73178864	0.22
93.16305542	0.19
94.87399292	1.12
97.02503967	1.45
98.97330475	1.86
102.9588623	0.39
107.0107727	0.12
108.9496384	0.90
109.6529312	0.09
110.9133911	0.79
112.874115	0.22
114.8848267	0.31
116.8959274	0.38
121.034317	0.32
121.9798737	0.13
122.8220749	0.75
125.0767517	0.55
128.8364868	0.44
133.1763306	0.31
134.9662781	0.37
135.8852539	0.13
137.0318298	0.98
138.9595032	6.78
140.068985	0.18
141.0725098	0.28
143.0086975	0.72
147.1089478	0.58
148.9779205	0.44
150.8559875	0.45
153.0075073	0.70
154.8811951	0.49
156.0084229	0.11
157.0870361	0.52
158.7493896	0.23
161.0759125	0.50
163.2745056	0.51
164.1648865	0.39
165.180481	0.37
167.0791016	0.28
168.9287415	0.72
171.3573608	0.53
171.9937286	0.10
173.2839203	0.31
177.199646	0.25
179.2167969	0.28
179.9119263	0.15
181.1642761	0.34
183.2286377	0.76
185.1055756	0.63
187.0562744	0.31
189.1157227	0.18
191.1539459	0.28
193.2845001	0.23
195.1385193	0.41
197.1051331	7.77
198.9641724	0.84
203.131073	0.99
205.3406677	0.09
207.3327637	0.38
209.2462158	0.80
211.2194214	1.20
212.2077942	0.25
213.1127319	0.33
217.0317078	0.28
219.1412048	0.85
221.2098694	2.70
223.2412109	0.14
225.1542664	0.96
226.7267456	0.26
233.181488	0.96
236.5760803	0.64
237.2806091	3.06
239.1304016	12.75
243.2402649	1.09
247.5794373	0.06
251.0683594	0.56
253.173584	1.54
255.1934814	1.51
255.8398438	0.17
257.0621338	0.84
261.2294312	2.92
262.1834106	0.12
269.0613098	0.10
279.2413025	100.00
280.2843933	0.20
281.1718445	0.61
297.258606	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	319.19
Annotation	Testolate
Peak:m/z	Relative Intensity
93.09600067	0.19
109.3232651	0.26
137.2712402	0.51
143.0131226	0.43
149.2241364	0.80
151.0298767	0.30
153.2624512	0.17
167.3633423	0.47
169.0334167	0.26
183.3022156	0.49
200.8665771	0.28
205.2034912	0.41
207.4038696	1.02
211.3825378	0.26
213.2595825	0.28
221.1974792	0.68
223.051239	0.21
227.4202271	0.37
235.1663818	0.22
239.4665833	0.37
241.2214661	9.39
242.3963318	0.30
243.3001404	0.60
257.3494568	14.03
259.0177307	2.16
263.2641602	0.36
265.1336365	0.37
273.0462646	1.77
273.6990967	0.66
275.1665955	0.68
276.2425842	0.64
277.3120728	0.92
281.0413818	0.36
283.2410278	12.37
285.1621704	2.21
286.7936401	0.32
291.1963196	2.95
299.2619629	0.35
301.1749573	100.00
302.0657959	1.58
302.7669678	0.56
303.5849915	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.1921
Annotation	(6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
130.9213562	0.45
138.0552979	0.15
143.9836273	0.10
153.2203979	1.39
154.1152954	1.18
160.9420776	2.87
161.9734192	0.65
179.1184387	0.19
204.1466064	0.08
205.3484802	1.18
206.2640076	2.34
210.7393188	0.18
222.8211060	3.24
224.0208435	5.03
224.6235962	0.09
254.2816467	0.21
256.2269592	0.20
305.9813538	0.17
316.2631226	0.31
317.0809631	0.07
342.3063354	0.09
343.3292542	0.19
344.0838013	0.20
360.8383179	0.10
367.8722839	0.12
369.8807678	0.06
378.2934875	0.10
382.6704407	0.13
386.1047668	100.00
386.7887573	0.92
388.2934265	0.64
396.0341187	0.13
402.2590942	0.18
413.9171753	0.28
414.6061096	0.23
415.4180908	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
149.2097778	0.30
156.746994	0.31
171.0926208	1.84
184.9567261	1.82
187.085144	1.29
188.9633026	0.68
197.0475464	0.58
199.1836243	1.70
201.0558319	1.76
213.083252	0.53
215.2442017	3.39
217.2472534	1.52
227.3628235	0.74
229.2666321	2.88
231.3539734	0.55
241.2670898	1.87
243.2030334	4.35
245.2359009	2.88
255.352356	1.11
257.1264343	1.79
259.0298157	0.58
263.4295349	3.56
265.0837708	0.25
269.2008057	3.36
271.3170166	5.16
273.2894592	1.66
275.1452026	0.57
279.140564	0.44
281.3516846	0.34
283.4436646	1.29
285.2514954	5.18
287.1706543	2.00
293.7180786	0.54
295.1520996	0.75
297.3187866	4.37
298.2178955	0.30
299.2756042	7.41
301.2728882	2.36
311.053894	0.33
312.2102661	0.61
313.2119751	2.78
313.9984131	0.78
315.3111572	2.19
319.0533752	0.23
321.2946472	2.25
323.397522	3.36
325.3438721	0.55
329.3031006	0.30
331.4809265	0.23
339.2561951	100.00
341.2174988	17.67
358.8172607	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2782
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
140.1464539	0.05
152.9472046	0.03
196.0613403	1.60
205.5109253	0.03
209.0043945	0.05
214.1094971	0.84
243.4259033	0.04
261.2146301	0.44
279.2162476	100.00
279.8867188	0.35
311.0261230	0.06
334.3078613	0.03
347.9708252	0.02
397.3410950	0.04
401.9184875	0.10
415.3507996	0.37
432.4497986	0.09
433.2908020	0.03
440.3682556	0.13
458.1545715	0.09
458.8349304	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	662.1019
Annotation	NAD
Peak:m/z	Relative Intensity
346.1607666	0.27
403.0314941	0.11
407.8938599	0.87
426.0451050	0.07
430.3471069	0.04
440.1574707	0.16
487.9265137	0.10
490.5317383	0.09
500.0725098	0.05
527.3578491	0.22
540.0914917	100.00
547.2889404	0.17
556.9384155	0.23
558.3892212	0.08
559.0641479	0.10
561.8770142	0.05
564.2199097	0.23
615.9006958	0.48
626.1251831	0.42
641.3912964	0.26
644.3723145	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1241.1245
Annotation	Unknow
Peak:m/z	Relative Intensity
448.2758484	0.08
510.1937256	0.01
511.2606506	0.04
512.3591309	0.04
520.7377319	0.03
554.0081787	0.05
555.4381104	0.08
584.3842163	0.06
638.6876221	0.10
639.8881836	0.04
642.1243896	0.01
646.6325684	0.02
647.7585449	0.01
651.3591309	0.02
652.7680664	0.03
682.1648560	0.16
702.3027344	0.09
709.6163330	0.11
737.8627319	0.06
761.5775146	0.02
762.4812012	0.10
764.8627319	0.03
769.8642578	0.02
780.5489502	0.30
781.5499878	0.10
782.4401855	0.01
791.9996948	0.15
799.4418335	0.02
823.2703857	0.05
858.9427490	0.02
875.5769043	0.13
877.3867188	0.30
878.5004883	0.05
881.0584717	0.03
882.7432861	0.20
890.4373779	0.03
891.2714844	0.08
899.1618652	0.01
909.8521729	0.02
920.5920410	0.06
922.5424805	0.01
936.9379883	0.08
937.9522705	0.03
939.7132568	0.24
940.3288574	0.04
945.6070557	0.04
946.3647461	0.38
948.6608887	0.02
954.6015625	1.18
955.5371094	0.50
963.7780762	0.10
971.1047363	0.08
976.2683105	0.01
977.4406738	0.06
980.6208496	0.09
981.5080566	0.11
988.3775635	0.24
989.4733887	0.15
990.1284180	0.04
993.6851807	0.01
995.0375977	0.36
995.8774414	0.35
996.5501709	0.18
1001.5952150	0.06
1002.2200930	0.02
1004.1657710	1.02
1005.1202390	1.02
1006.4477540	1.58
1007.5322270	0.80
1008.7584230	0.08
1011.4227290	0.18
1013.8089600	0.45
1019.7414550	0.25
1024.7440190	0.04
1029.4786380	0.21
1033.3829350	0.75
1034.2995610	0.17
1040.8001710	0.08
1046.4252930	0.16
1051.1213380	0.04
1054.1784670	0.06
1055.7358400	0.78
1059.7392580	1.32
1060.5017090	0.37
1064.8707280	0.11
1068.8344730	13.10
1069.6115720	1.91
1070.2792970	0.06
1075.5125730	0.03
1077.4641110	0.15
1078.2448730	0.05
1087.9206540	0.25
1088.5527340	0.08
1089.1689450	0.26
1092.2695310	0.05
1097.3583980	2.77
1098.2227780	0.66
1102.0495610	0.12
1102.9930420	0.03
1104.9660640	0.09
1106.5849610	0.39
1110.1822510	0.62
1111.2880860	0.63
1112.1450200	0.03
1117.2668460	0.10
1119.1655270	0.92
1119.9687500	0.73
1128.3985600	0.28
1130.6464840	0.03
1131.3266600	0.03
1133.3768310	0.05
1134.4993900	0.77
1135.3625490	0.01
1136.6293950	0.27
1137.4895020	0.03
1140.2812500	0.01
1145.0836180	0.04
1145.8576660	3.18
1146.7424320	0.67
1148.2456050	0.06
1150.0454100	0.09
1154.5615230	2.99
1155.3012700	6.22
1158.3768310	0.27
1159.2094730	0.54
1159.8903810	0.61
1163.7888180	0.11
1166.6896970	0.10
1167.9401860	5.52
1168.7070310	1.56
1169.6354980	0.07
1175.7836910	1.84
1176.3876950	3.16
1177.0263670	6.75
1177.6380620	1.59
1179.3367920	0.05
1185.1108400	0.16
1186.1840820	0.04
1188.2451170	0.24
1188.9882810	0.17
1195.2447510	0.04
1197.6041260	0.12
1201.2258300	0.16
1201.9663090	0.19
1204.4410400	0.23
1205.3005370	0.17
1206.3255620	0.10
1207.5384520	0.03
1210.0791020	4.11
1210.8151860	9.75
1211.7191160	0.35
1212.5222170	0.02
1214.3748780	0.27
1215.2762450	0.06
1217.2962650	0.08
1219.0153810	44.24
1219.7829590	100.00
1220.7253420	0.38
1221.4377440	0.03
1223.2858890	3.08
1224.1777340	0.84
1224.9682620	0.03
1225.9816890	0.02
1226.8604740	0.33
1230.2447510	0.03
1232.0618900	0.03
1249.3476560	0.10
1302.5777590	0.16
1303.7578120	0.06
1322.5429690	0.04
1345.1065670	0.13
1346.7713620	0.13
1348.0242920	0.06
1361.6905520	0.05
1374.2803960	0.05
1388.9471440	0.02
1413.6835940	0.12
1414.4904790	0.14
1415.4583740	0.03
1427.0635990	0.03
1431.4713130	0.49
1432.4666750	0.44
1433.5952150	0.10
1445.4848630	0.15
1457.5987550	0.22
1458.7438960	0.26
1464.1458740	0.05
1475.5640870	0.44
1476.5384520	0.45
1477.4840090	0.22
1527.6236570	0.09
1528.5097660	0.06
1529.1866460	0.02
1530.5516360	0.11
1536.9897460	0.06
1556.1535640	0.05
1572.5659180	0.14
1608.8133540	0.02
1622.2700200	0.04
1642.4017330	0.16
1647.8444820	0.03
1657.6026610	0.06
1658.4680180	0.11
1667.0892330	0.01
1671.8958740	0.08
1683.9952390	0.05
1684.6094970	0.01
1685.8441160	0.01
1686.9025880	0.04
1693.8787840	0.04
1701.5455320	0.01
1702.5406490	0.14
1728.4464110	0.04
1730.2188720	0.08
1755.5407710	0.05
1762.7510990	0.02
1763.8863530	0.07
1764.6741940	0.04
1773.9227290	0.02
1780.5081790	0.10
1781.6887210	0.20
1782.6429440	0.09
1798.9144290	0.15
1800.0455320	0.14
1801.1008300	0.05
1801.9007570	0.02
1825.7857670	0.07
1827.2977290	0.03
1828.1756590	0.03
1839.2193600	0.02
1844.4337160	0.15
1863.5217290	0.05
1891.7391360	0.03
1892.7863770	0.08
1893.8704830	0.08
1909.6335450	0.26
1910.7385250	0.28
1911.7277830	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	494.3229
Annotation	PE(19:1(9Z)/0:0)
Peak:m/z	Relative Intensity
149.1531219	0.34
161.1067200	0.10
165.9780884	0.21
184.0800171	100.00
198.2826843	0.12
208.9905090	0.15
255.4267883	0.15
258.3041687	0.73
261.2087708	0.18
280.1334839	0.09
322.1348877	0.04
328.0785522	0.04
340.2822876	0.16
343.0508728	0.07
346.4142456	0.20
348.9324036	0.09
376.3808594	0.08
394.4571838	0.14
419.2682800	0.23
431.1914368	0.10
444.5684204	0.18
452.9464722	0.47
458.3924255	0.48
460.2148743	0.13
476.3789368	49.15
477.0100708	0.18
480.2639771	0.12
484.7869263	0.13
485.4367981	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.2477
Annotation	alpha-Butyl-omega-hydroxypoly(oxyethylene) poly(oxypropylene)
Peak:m/z	Relative Intensity
91.0178070	0.18
92.8979034	0.18
94.8969803	0.11
98.7616272	0.12
100.0779877	0.18
104.9283218	0.37
109.9952316	0.23
114.9638596	0.36
124.0140457	0.10
126.2322540	0.13
127.0099716	0.40
132.2247925	0.05
132.9749756	0.12
133.9759216	0.23
135.1524200	0.06
136.2250671	0.05
137.0976410	0.12
138.1641235	0.05
148.1646118	0.15
149.0365753	0.16
150.0532227	0.23
151.2840271	0.11
152.1169891	0.09
154.0701447	0.61
163.1275940	0.25
163.9376221	0.11
166.8025208	0.32
167.9653320	0.16
169.9075012	0.07
173.0242004	1.19
175.1434021	0.64
176.1522522	0.16
179.3995972	0.16
182.6095276	0.15
188.2084656	0.22
190.2191162	0.20
193.0883484	0.11
194.0467834	0.45
195.2343140	0.05
196.1487732	0.39
197.0110779	0.16
198.4316101	0.09
199.1782532	0.27
202.1341248	0.18
203.4300842	0.13
204.0483704	0.05
204.6928711	0.16
205.6922607	0.76
208.2937317	0.04
214.0209961	0.19
219.1095276	0.13
220.0317688	0.39
221.0679016	0.12
222.1621704	0.41
223.0083313	0.47
225.9437866	0.46
230.6677246	0.06
232.8343506	0.06
234.1036682	0.23
235.1662292	0.10
236.2707520	0.31
237.8377686	1.09
239.0037537	0.12
239.7873840	0.13
244.0292969	0.55
245.2974548	0.05
249.1181335	100.00
250.1820068	0.21
252.1115112	0.31
256.9404297	0.30
258.1509705	0.04
262.0972900	5.79
263.2581787	1.47
264.9421387	1.27
265.5523987	0.12
271.0868225	1.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	371.2052
Annotation	5-Megastigmen-7-yne-3,9-diol 3-glucoside
Peak:m/z	Relative Intensity
104.9432755	0.05
106.9119263	0.24
108.8831940	0.09
111.0135498	1.29
118.9389877	0.30
121.0059814	0.80
123.0446320	0.82
125.0913849	1.63
126.7925568	0.01
129.1543884	0.03
129.9063568	0.05
131.1698761	0.34
133.1325073	1.27
135.0542450	2.23
136.9285278	0.14
139.0504761	0.19
145.0320892	0.30
147.1131592	0.84
149.1416626	1.76
151.1425934	0.11
152.9436188	4.96
159.0898743	0.12
161.1515808	0.12
163.1619568	2.43
165.0447693	0.12
167.0833435	0.60
173.0931091	5.84
175.1031494	0.22
176.4714966	0.16
177.1317291	0.78
181.3428955	0.03
183.3657837	0.01
187.1441956	0.38
189.1178894	0.26
191.0633850	38.19
194.0193481	0.05
195.0434875	0.08
198.9880676	0.05
201.1452789	0.11
203.1910553	0.03
205.2683105	0.04
209.0757294	100.00
211.1958618	0.11
214.1697083	0.06
215.2063904	0.39
217.0179901	0.11
219.1184082	0.31
220.8469543	0.26
227.0996399	0.25
228.1269226	0.07
229.2935181	0.08
231.2985840	0.08
233.2046814	1.11
235.2702637	0.04
237.1537170	0.56
239.2337952	0.09
242.9121094	0.04
247.3535156	0.12
249.1799927	0.17
251.1252441	0.14
255.1861572	0.65
257.1693726	0.88
259.0271606	0.31
261.0585327	0.12
265.3094177	0.15
269.1529541	0.33
271.3537292	0.13
272.8300781	0.09
275.1676636	2.15
279.1392822	0.85
281.1205444	0.16
282.2549438	0.03
283.2168579	0.25
283.8454590	0.02
287.3290710	0.90
297.2911987	0.13
299.2609863	1.49
301.9513245	0.03
305.1496887	1.09
309.1572266	0.12
311.2721252	0.02
312.9356689	0.06
314.2392273	0.05
315.2138672	0.04
317.3058472	2.33
324.0513916	0.16
325.2431030	0.05
325.9307251	0.02
327.1321411	0.23
329.0966797	0.03
331.0435791	0.08
333.1344299	0.03
335.2046509	1.22
338.0191345	0.05
343.2146912	0.12
348.0300293	0.10
349.8139343	0.20
353.2312927	16.18
354.1178284	0.13
355.5976257	0.11
359.1734619	0.02
361.2005920	0.22
362.7496338	0.10
364.6153259	0.15
370.3616028	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.12227631	0.08
102.992218	0.05
104.5819855	0.18
105.2331848	0.04
107.0163422	1.17
108.995697	1.78
109.5986099	0.05
110.8886719	0.29
112.5341873	0.09
113.1511154	0.07
117.0186005	0.33
119.2041779	0.04
120.9380722	3.34
123.1238708	1.16
125.0408936	0.43
128.8566132	0.25
130.9207764	0.46
133.0330811	1.00
134.164093	0.18
135.0617371	3.03
136.1742249	0.11
137.1182556	0.60
139.05513	0.26
141.1484375	0.11
142.9530182	1.03
144.9971313	0.14
146.3160706	0.29
147.0499878	3.55
149.0285339	2.23
151.0594177	1.32
153.0245209	0.11
155.1351471	0.03
157.1248169	1.33
159.1325073	0.43
160.9569702	2.39
163.0952759	0.96
165.1927795	0.87
167.0431366	0.25
168.5197449	0.20
169.1659546	0.78
171.0140686	0.47
173.095993	0.99
174.9986877	1.17
177.0415649	0.48
179.0404358	0.03
179.8493805	0.09
180.8517609	0.15
183.0151062	0.52
185.1635132	0.06
187.009613	1.50
189.1308594	0.86
191.1827087	0.82
193.0157166	0.09
195.13974	0.23
197.1090698	0.27
199.1527405	0.24
201.1543732	0.42
203.0897217	0.64
205.176178	0.57
207.1143799	0.04
207.9250488	0.19
208.9461975	0.23
211.0375061	0.74
212.9770508	0.34
215.2330627	0.47
217.0318604	1.20
219.1351318	0.28
220.4887085	0.12
221.1825562	0.06
222.0991211	0.06
223.3660278	0.34
224.1334534	0.03
225.2229004	0.40
227.1976318	0.60
228.2963867	0.18
229.2374268	0.35
231.09729	1.04
233.1011963	0.15
239.2666321	0.15
241.213562	0.18
242.9729614	0.17
245.2333984	1.62
247.2557678	5.28
251.3456421	0.15
253.3464355	0.06
255.2528076	0.29
256.6219788	0.16
257.3200684	0.22
258.6921082	0.17
259.3179932	0.55
261.2232971	0.13
263.2875366	0.19
265.2019348	0.26
267.1030273	0.65
269.2705078	0.08
270.225708	0.04
271.2865601	0.36
273.2442627	0.11
277.2180176	0.08
279.1386719	0.28
281.2491455	0.64
283.1335449	0.41
284.815979	0.14
285.4266357	0.41
287.3121338	0.29
292.2348938	0.11
295.1472168	0.37
297.3140869	0.58
298.5935669	0.19
299.3609924	1.48
305.2466736	2.10
306.3069763	0.06
309.3747253	0.16
311.39505	0.03
313.0619507	0.78
318.7914734	0.03
323.2479248	100.00
323.9869995	0.71
325.4421692	0.11
327.2612915	0.03
341.1984558	1.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	312.095
Annotation	Zidovudine
Peak:m/z	Relative Intensity
92.1104355	0.12
128.1768799	0.03
129.6140137	0.08
132.2044525	0.06
133.9737091	47.47
134.5869904	0.07
137.0369873	0.04
144.1406708	0.17
145.1364136	0.22
176.3367615	0.09
180.0958405	0.05
185.9379272	0.23
191.0323029	0.09
210.1146240	0.05
224.0090942	0.07
226.2416077	0.06
250.4710999	0.09
251.0946045	0.05
252.1430359	0.27
255.9003906	0.05
265.9828796	100.00
266.6072998	0.49
269.1904907	0.06
276.2532959	0.09
293.5902710	0.45
294.5961914	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	257.19
Annotation	3-Deoxyestradiol
Peak:m/z	Relative Intensity
74.96005249	0.72
76.80070496	21.93
78.99402618	0.09
80.9740448	0.81
83.06340027	1.54
84.79381561	0.41
93.03632355	0.30
94.95173645	3.34
96.98326111	2.54
97.75343323	0.33
98.98433685	0.27
100.9919434	0.65
104.7268677	0.69
107.1187134	0.22
108.9494934	3.51
110.9174957	0.93
113.0149536	0.15
114.992157	0.61
117.1689606	0.05
118.7844238	0.73
120.8301392	0.24
121.8807831	0.22
123.0788879	2.38
125.2649841	0.22
127.0460815	0.16
128.9813232	7.43
130.9045563	0.38
133.0058289	1.48
134.8844757	0.37
137.1734467	0.57
139.0441742	0.41
141.00354	0.84
142.9713287	14.76
145.0384827	1.32
146.9691162	0.84
148.9731293	0.22
150.9508362	1.11
152.9772491	0.07
155.0265961	3.19
156.9989777	7.29
159.0131073	0.55
160.8994598	1.30
168.0322571	0.18
169.0213928	1.48
171.037796	0.65
173.0644073	1.29
173.8379059	0.08
175.0380402	0.47
176.1669617	0.22
176.8250427	0.60
179.145401	8.39
182.9508514	2.17
183.897171	0.05
185.1663055	0.26
187.0307922	0.24
189.1954956	0.24
193.3045502	0.25
195.0568085	0.17
197.0143585	0.78
198.0683899	0.31
199.1729736	0.95
201.2425079	0.50
202.9116669	0.23
207.3691559	0.19
208.8628082	0.14
211.1219177	4.53
212.7275696	0.43
213.3613892	0.10
215.108139	0.69
216.027359	0.06
221.1730042	4.90
227.8801575	0.29
229.2021942	0.44
237.1912079	0.08
239.1783295	100.00
239.9984741	1.22
240.9827118	0.13
248.2009125	0.11
257.2619629	0.83
261.7804871	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	600.7
Annotation	Unknow
Peak:m/z	Relative Intensity
212.9487457	0.24
214.8858948	0.19
215.6892700	0.11
232.0730743	0.06
251.3297424	0.08
281.0210571	0.04
290.7949219	0.05
296.9834900	0.10
305.1972046	0.06
328.2081299	0.07
348.7807007	0.46
364.8481445	4.51
374.1857910	0.07
380.8202515	1.41
386.7822266	0.08
388.8633423	0.33
402.0603638	0.11
404.1443481	0.05
406.1075439	0.11
408.1059570	0.84
420.7098389	0.11
424.2487793	0.31
425.1221313	0.04
426.2531128	0.48
427.1457520	0.03
432.7086792	7.03
443.8790283	0.32
445.2461548	0.21
446.9359741	0.23
448.7509766	11.90
464.6336670	0.76
465.3715210	0.08
488.8011475	0.05
494.6073608	0.04
496.0773926	0.16
500.2841797	0.06
500.9282837	0.03
502.9762573	0.04
507.0809326	0.07
514.5674438	0.44
516.7027588	100.00
532.5130005	9.33
533.1975708	0.13
554.9409790	0.66
582.9873047	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	501.92
Annotation	Unknow
Peak:m/z	Relative Intensity
155.1160889	0.03
158.9630432	3.77
159.9826355	0.41
199.0044098	0.58
199.8618011	0.61
216.7295380	0.19
228.8853760	0.65
230.1611328	0.61
242.9722290	0.05
272.9760742	41.61
273.9656067	35.15
372.0886230	0.27
387.0538330	40.26
387.9466248	100.00
412.0121765	0.22
428.0830994	0.17
430.9086304	0.10
446.8544922	0.13
455.8385925	1.01
457.0473938	0.14
471.8022766	0.07
474.9838257	0.24
484.0405884	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1031.105
Annotation	Unknow
Peak:m/z	Relative Intensity
291.2803040	0.28
302.0273132	0.07
324.2159119	0.17
325.2580566	0.75
326.1339722	0.43
336.4545593	0.61
359.5136719	0.08
377.4423828	0.07
379.4648743	0.17
392.2244568	0.08
393.5046387	0.34
404.3593750	0.12
421.0730591	0.58
425.2405701	0.47
431.2351379	0.28
439.4187012	2.42
440.3608398	0.57
441.3545227	0.29
445.3309937	0.07
448.2282104	0.39
459.3666687	0.21
468.3645020	0.24
477.9677124	0.08
492.3853760	0.10
493.3290100	0.20
494.2756042	0.13
506.5854492	0.06
507.4032593	0.19
518.0947876	0.10
523.8734741	0.90
524.5816040	0.21
525.4747314	0.19
534.3218994	0.37
535.3696289	0.10
544.5844727	0.20
552.3051758	0.92
553.2138672	0.37
555.5468750	0.12
557.1030273	0.10
562.4116211	0.84
566.4953003	0.21
567.1217651	0.09
602.4751587	0.10
606.3858643	0.37
609.3331299	0.14
620.3159180	0.24
623.0299683	0.74
628.8920898	0.34
635.2229004	0.47
641.3851318	0.12
642.3170166	0.37
648.2427368	0.50
650.0507812	0.07
659.3430786	0.06
663.4561768	0.10
671.3786011	0.17
679.2530518	0.92
686.3244629	0.24
687.7575684	0.53
691.2974854	0.36
694.2387695	0.20
712.2893677	0.15
714.5656128	0.17
721.2080078	0.15
730.6639404	0.20
740.0716553	0.80
744.9266968	0.64
746.4189453	0.26
755.5137329	0.15
770.5164795	0.25
772.5057373	0.19
773.7185059	0.66
779.2648315	0.24
783.1896973	0.17
787.4471436	0.21
788.2495117	1.10
792.8218994	0.34
798.3150635	0.22
804.8569336	0.20
807.0487061	0.30
811.4642334	0.07
814.2977295	0.13
820.6805420	0.10
824.6343994	0.24
825.4698486	0.34
829.4995117	0.33
834.0113525	0.15
834.7401123	0.58
836.1879883	0.62
837.1630859	0.07
838.6463623	0.24
841.4289551	0.71
842.3925781	0.44
849.2329102	0.25
861.7886963	0.18
863.2196045	0.14
867.2813721	0.07
870.7716064	0.17
871.4042969	0.87
872.8762207	0.87
873.8951416	0.10
876.2833252	0.32
879.1433105	1.30
880.5946045	0.24
881.3955078	0.61
882.0058594	1.27
882.8017578	0.76
884.3311768	0.18
887.3726807	0.45
888.1390381	0.79
893.0197754	0.44
894.1182861	0.28
895.3856201	0.83
896.8553467	0.78
900.4973145	0.45
902.3621826	0.55
903.4083252	1.08
904.1680908	0.24
906.1999512	0.87
909.2133789	0.43
911.8907471	2.82
912.5362549	0.93
914.2675781	1.26
914.9251709	0.37
916.3343506	1.01
917.0653076	1.57
917.8428955	0.85
918.5996094	1.21
919.7897949	1.15
920.5738525	1.83
921.3016357	0.16
922.3121338	1.73
923.1483154	1.10
925.5140381	1.19
926.4182129	2.05
927.1051025	0.46
928.3161621	0.79
929.4791260	0.09
931.3511963	0.08
933.0755615	2.67
934.0039062	1.39
935.4515381	0.12
938.9873047	1.83
939.7071533	2.78
940.9207764	3.33
942.2443848	0.43
944.1079102	3.94
944.8288574	0.19
945.4713135	0.13
946.4367676	1.57
947.7368164	1.78
950.2353516	12.14
951.1972656	1.25
952.3029785	0.95
954.8134766	1.84
955.7353516	4.27
957.8215332	0.73
958.5609131	2.47
960.6149902	3.78
961.2493896	0.49
962.2709961	1.03
963.5050049	0.44
964.4080811	0.42
966.0270996	2.70
967.0053711	0.64
969.3647461	2.66
970.6264648	1.52
972.3347168	6.99
973.1763916	7.56
973.8747559	0.40
974.9975586	0.53
976.0424805	3.86
977.2385254	0.59
978.3880615	16.17
979.0461426	30.41
980.6473389	0.87
981.7812500	13.99
982.4841309	9.41
983.5832520	1.11
985.0319824	0.89
986.1989746	0.70
987.4360352	7.40
988.1188965	100.00
989.4934082	1.39
990.1081543	0.83
990.8427734	0.40
991.7550049	0.80
992.4516602	0.18
994.1108398	7.27
994.8448486	1.83
995.6116943	0.52
996.6884766	0.54
997.8347168	0.59
998.9123535	0.95
1000.3453370	1.49
1003.0402830	1.36
1004.7963870	1.02
1006.8325200	0.65
1009.1771240	1.38
1010.5006100	1.76
1013.5593260	2.34
1014.3144530	1.36
1016.3493650	6.54
1017.4869380	1.91
1018.2597660	1.19
1019.4309080	0.58
1020.3280030	1.80
1021.6787110	0.64
1038.5629880	0.39
1047.3193360	0.38
1052.3742680	0.18
1055.4204100	0.54
1056.6516110	0.23
1062.0922850	0.53
1063.6345210	0.46
1072.3359380	0.14
1073.1542970	0.27
1083.1124270	0.28
1084.9699710	0.23
1086.4615480	0.39
1087.2088620	0.42
1087.9747310	0.60
1091.4780270	0.24
1092.9436040	0.19
1094.6687010	0.22
1095.7844240	1.34
1096.6296390	1.09
1097.3839110	0.05
1104.4154050	1.18
1105.4609380	0.47
1108.0981450	0.24
1109.0852050	0.53
1110.2144780	0.19
1112.1911620	1.15
1115.4284670	0.73
1120.8920900	1.75
1122.0883790	0.65
1125.4636230	0.42
1129.5749510	0.26
1135.4182130	0.30
1138.0817870	0.11
1138.9133300	0.34
1144.4184570	0.37
1145.0213620	1.09
1145.9030760	0.39
1149.2225340	0.14
1152.0537110	1.38
1152.8288570	0.31
1154.2897950	0.08
1156.1296390	0.17
1157.9001460	0.88
1159.1276860	0.40
1160.1961670	2.04
1160.8833010	1.15
1162.1802980	1.80
1163.0483400	0.26
1163.8229980	0.48
1164.6405030	0.38
1166.8198240	0.15
1168.6586910	0.26
1172.2844240	0.17
1173.8178710	1.43
1178.6518550	1.47
1179.3740230	0.10
1183.4353030	0.68
1184.4661870	0.70
1186.5383300	1.65
1187.2264400	0.10
1189.4141850	0.52
1191.7416990	0.41
1196.3956300	0.83
1197.4572750	0.11
1198.2332760	0.68
1200.0720210	2.22
1201.6586910	0.72
1205.3134770	5.53
1206.3035890	1.63
1207.3463130	0.33
1209.5028080	1.07
1210.6064450	0.10
1212.0941160	0.15
1213.0694580	0.09
1214.4312740	0.55
1215.3398440	1.09
1216.0439450	0.33
1217.2067870	0.59
1218.3728030	0.10
1218.9819340	0.46
1220.8934330	0.71
1221.8464360	0.35
1222.8164060	0.49
1225.9750980	0.61
1226.5944820	0.64
1228.4433590	0.10
1229.1153560	0.16
1230.4289550	0.92
1233.3366700	0.60
1234.3492430	2.33
1235.2664790	0.33
1236.5454100	0.82
1237.6000980	0.29
1239.1075440	0.31
1240.1691890	0.74
1241.7827150	1.19
1242.6733400	1.86
1243.4956050	0.79
1244.2917480	0.62
1246.1610110	1.30
1246.8846440	0.47
1248.0905760	0.35
1252.7158200	0.96
1253.9748540	1.11
1255.5554200	0.52
1257.1137700	1.44
1260.9575200	0.23
1262.2432860	4.32
1263.1562500	2.96
1266.3305660	1.51
1269.7442630	0.56
1271.0017090	7.77
1272.1655270	3.33
1273.1037600	1.23
1275.2771000	0.61
1276.9764400	0.39
1278.3288570	1.07
1279.1147460	0.39
1280.9390870	1.09
1281.6060790	0.45
1282.6474610	0.11
1283.7926030	0.48
1284.6790770	0.05
1285.2805180	0.24
1286.2927250	1.13
1287.0397950	0.09
1288.0819090	0.96
1289.1750490	1.13
1291.7021480	0.99
1292.8403320	0.95
1293.6352540	0.39
1295.3804930	1.07
1296.8453370	1.63
1298.3009030	0.26
1302.0765380	1.39
1303.6965330	0.25
1305.9910890	1.53
1306.7294920	1.36
1307.4030760	0.09
1308.8376460	0.51
1309.9351810	1.28
1310.7348630	1.58
1311.6724850	2.53
1312.3457030	0.08
1313.1793210	0.37
1314.3261720	1.72
1315.3428960	1.67
1316.1199950	0.57
1317.5197750	0.60
1318.7698970	4.32
1319.4510500	1.52
1320.1374510	0.90
1321.4005130	0.14
1322.3245850	0.61
1323.2156980	1.66
1324.1081540	0.38
1327.6044920	5.38
1328.5501710	1.92
1329.3946530	0.39
1332.8070070	0.12
1335.2370610	0.46
1338.7513430	0.28
1340.9860840	0.44
1341.6024170	0.22
1343.6748050	1.91
1344.4562990	1.26
1345.2012940	0.20
1346.1695560	0.20
1348.1145020	0.66
1350.1693120	0.46
1351.3946530	0.89
1352.4506840	0.36
1353.1099850	0.25
1353.8708500	0.32
1357.1248780	0.72
1359.1761470	0.58
1360.3432620	0.33
1361.7746580	0.87
1363.1093750	0.44
1364.5218510	0.55
1366.2735600	0.21
1367.4649660	2.08
1368.8138430	2.12
1369.7791750	0.10
1370.4328610	0.31
1371.6134030	1.57
1372.3580320	0.57
1373.1073000	0.35
1373.7783200	0.46
1374.8221440	0.93
1376.0722660	2.87
1377.0449220	1.69
1377.6540530	0.70
1378.7410890	2.91
1379.3853760	15.30
1380.0714110	6.09
1381.0989990	0.60
1383.0072020	0.98
1383.8951420	0.26
1385.0289310	1.68
1386.0865480	1.87
1387.7669680	0.28
1389.3668210	0.30
1390.3663330	1.38
1392.1170650	0.58
1396.4190670	0.15
1397.0284420	0.80
1398.6707760	1.64
1399.8533940	7.06
1400.6077880	1.05
1401.8691410	0.50
1403.5511470	0.34
1404.8262940	0.97
1407.9198000	17.15
1408.7458500	5.77
1409.6405030	2.06
1410.9404300	1.98
1411.7656250	0.12
1415.0122070	0.27
1415.7542720	0.40
1417.1696780	12.53
1418.0655520	3.19
1419.0878910	0.79
1419.8128660	0.57
1421.8889160	0.13
1424.5389400	7.78
1425.3544920	6.01
1426.2094730	0.28
1427.4940190	0.67
1428.5471190	0.12
1430.6984860	0.29
1431.5319820	0.16
1432.9046630	3.63
1433.7061770	1.02
1434.4625240	0.31
1435.1451420	2.53
1436.6820070	1.84
1437.5981450	0.80
1438.8371580	0.28
1439.8172610	0.29
1441.4246830	5.97
1442.3065190	1.80
1445.5549320	0.47
1448.6016850	0.53
1453.4974370	0.58
1454.3338620	0.93
1455.1688230	1.00
1456.3739010	1.78
1457.2163090	0.62
1458.7227780	0.19
1460.7564700	0.21
1461.3758540	0.13
1463.8157960	0.14
1465.2270510	2.54
1466.3175050	0.27
1466.9204100	0.77
1467.6386720	0.51
1471.8714600	1.42
1473.3437500	4.81
1474.1745610	2.44
1474.8189700	0.39
1479.5694580	0.12
1481.3289790	36.18
1482.2176510	10.56
1482.8885500	2.79
1484.0444340	1.21
1485.4731450	0.31
1486.3238530	0.43
1490.3011470	4.11
1491.5291750	2.00
1498.1279300	0.97
1499.4149170	0.20
1502.9305420	0.54
1512.4722900	0.16
1517.6248780	0.22
1536.5808110	0.18
1538.4703370	0.48
1578.7498780	0.21
1581.2637940	0.14
1589.3908690	0.22
1596.9218750	0.10
1597.5594480	0.20
1625.4366460	0.33
1636.8126220	0.65
1651.6187740	0.23
1663.9508060	0.12
1666.3590090	0.12
1677.2899170	0.14
1714.2166750	0.31
1716.7076420	0.05
1734.9333500	0.36
1736.8970950	0.55
1764.3094480	0.58
1773.4581300	0.28
1776.7679440	0.18
1781.8571780	0.41
1787.1677250	0.36
1787.8006590	0.11
1821.6013180	0.26
1840.1794430	0.25
1844.7058110	0.20
1851.0187990	0.19
1865.0672610	0.09
1865.7349850	0.25
1897.3223880	0.23
1915.5711670	0.39
1917.5222170	0.36
1925.7176510	0.10
1956.6644290	0.50
1968.7725830	0.19
1973.8450930	0.67
1992.5909420	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2499
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.07463074	0.33
103.0401382	0.04
105.1228409	0.18
106.9553833	1.81
109.0877228	1.02
110.9109268	0.27
113.0143509	0.27
115.0859451	0.04
117.0530548	0.94
118.9450836	0.30
121.0356598	2.56
123.0333252	0.43
124.8684006	0.34
126.927002	0.03
129.0592957	0.51
131.0291595	0.95
131.8318329	0.10
133.0293274	0.19
135.035553	1.63
137.0458832	0.30
139.011322	0.07
140.947998	0.53
142.9649506	2.03
145.0550995	0.34
147.0220337	1.18
149.0405884	1.99
150.8995667	0.80
151.9871521	0.83
153.0593262	0.94
154.9589844	0.81
157.018219	0.99
158.0447998	0.05
158.9110718	1.63
161.0459442	0.75
163.081543	0.58
165.1225281	2.12
166.0469818	0.89
167.061554	0.95
168.1190491	0.10
169.0450439	3.48
170.1057434	0.03
171.1636658	0.37
172.9350128	4.75
175.1316833	1.15
175.9660187	0.13
176.9200439	0.06
179.0662689	0.20
180.8735046	0.23
182.9955444	1.84
184.1687164	0.08
185.0431213	0.65
187.0875092	2.67
188.9685059	0.29
191.1591797	0.28
192.056366	0.11
193.2101135	0.43
195.2299194	0.49
197.0090637	0.97
199.0356445	0.07
200.2834015	0.11
201.101181	0.68
202.1911774	0.25
203.0435181	0.08
205.1760101	0.94
207.1296997	0.20
208.2129211	0.10
209.0471191	0.32
209.7090759	0.03
211.0541992	1.09
213.1828003	0.17
215.0061646	2.52
216.0330811	0.06
217.0455627	0.40
219.1433411	0.22
223.2245789	2.34
224.3699646	0.15
227.182312	0.04
228.0892334	3.15
229.0596619	7.69
230.203064	1.33
231.1482239	0.41
233.0028076	1.42
234.1318054	0.41
235.515564	0.16
238.9307556	0.08
240.9840698	0.72
242.2432861	0.23
243.1728516	0.76
245.1218567	1.38
247.1026917	8.90
248.1612549	0.50
249.4313354	0.08
251.1975708	0.54
252.5939636	0.18
253.3283081	0.11
255.1489868	0.12
257.1654053	0.61
259.3757629	0.29
261.3848267	0.09
263.2873535	0.20
264.5548706	0.04
265.1876221	0.32
268.0036011	0.27
269.4013672	0.14
270.2621155	0.06
271.0071106	0.04
271.7280884	0.09
273.3814697	0.04
277.2463989	0.38
279.265686	0.18
281.3328247	0.33
283.0738831	0.11
283.7716064	0.07
285.1738281	0.56
287.1849365	1.08
294.1415405	0.04
295.177063	1.69
296.2373657	0.35
297.3379517	0.31
299.1931152	1.71
300.0101624	0.11
303.719574	0.10
305.2991028	4.15
306.2400513	0.06
310.033783	0.06
311.2357788	0.07
313.3479004	2.44
323.2406921	100.00
324.1246338	0.29
325.074646	0.12
326.427124	0.13
332.3338013	0.07
341.1965027	0.70
346.3413391	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	308.0902
Annotation	Glutathione
Peak:m/z	Relative Intensity
87.8914871	0.02
116.0187988	1.13
129.9561310	0.60
143.9773712	2.28
146.0934753	0.06
151.0863037	0.18
152.0591736	0.04
161.9272156	25.32
162.7831573	0.05
175.0187378	0.06
178.9589996	100.00
185.9872742	0.07
192.9919891	0.03
204.7713318	0.08
214.9310303	0.69
215.9625244	0.02
233.0650635	15.72
245.0748901	1.04
261.3029785	0.03
270.7020264	0.02
272.0863342	1.36
290.0736389	5.51
291.1426697	1.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.1136
Annotation	3'-O-Methylguanosine
Peak:m/z	Relative Intensity
92.0110397	0.13
117.8879242	0.06
123.9604797	0.08
133.2406158	0.14
136.0092773	0.96
139.0582581	0.10
151.9443207	100.00
164.0763397	0.07
166.0349731	2.13
166.9329834	0.12
172.1533813	0.10
193.1276093	0.28
205.0701904	0.21
236.0958557	0.06
238.0706482	0.53
239.3029480	0.06
240.4155273	0.18
244.1049500	0.07
251.8359070	1.11
253.1440125	0.17
254.0882874	0.08
257.0637817	1.35
263.2398682	0.11
280.0135498	0.90
281.0626526	1.30
289.0593567	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	399.2024
Annotation	Cincassiol B
Peak:m/z	Relative Intensity
125.8051147	0.08
191.0493164	0.12
207.9903259	0.06
255.0036926	0.03
258.5737305	0.07
265.1382446	0.10
271.1097717	0.07
300.9374390	0.02
311.2150269	0.04
325.1813660	0.06
327.1668091	0.06
329.2057800	0.04
331.0572815	0.03
337.1083984	0.08
341.2639160	0.17
353.0447388	0.23
355.0809021	0.04
357.2993469	0.09
360.8415222	0.03
364.1276855	0.13
369.2615967	100.00
370.4367065	0.09
371.8882446	0.11
373.0717163	0.10
381.2320251	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	450.2626
Annotation	PE(16:1(9Z)/0:0)
Peak:m/z	Relative Intensity
140.1199951	0.09
196.0008087	0.44
200.0573730	0.19
210.1081543	0.09
214.0054321	2.02
253.2176819	100.00
264.4529724	0.08
268.0614624	0.09
276.9368591	0.09
279.9873962	0.13
297.9512634	0.13
306.3694458	0.10
308.1217957	0.11
318.4557190	0.13
334.5021667	0.13
360.9577026	0.09
366.2223816	0.11
371.3200378	0.06
378.2133789	0.12
382.8457947	0.23
387.5727844	0.06
396.8847961	0.09
404.0877991	0.07
406.1105652	0.30
407.2049866	0.33
412.3482971	0.07
414.2878723	1.17
415.4589539	0.07
432.0209045	0.17
432.7202148	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	500.9197
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9538574	2.28
160.0696106	0.60
199.0450134	0.65
200.0126343	0.76
200.9709167	0.05
202.0673523	0.21
216.9916687	0.28
218.2560120	0.21
228.9667664	0.22
229.9315186	0.59
272.9527893	33.31
273.9418030	41.08
371.9471436	0.07
387.0868530	43.77
387.9557190	100.00
412.0651245	0.09
417.0642700	0.22
428.0462341	0.47
429.9870605	0.06
454.3024597	0.10
455.3820190	0.12
457.0978699	0.11
458.9547119	0.43
483.6381226	0.51
486.2283630	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	714.5081
Annotation	1-Palmitoyl-2-linoleoyl PE
Peak:m/z	Relative Intensity
255.2092438	29.60
279.2270203	100.00
282.1501465	1.67
296.3214111	1.10
345.5298462	1.82
390.5560913	1.88
433.4403076	1.82
445.1883545	2.68
450.220459	1.03
452.4659424	18.22
461.2203979	1.61
466.5437622	2.73
474.6137695	1.38
562.5372925	4.30
566.2954712	0.46
589.2684326	0.75
627.7877808	1.66
670.6873169	2.81
678.5245361	1.39
696.2142334	6.12
697.024292	4.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.21150208	0.14
99.00131989	0.17
104.9713211	0.10
106.8936615	0.85
108.9728241	2.40
110.829277	0.58
113.0022507	0.25
117.0090561	0.47
119.2419662	0.43
120.9816818	2.85
123.1388016	1.09
125.1168823	0.31
128.8612671	0.12
131.1459351	0.37
132.8456573	1.54
135.0253143	3.96
135.8069305	0.11
137.0397949	0.53
139.1486816	0.62
141.9633179	0.04
143.0563812	1.66
147.0475769	2.40
148.1670685	0.09
148.9963989	2.99
151.0227661	0.86
157.084137	0.33
158.3578491	0.17
159.0222168	0.34
161.0122833	1.91
163.1507568	0.73
164.1394043	0.11
165.1794739	0.74
166.1213837	0.19
169.1505432	0.70
171.0854492	0.79
173.0850372	0.39
175.0511017	1.38
176.8310547	0.14
179.197113	0.26
179.9486542	0.30
180.9967346	0.22
182.9046631	1.24
186.938446	0.87
189.1469727	1.15
192.9537506	0.18
195.110672	0.36
197.0808563	0.33
199.1010437	0.65
199.9373474	0.04
201.1142883	0.48
203.0659943	0.79
205.2962952	0.55
206.1623535	0.39
207.2052765	0.81
209.1891174	0.46
211.0982056	0.59
212.8809204	0.29
214.9512024	0.44
217.1940308	2.21
218.0890808	0.05
221.1026611	0.76
223.1251526	1.10
225.0434875	0.17
227.2216797	0.47
229.2131348	1.02
231.1405029	1.43
233.2279053	0.28
235.1030884	0.65
237.0309753	0.46
239.2643127	0.49
241.2528076	0.06
242.2348328	0.35
245.2364197	2.13
247.3075867	6.03
249.0956421	0.24
251.3803406	0.07
253.194519	1.04
254.0167236	0.19
255.092041	0.48
256.7753296	0.13
257.4046021	0.36
258.6313477	0.34
259.2600098	0.40
259.8844604	0.23
263.2674255	0.29
265.1640625	0.25
266.9093628	0.28
269.0856323	0.13
270.1878662	0.58
271.1950684	0.69
275.6036377	0.19
276.2975464	0.37
277.2272949	0.13
279.2466431	0.67
281.1212769	1.26
283.2258606	1.33
285.2953186	0.15
287.5197144	0.25
292.1702271	0.08
293.2421875	0.17
294.3055115	0.06
295.3941345	1.13
296.2586365	0.43
297.093689	0.45
297.9247742	0.61
299.2038574	1.79
299.974884	0.79
303.4793091	0.06
305.2588501	2.15
307.1372375	0.27
309.0918579	0.14
310.1508179	0.16
310.8775635	0.06
313.1466675	0.48
318.0512695	0.07
321.3188477	0.30
323.2337646	100.00
324.0628662	0.55
332.552948	0.18
341.3053284	0.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	586.0476
Annotation	Unknow
Peak:m/z	Relative Intensity
172.0218506	0.53
173.1005707	0.34
183.1102905	0.13
186.0123291	0.20
191.0364227	3.09
196.1450500	0.13
199.8591461	30.49
213.9216156	0.12
215.8049927	0.98
217.0715332	0.42
227.9118500	0.34
229.9387665	0.80
231.7426147	0.29
232.5592041	0.09
236.2490540	0.11
243.0703735	32.21
243.9375458	3.05
248.3038025	0.31
258.0301514	0.36
260.0424805	0.11
262.0284729	2.39
270.1786499	0.23
271.9987488	0.32
274.0916138	0.63
274.9980469	0.20
286.0234375	6.13
288.0821533	0.09
290.0233765	0.28
292.3203735	0.17
301.9655151	0.83
303.9611206	74.86
306.2908325	0.16
307.3235474	0.21
316.0671082	6.90
319.1585083	0.12
320.1687012	0.39
334.0581665	8.36
335.0162964	0.30
345.7430420	0.22
347.9511108	0.68
364.0342407	1.50
378.0925903	1.64
380.2073975	0.21
388.3444824	0.07
393.9097900	0.57
395.2141113	7.84
396.1156006	54.86
406.0443726	31.83
412.1883545	8.74
413.3892822	0.35
414.1398926	0.14
418.2300415	0.44
423.3856812	1.00
424.0084839	25.00
426.2374268	0.25
430.9498901	0.18
436.6665649	0.41
437.7837524	0.26
450.2211914	0.11
452.0740967	64.61
453.1137695	0.45
454.0368652	1.70
457.1369019	0.28
457.7485352	0.34
465.0024414	0.40
466.1370850	0.62
479.9932861	1.37
482.1707764	52.08
495.6682739	2.69
496.2860107	1.93
498.1275024	25.40
508.2189331	0.19
512.2672729	0.11
524.2044678	0.77
525.1492310	0.25
526.3025513	0.12
540.4928589	0.91
541.5454712	3.23
542.1997070	6.31
568.1271362	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	679.2947
Annotation	Hv-NCC-1
Peak:m/z	Relative Intensity
204.1022034	0.54
220.4378052	0.13
246.2417450	0.51
250.1218109	0.06
253.2582855	0.12
273.3003235	0.36
287.1838989	0.21
299.2075195	1.15
305.2794800	0.12
311.1683960	0.20
315.1952820	1.71
323.0254517	0.83
325.2736206	0.43
327.3085938	0.09
337.1762695	1.50
339.0865784	0.10
343.0828247	0.12
344.7921753	0.19
355.5614624	0.15
357.2429810	0.52
359.1018066	0.34
360.3173828	0.22
365.2001343	0.21
369.2122192	0.10
371.4167480	0.86
372.8159180	0.37
383.1362915	0.67
389.1451416	0.13
401.2142944	3.42
414.9533081	0.42
433.1618042	2.42
434.6134033	0.13
438.3409424	0.09
450.3752441	0.39
461.1408691	0.06
462.3150024	0.11
464.2525635	13.98
464.9325562	0.07
466.0546875	0.41
472.2166138	0.28
476.4335938	0.13
480.2301025	0.33
482.2139893	1.41
484.4730225	0.27
490.2077026	10.47
491.0683594	0.10
492.3335571	0.41
493.0568237	0.21
494.1182861	0.40
508.1269531	5.99
510.1421509	0.11
514.3380127	1.19
522.2854614	29.25
523.3906860	0.07
524.2310181	0.08
526.0960083	1.20
528.4024048	0.23
554.5305176	0.37
559.2181396	0.14
567.6293945	0.05
583.2605591	0.86
585.2576904	0.35
587.4016724	2.01
593.2109375	0.35
598.6432495	0.08
603.2624512	3.07
605.6917114	0.28
611.2201538	3.37
615.1038818	0.27
619.4390259	3.48
621.5307617	0.50
625.4863892	0.24
629.2548218	9.98
633.3625488	0.08
635.5776978	0.27
641.2696533	0.13
643.1056519	5.35
647.2595825	100.00
647.9169312	0.16
650.7129517	0.27
657.4545898	0.29
661.2453003	3.77
670.1829834	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
121.1477203	0.36
141.1436768	0.41
142.7896118	0.34
145.0132599	0.54
149.0243835	0.24
157.5208893	0.16
161.1086731	0.32
165.2518616	0.46
171.0283203	0.81
173.0077209	0.26
183.344986	0.18
187.079834	2.42
199.1183472	1.19
200.9936523	0.22
202.9984894	0.56
207.2290497	0.17
215.1936646	1.63
227.1448059	1.38
229.1212769	1.89
239.1482239	0.22
241.1209717	0.52
243.2604675	0.74
245.5413818	0.20
255.2764282	1.21
257.2767029	2.16
259.374054	0.53
261.3796387	0.34
263.2967224	0.21
268.2002563	0.39
269.1881714	1.96
271.0877075	1.76
271.7193909	0.17
276.3933716	0.37
278.0013123	0.38
285.2052307	2.90
286.1991577	0.46
287.4248047	0.69
289.2578125	0.75
295.1693115	1.73
297.4663391	1.89
299.242157	5.83
300.7910156	0.33
301.4140015	0.53
302.9689941	0.39
307.2096252	0.44
311.013855	1.08
313.1374817	2.92
314.2819214	0.46
315.3547363	0.77
321.3078613	1.79
322.1044922	0.44
323.4248047	8.36
325.2678223	0.81
329.243103	0.57
331.1325073	0.24
337.4914856	0.77
339.2406311	100.00
341.2748413	23.54
343.4217834	0.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	237.1228
Annotation	Alanyl-Phenylalanine
Peak:m/z	Relative Intensity
83.7838745	0.04
90.9131317	67.08
107.9001160	100.00
108.8233948	0.05
120.9770660	0.14
129.9850006	0.38
167.1363068	0.04
167.8680573	0.07
191.1294250	9.34
192.0670319	0.72
192.8964844	0.05
195.1355743	0.04
196.1881561	0.03
200.8154144	0.03
209.1105957	0.43
220.0722809	82.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.0148
Annotation	Unknow
Peak:m/z	Relative Intensity
169.3626099	0.02
182.9586182	0.05
220.9814148	0.07
223.8848724	100.00
224.5563812	0.13
237.1374512	0.01
241.7389374	11.52
242.3433990	0.07
243.8351593	0.01
246.3327484	0.01
265.0214539	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	515.1255
Annotation	b-D-Glucuronopyranosyl-(1->3)-a-D-galacturonopyranosyl-(1->2)-L-rhamnose
Peak:m/z	Relative Intensity
149.0353394	0.11
160.8959503	0.12
170.9180603	0.07
172.0776978	0.17
173.0637360	5.51
175.2308044	0.07
178.8275146	0.88
233.0312500	0.21
252.0862732	0.13
263.1976929	0.13
269.2635498	0.08
271.2661133	0.14
272.4204712	0.05
273.0311890	0.07
275.1589355	0.23
309.4307251	0.26
321.3148193	0.09
323.2667847	0.11
335.2377930	0.78
341.1285400	100.00
350.9984131	0.10
353.0834961	0.17
365.2642822	0.18
383.1854858	0.27
392.0150757	0.10
419.9018555	0.05
425.2746582	0.23
426.3150635	0.10
428.0598145	0.09
440.6998291	0.04
457.0769043	0.06
459.7291870	0.17
468.9357300	0.33
470.7106323	0.14
497.3353882	0.24
498.1867676	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	673.22
Annotation	(+)-Pinoresinol 4-O-(6''-O-galloyl)-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
214.8060760	0.29
312.9525146	0.24
328.9308472	0.12
331.4421692	0.62
335.5626221	0.28
348.7435303	0.22
412.8678589	0.12
427.0308228	0.06
427.9133301	0.45
428.9848022	0.75
429.8474121	0.22
436.4560547	0.43
442.9938965	3.18
443.9620972	1.64
444.9814453	4.37
445.8834229	0.20
459.0683594	0.32
517.1376343	0.26
527.1043091	0.42
527.8771973	1.28
528.6748657	0.19
542.7671509	1.57
544.0441284	1.15
549.0986938	0.06
556.7684937	24.51
557.8729858	26.79
558.8587646	100.00
559.9724731	27.72
572.5688477	0.25
574.3023071	0.12
576.3468628	0.39
577.4053345	0.10
597.4707642	0.08
598.6605225	0.61
608.9450073	0.09
612.9230347	0.20
627.0531616	1.01
627.7327271	0.33
628.6062622	0.48
642.3938599	0.27
644.9525757	0.44
646.1742554	0.23
649.7784424	0.73
653.2924194	0.12
655.2315063	0.23
656.1690674	0.28
657.3898315	0.36
658.9969482	0.13
659.8866577	0.05
682.7856445	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0712
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
105.0004578	0.10
149.1374969	0.19
169.1034393	0.28
174.1781464	0.53
179.123642	0.56
181.0305634	0.10
196.2945557	0.08
204.3469391	0.19
205.8955078	0.99
207.1820984	3.27
208.0827179	3.25
209.279953	0.57
210.1267395	0.11
221.1542206	0.22
222.0706635	2.09
223.0367279	3.63
223.9750671	0.70
251.0790405	100.00
252.1975098	19.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	501.1721
Annotation	Unknow
Peak:m/z	Relative Intensity
177.1498871	0.03
191.0302429	0.03
204.9983521	0.34
209.0632019	0.02
219.1586304	1.65
243.2234955	0.07
261.1640625	0.08
297.2407227	0.03
301.7857056	0.02
321.1778870	1.31
339.1380615	100.00
340.9889526	0.06
356.8602600	0.02
367.2620850	0.11
368.5089722	0.03
371.8106689	0.02
381.1426086	0.03
399.1181641	0.02
425.3041992	0.03
427.1940308	0.05
455.2007751	0.57
455.9901428	0.11
457.7551880	0.05
473.9839478	0.06
483.3257141	0.70
484.3769836	0.10
485.8576965	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
85.09831238	0.09
87.01122284	0.12
91.04099274	0.47
92.90802002	0.21
95.03855896	1.77
96.95127869	1.36
98.9042511	0.30
102.0678024	0.04
107.3106461	0.12
109.0360565	2.30
110.9070358	0.65
113.1001511	0.36
117.0641479	0.07
118.9964523	0.48
119.9863892	0.04
121.0354462	1.20
123.0254517	3.42
124.8290253	0.34
127.0465927	0.72
128.9364319	0.27
130.9384308	0.10
132.8117065	0.70
134.8961487	1.59
135.8792725	0.16
137.0020599	1.49
139.0476074	2.62
141.0845337	0.80
143.117157	0.67
147.1012573	0.67
149.1189575	0.60
150.8364258	0.64
153.0713501	1.50
154.9672852	0.70
156.9892883	0.58
158.9280548	0.25
161.0057983	1.01
163.1207581	0.39
165.1335907	0.51
166.9530334	0.28
169.0057983	1.50
169.9892883	0.18
171.1014557	0.96
173.2001648	0.03
175.239502	0.66
177.1925049	0.26
178.2914429	0.07
179.1580353	0.82
181.2446594	0.45
183.0261536	1.91
185.1472015	1.15
187.4161987	0.14
189.1303864	0.17
191.0334473	0.30
192.5011444	0.04
193.203537	0.94
195.1582489	1.94
197.0768433	3.55
199.1646118	0.90
201.134552	0.84
203.2283325	2.00
204.4677734	0.06
205.1942749	0.32
207.1707764	0.16
207.8205566	0.11
209.2132568	0.72
211.0524292	1.63
211.9921875	0.11
213.1706543	0.33
215.079895	0.27
216.8748169	0.25
218.379425	0.12
219.1565857	0.58
219.9289856	0.05
221.3134155	4.05
223.1789246	1.17
224.1315918	0.15
225.2492981	0.85
227.169281	0.82
233.2402344	2.14
234.3948059	0.88
237.2637329	5.94
238.5802307	1.76
239.2141113	19.88
241.267395	0.43
243.1889038	1.46
244.1502686	0.28
251.1325684	1.71
253.1296997	0.87
255.1791992	2.52
256.4704285	0.65
257.1155396	1.98
261.2008057	3.28
262.2555237	0.65
269.2783203	0.76
273.4825134	0.07
279.2279053	100.00
280.2453308	2.77
281.0822754	0.42
284.8722534	0.15
287.7005005	0.17
297.3137207	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	470.1516
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9353638	1.02
308.2269592	0.15
341.2014160	100.00
452.3528137	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.128
Annotation	Tyrosyl-Threonine
Peak:m/z	Relative Intensity
82.9742508	0.04
83.9815216	1.34
84.9208069	0.04
88.9721146	0.10
95.0483780	0.26
97.0766067	0.08
100.9888611	0.25
101.9661789	0.15
107.0468597	0.01
109.0952148	0.22
113.0469284	0.02
113.9966583	0.08
115.0565567	0.06
119.0770416	0.03
120.9174042	0.10
122.0442886	0.11
122.9900742	0.07
130.0250854	31.70
132.9140320	0.32
135.1817932	0.20
137.0504608	87.47
142.0707092	0.15
143.2879639	0.06
146.9667053	100.00
149.0507507	0.14
151.1358337	0.04
151.7992554	0.05
153.2151184	0.74
153.9456787	1.01
157.0175476	0.07
158.8657227	0.35
163.0821228	0.13
165.0315247	0.16
167.0145569	0.06
168.9134369	0.07
176.9347076	0.11
183.2499542	0.02
185.1038513	0.02
193.2600708	0.01
194.0345764	0.01
195.3707886	0.02
197.3657227	0.02
199.1870422	0.07
209.7140503	0.16
212.9437561	0.04
217.2902832	0.01
219.6358337	0.12
222.9670105	0.06
227.0151978	0.02
237.1178894	0.57
238.2446594	0.03
239.0341797	0.03
241.1772766	0.09
241.8825684	0.34
247.3619690	0.75
262.6624756	0.13
265.2482300	1.42
266.0412292	2.68
267.0352478	0.08
270.8633423	0.12
274.0466919	0.18
293.9016724	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	209.1531
Annotation	(5R,6S)-5,6-Epoxy-7-megastigmen-9-one
Peak:m/z	Relative Intensity
66.9254150	0.07
69.0369263	0.06
70.9975510	0.26
78.7472534	0.02
81.0094299	0.70
82.9115372	6.64
84.8727112	0.17
86.9367523	0.06
89.1053162	0.06
91.0426788	0.05
92.9451294	1.02
94.9895782	0.78
96.9280090	0.97
98.9852295	0.23
104.9482727	0.28
107.0506744	2.69
109.0438538	7.05
109.9454041	0.05
110.7517548	1.48
113.0684662	0.06
115.0659485	0.03
119.0596619	0.13
119.9888000	0.03
121.0223541	1.73
123.0156403	3.11
125.0303192	2.02
125.9350739	0.03
127.0366058	0.19
128.9324799	0.05
131.0832214	0.06
132.9938507	3.96
134.9768372	0.71
137.0713806	0.63
139.0805359	0.17
141.1292725	0.05
144.9827423	0.02
147.0836639	0.32
149.1359100	2.99
150.9698029	86.53
151.8054352	0.05
153.0627289	1.28
154.8802032	0.25
161.0403900	0.04
163.0526886	0.79
164.9757538	0.31
167.0613251	100.00
167.9953613	0.33
171.1780396	0.08
173.1128845	3.79
177.1182556	0.01
181.0393524	0.61
186.0225067	0.06
188.9651642	0.05
191.0500336	5.45
192.1409302	0.18
193.3445587	0.03
209.1386871	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.7882996	0.63
106.990509	1.54
109.0176086	1.84
111.1039505	0.55
114.8082199	0.09
117.030632	0.63
118.9326096	0.32
120.9637909	3.94
123.1249084	1.53
131.0599976	0.31
133.8081665	0.22
135.0058289	4.19
136.9013367	0.55
139.2512512	0.52
141.0772705	0.25
143.0677795	1.24
145.1399384	0.17
146.9779053	2.07
147.9788513	0.07
149.1342163	2.69
149.9476929	0.17
151.0721436	0.98
152.8488159	0.07
155.1187592	0.82
156.9884949	0.90
159.0838928	0.84
161.0852356	1.46
163.0457764	0.59
164.9545441	0.66
167.1266327	0.51
169.1192627	0.91
170.8697052	0.72
173.1440887	1.31
175.0556641	1.52
177.1371613	0.58
179.09552	0.11
181.1154938	0.13
182.0943146	0.19
183.1024017	1.05
184.9878387	0.09
187.1906891	1.78
189.1412354	0.96
191.3094788	0.39
193.0986786	0.43
196.0866699	0.37
197.0662994	1.12
199.3013306	0.09
200.1382141	0.11
201.3056335	0.45
203.0409088	0.33
205.1256714	1.67
207.2526398	0.10
209.3375549	0.40
211.1312561	1.03
213.0770874	0.66
215.0324707	0.26
217.052002	0.43
220.7147827	0.19
221.3190002	0.43
223.102478	0.64
227.1622925	1.21
229.0783386	0.32
230.9841003	0.60
233.1885986	0.13
235.3846436	0.37
237.1690369	0.73
239.153717	0.56
241.2052612	0.32
243.138092	0.54
245.1194458	1.65
247.3096619	6.14
247.9899597	0.07
249.1222839	0.23
250.8770142	0.08
252.1466064	0.44
253.3077393	0.49
253.9689331	0.17
255.164093	0.35
257.1028442	0.36
259.0793762	0.91
263.2287598	0.35
265.0227356	0.23
266.7944031	0.96
269.2831421	0.30
271.1365356	0.30
277.1453552	0.28
279.3746338	0.27
281.3334351	0.49
283.3835449	0.68
285.2262573	0.19
287.1027222	0.45
288.1209106	0.11
289.1867981	0.12
292.3206177	0.34
294.1541748	0.13
295.2817078	0.62
297.2350464	0.55
299.428009	0.73
300.1204834	0.38
303.3192139	0.26
305.2637634	3.53
310.1251831	0.32
313.2359314	1.22
323.2315674	100.00
324.2005005	0.92
324.9989624	0.06
331.788208	0.19
332.8881836	0.46
340.4892883	0.64
341.2794495	1.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	175.1185
Annotation	L-Arginine
Peak:m/z	Relative Intensity
59.9606361	53.30
69.9400940	5.97
72.0430756	1.48
84.0563049	0.95
84.8368988	0.03
97.1074219	0.23
97.9596252	0.19
111.9515686	4.14
113.3688049	0.91
114.0450745	4.21
115.2682953	4.12
116.0229950	51.39
130.0523071	38.76
131.0719910	0.35
133.1540680	0.39
139.9426575	3.12
140.9406281	0.14
143.0360870	0.08
157.0108032	77.87
158.0000000	100.00
166.1560516	0.63
175.0485840	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.072
Annotation	4-(beta-D-glucosyloxy)-3-hydroxy-benzoic acid
Peak:m/z	Relative Intensity
93.00430298	0.33
101.0828934	0.60
106.9504166	0.28
107.9248352	5.47
108.9419403	6.32
112.9779053	1.20
120.9643097	1.97
122.8133316	1.03
133.016571	0.68
135.0170288	0.79
138.8823853	0.37
151.8870544	37.45
153.0270081	100.00
161.0558929	0.33
163.0959625	8.74
164.9702454	15.84
167.0528259	0.61
174.8339539	0.20
177.0837402	2.73
179.0724182	1.00
181.0533752	3.31
184.2454681	0.57
190.8264618	1.30
193.0203247	1.95
194.9814606	2.46
204.9704895	0.39
207.0925293	2.71
219.2165527	2.10
222.927887	2.98
225.1231079	6.03
231.2268982	0.34
240.1383057	0.20
243.1493835	0.51
250.9485779	0.72
253.2579956	0.26
255.3771362	0.72
267.1206665	1.73
268.9644165	6.41
272.0183105	0.28
277.114502	0.28
279.1110229	3.38
281.2855835	1.33
283.177124	1.21
296.9380188	1.31
297.9717407	0.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	305.1697
Annotation	Unknow
Peak:m/z	Relative Intensity
95.7486420	0.03
96.8104858	0.02
98.1194763	0.18
107.7878113	0.04
112.0220413	0.05
116.2324371	0.03
117.0653076	0.03
117.8811340	0.10
124.9554977	8.52
130.0313873	0.63
131.0027161	0.19
138.6294250	0.06
139.9736633	0.12
140.8901825	0.08
143.0283813	100.00
147.7992249	0.02
148.8904114	0.02
152.8713684	0.03
155.0119934	0.06
158.1383362	0.02
158.9375153	0.11
165.0753784	0.09
172.1159363	0.04
174.8054199	0.03
176.0536804	0.36
177.2877197	0.02
182.9215851	0.02
184.3560333	0.02
185.1557007	0.14
189.0914154	0.10
191.0318451	0.06
196.0923462	0.05
196.9209442	0.03
205.2897949	0.02
207.0863342	0.04
208.0599976	0.03
208.8641052	0.08
210.3018799	0.03
214.3173828	0.03
215.1949768	0.02
215.9217224	0.08
217.1339722	0.07
218.9129028	0.08
221.0786133	0.04
225.1035461	0.02
227.2782898	0.07
230.1610107	0.08
230.8789673	0.03
237.1047058	0.24
239.0197449	0.21
240.9196472	0.18
242.1982422	0.03
245.0775757	0.02
251.3103027	0.31
257.0248108	0.01
258.4129944	0.18
259.3328247	1.16
261.1968689	0.10
263.2683105	0.18
269.2255859	0.14
273.0523682	0.08
274.0253296	0.16
277.0220642	0.07
287.1816711	1.18
288.0004578	0.23
311.8118286	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	646.8557
Annotation	Unknow
Peak:m/z	Relative Intensity
199.1902924	0.06
214.7577209	0.02
245.0568085	0.18
273.1193542	0.37
275.9937744	0.02
289.0335693	5.32
291.2512817	0.02
304.9971924	1.13
386.9671631	0.11
402.9235840	12.78
407.3542480	0.06
415.8641357	0.04
418.8856812	9.23
419.5104370	0.02
449.4203491	0.03
467.0187988	0.04
501.3018188	0.07
501.9388428	0.14
502.9876709	0.01
516.8523560	3.29
531.0282593	0.31
532.7874756	100.00
533.5422363	0.42
561.8402710	0.09
572.9215698	0.15
573.6123047	0.06
574.9315796	0.04
592.1248779	0.12
600.7253418	0.75
602.7943726	0.15
613.7078247	0.07
614.6071167	0.03
618.6516724	0.03
619.6643677	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	435.958
Annotation	Unknow
Peak:m/z	Relative Intensity
127.8966827	0.16
141.5676575	0.14
155.8656158	1.10
170.0967255	0.62
173.6130371	0.13
183.9232788	2.24
198.2793427	0.20
199.9887390	22.67
200.9071960	1.50
209.6861725	0.16
211.0519104	0.17
214.0552673	3.77
215.4931793	0.23
218.0800781	0.51
226.9742432	0.12
228.0475159	0.39
243.9889526	8.63
245.8276672	0.76
254.9078979	0.74
256.1969299	0.10
257.9931641	72.99
259.2203369	0.17
262.0831299	1.04
267.9628601	0.33
269.8833618	0.22
272.2688599	0.16
284.0509338	1.26
285.8637085	3.51
287.9494324	8.35
289.5135498	2.63
290.1850281	0.67
299.6447754	0.15
301.8978577	47.74
304.0031738	3.21
306.7420654	0.28
307.4450684	0.05
314.0969238	1.74
318.0316772	0.16
323.4542847	0.13
325.3037109	0.30
327.9345093	4.09
329.5894165	6.50
330.2206421	0.83
332.0158691	100.00
339.1666260	0.22
345.8324890	23.34
348.1567383	0.75
357.1642151	0.67
357.9603577	0.61
369.2418213	0.15
373.7689819	3.65
390.0417175	0.25
391.9290466	30.71
392.5896301	0.07
399.9814453	2.64
401.1433105	0.31
402.5240173	0.32
417.9879761	78.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	632.5806
Annotation	Unknow
Peak:m/z	Relative Intensity
195.0461884	0.03
197.0817261	0.06
208.9192810	0.14
213.1570435	0.07
226.8239746	0.52
245.1152039	0.07
256.1381836	0.27
259.2518921	0.29
263.2484741	0.06
272.4710693	0.36
274.3704529	0.26
276.2484741	0.22
277.0584717	0.04
299.6587219	0.17
303.5513916	0.23
307.0875244	0.07
311.4591675	0.27
312.3002625	0.20
314.2064209	0.07
316.9148560	0.04
320.6923828	3.23
321.8258667	0.24
322.6591187	0.28
325.1228027	0.21
330.4378052	0.16
333.1011353	0.50
338.4422607	0.17
342.0911865	1.18
342.7469482	0.40
343.3591309	0.09
346.1837158	0.03
347.2844238	0.14
348.1185913	0.08
351.2546387	0.21
356.2995605	10.29
357.2875366	0.18
358.7492065	0.22
360.2232056	0.10
361.2457275	0.05
362.6583252	0.03
366.8978882	0.08
367.5286865	0.11
373.6895752	0.08
386.2930298	0.03
387.0895996	0.10
388.3740845	0.08
391.2216797	0.16
401.2276001	0.09
402.4770508	0.08
404.9323120	0.55
405.6622925	0.14
410.3928223	0.11
414.1610107	0.38
415.4119263	0.16
424.3221436	0.18
427.4910278	0.03
429.8009033	0.07
433.7643433	0.14
444.7148438	0.07
458.4788208	0.22
459.5069580	0.08
460.8662109	0.22
465.9103394	0.11
467.0437622	0.24
469.5472412	1.12
470.4259033	0.21
471.2109375	0.13
472.4238281	0.11
476.2080688	0.26
485.5709229	0.33
488.9767456	0.30
494.4660645	0.10
495.6459351	0.17
500.5799561	0.05
502.4711304	0.02
507.3952026	0.03
508.2158813	0.27
508.9633179	0.15
510.4198608	0.06
512.8317261	0.07
515.3449707	0.29
517.7690430	0.26
521.2360229	0.09
522.5211792	0.07
523.1253052	0.04
523.7482910	0.09
524.8746338	0.77
525.7012329	0.41
531.3923950	0.43
532.1679077	0.11
533.6303101	0.28
534.3003540	0.22
535.0636597	0.17
539.5133057	0.06
543.3164673	7.69
544.4478149	2.51
545.4859009	0.03
547.1660767	0.05
549.2767944	0.19
551.0122681	0.05
551.8472290	0.13
552.5169678	0.28
559.2785645	0.10
560.6202393	0.10
566.2786255	0.52
567.1340942	0.13
569.3941650	0.58
570.6090698	0.08
572.0344849	0.41
573.3509521	0.15
574.1981812	0.94
579.4811401	0.08
583.3699341	0.45
584.5371704	1.04
586.0354614	1.54
588.0468140	0.20
594.5519409	0.99
595.4705200	0.44
596.5055542	0.06
597.5715942	0.14
598.4242554	0.54
600.4661255	14.00
601.1212769	7.47
602.1986694	0.23
603.0469971	0.10
603.6926880	0.08
604.4205933	0.04
606.5956421	100.00
607.7124023	2.49
608.9281616	0.82
609.8385620	0.65
610.9295654	0.51
612.7192383	0.21
613.7758179	0.24
614.4892578	0.18
615.5029907	0.10
616.6585083	0.26
617.3218994	0.71
619.7246094	0.60
621.4855347	0.29
623.9153442	0.60
626.8585205	0.12
640.4669800	0.37
642.1874390	0.18
645.8698120	0.22
650.9889526	0.20
651.9513550	0.32
653.4304810	0.05
654.8225708	0.19
655.5111694	0.03
656.7014771	2.02
662.5365601	3.67
663.1932983	1.40
666.9084473	0.76
667.7136841	0.41
668.4052124	0.37
691.3554688	0.03
692.2963867	0.13
693.3043823	0.57
694.4199829	0.21
695.5169067	0.25
703.6126099	0.09
705.9465332	0.34
711.4171143	28.57
712.4592896	9.89
713.4337769	1.73
714.2399902	0.47
715.3695068	0.17
717.5298462	0.06
722.9453735	0.52
724.0944214	0.39
728.4937744	0.16
731.5659180	2.10
732.5905762	0.21
734.4717407	0.49
740.4290161	0.14
742.6713867	0.07
746.1098022	0.28
748.5753174	0.24
752.5266113	1.99
753.3872070	0.70
754.3759155	0.21
756.9613647	0.14
759.6296997	0.19
760.6008911	0.31
767.5249634	0.11
770.3767700	0.08
771.4271240	0.30
772.5592651	0.13
773.4835815	0.31
775.2888794	0.15
776.2462769	0.14
777.3402100	0.46
778.4349976	0.42
784.6465454	0.14
785.4146729	0.07
787.3020020	0.49
787.9203491	0.23
789.4315186	0.06
794.3713989	0.37
795.0669556	0.98
795.8796997	2.44
796.5578003	1.91
799.4235840	0.17
800.6758423	1.27
801.6377563	0.09
811.9845581	0.24
817.0832520	0.09
818.9545898	0.05
823.4024658	0.08
825.7212524	0.68
827.3077393	0.11
835.4458008	0.07
848.8594360	0.08
851.4487305	0.36
852.9982910	0.20
855.2158203	0.28
856.6648560	0.41
857.8311157	0.11
859.4982300	0.08
860.7016602	1.85
861.3583374	0.14
862.1652222	0.06
868.4369507	0.07
876.7916870	0.35
877.8242188	0.29
879.1381836	0.23
881.4262085	0.07
882.4497681	1.17
891.2505493	0.77
892.1630859	0.21
900.2294922	13.06
901.1496582	2.37
909.2323608	45.37
910.1928101	7.83
912.0061035	0.39
913.3527832	0.17
934.4914551	0.03
936.8753052	0.08
937.9604492	0.11
938.6164551	0.28
943.6311646	0.07
944.7092285	0.18
946.1416016	0.14
950.7719116	0.25
971.7639160	0.12
976.3659058	0.18
983.9006348	0.44
985.3179321	0.62
988.5850220	1.24
990.0539551	0.27
993.4174805	0.97
994.0418091	0.06
1014.5032350	0.25
1027.9680180	0.06
1033.6336670	0.26
1042.3120120	0.10
1060.3010250	0.46
1067.1844480	0.13
1067.8123780	0.09
1081.5140380	0.05
1092.8228760	0.08
1139.7760010	0.05
1219.8602290	0.08
1323.6939700	0.05
1332.5130620	0.06
1428.7769780	0.11
1486.8031010	0.11
1544.8645020	0.05
1827.1649170	0.03
1873.0186770	0.06
1917.0777590	0.05
1980.0593260	0.50
1989.4656980	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	695.4655
Annotation	PA(18:2(9Z,12Z)/18:2(9Z,12Z))
Peak:m/z	Relative Intensity
225.1784363	2.00
265.0206909	0.83
277.3987122	1.79
279.2264404	100.00
281.5004272	1.53
312.2227478	3.34
381.4942017	6.08
387.7356567	1.22
415.229248	92.67
417.0731201	4.52
433.4031982	36.16
439.00177	2.35
500.3123779	0.83
504.6074829	1.22
547.5848999	0.83
549.1946411	5.34
583.2979126	1.77
601.4664917	1.44
621.5344849	1.14
622.5584106	5.61
630.9845581	19.87
634.3605347	1.14
645.7901611	1.06
649.510437	2.18
661.3599243	1.77
669.1442871	0.99
677.6260986	7.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
113.1364059	0.24
151.0180664	0.62
154.9482727	0.69
159.0155029	0.33
162.6994324	0.30
170.9801331	0.20
185.2359619	0.39
187.2020416	1.72
191.1205902	0.73
195.0415649	0.47
199.3383789	1.00
201.0952301	0.41
203.1611786	0.32
207.2597809	0.66
213.3404236	0.49
215.1324768	1.65
227.3143921	1.08
229.158783	0.63
240.987793	0.72
243.2973938	1.73
245.0641479	0.71
255.1989441	0.54
257.3687439	0.69
263.2350464	0.42
267.5080872	0.62
269.1433105	0.33
271.2352905	1.39
272.1694031	0.56
273.1207275	1.64
281.0023804	0.73
283.2081299	0.76
285.3600159	1.81
286.8450317	0.49
293.3912354	0.34
295.4107971	0.34
297.2850952	1.14
299.3480835	2.94
301.1341858	1.00
306.8128662	0.39
308.7116089	0.51
311.2361755	3.01
313.2157593	2.74
314.1851807	0.45
315.3623657	1.28
321.1442871	1.15
323.4280701	9.24
325.2137146	1.23
328.2033081	0.36
329.3765259	0.51
337.0622559	0.53
339.2496948	100.00
341.3216248	14.68
342.2825012	0.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	849.4089
Annotation	Unknow
Peak:m/z	Relative Intensity
258.1128845	0.08
259.1514282	0.26
283.1354370	0.23
283.9301758	0.08
285.1965332	0.22
300.1936340	0.91
311.2861938	0.29
312.2685547	0.60
330.2250977	0.43
338.2882080	0.31
340.1455078	0.12
344.8856506	0.18
348.0790405	0.09
357.2584229	0.06
358.1696777	0.08
365.7848206	0.48
371.1421814	0.74
375.3908081	0.33
378.2406616	0.35
383.3818665	1.07
384.0982666	0.37
393.3648682	0.53
402.2667847	0.24
411.4829102	0.45
426.9993286	0.13
428.6185303	0.30
429.2741089	1.81
430.5405884	0.17
436.1483765	0.19
441.2133789	0.23
454.2294922	0.50
455.4517822	0.12
460.4348755	0.60
467.9426270	0.10
476.5836792	0.17
482.1565552	0.24
491.2547607	0.56
492.2951660	0.19
493.5945435	0.09
494.7528687	0.17
495.5003052	0.22
500.1301270	1.94
501.1292725	0.11
502.5404663	0.09
504.0149536	0.06
512.1872559	0.78
519.3421631	0.20
525.8715210	0.28
530.1016235	0.98
531.1799316	0.07
540.1239014	0.29
541.2824097	0.06
553.4495850	0.10
558.3980103	0.06
584.5167236	0.55
585.3247070	0.19
593.1506958	0.20
601.3125610	0.68
601.9323120	0.05
611.2880249	0.62
620.3383179	1.80
621.0079346	0.26
621.6597900	0.08
625.1212158	0.28
629.3251343	7.48
630.2626343	2.00
631.1447144	0.09
672.8148804	0.29
687.1487427	0.29
688.0206299	0.24
690.8565063	0.57
713.2165527	0.25
726.2735596	0.20
731.2379761	0.38
732.5236206	0.41
733.6036377	0.42
734.5769653	0.13
736.3535767	0.17
738.2245483	0.72
739.0952759	0.73
742.6060181	0.59
744.2238159	0.12
749.2542725	2.19
750.3846436	1.07
751.6359863	0.51
753.6704712	0.38
759.8348389	0.33
761.9116211	0.28
767.4390869	0.11
768.8811035	0.92
770.2374878	0.31
772.6798706	0.27
783.3728027	0.39
784.0614624	0.20
785.0801392	0.21
790.8673096	1.15
793.4146118	0.26
795.5879517	1.42
796.2869873	0.05
797.4096069	0.04
799.7706909	25.77
800.7163086	1.61
801.5907593	0.58
804.0067139	0.23
805.4773560	0.21
806.9077148	0.24
808.1799927	0.34
809.4866943	0.56
810.6801758	0.11
816.6847534	0.91
818.7663574	1.18
820.3947144	1.49
821.3571167	0.74
825.4663086	1.46
826.7236938	0.56
836.1687622	0.35
849.3493652	0.37
859.4746094	0.22
861.0028687	0.13
871.2319946	0.68
872.0664062	0.22
873.8274536	0.42
874.5192261	0.23
876.9801025	0.38
880.8229370	1.64
882.8614502	5.34
883.4841919	2.76
884.2286987	0.08
884.9537964	0.25
890.8377075	1.30
891.6040649	0.46
902.4232788	0.28
904.8535767	0.51
908.8093262	0.30
910.9738770	0.18
911.7335815	1.20
917.0869141	5.89
917.9643555	1.50
918.9028320	0.34
919.6991577	0.39
923.1818848	100.00
924.3925781	1.46
926.0270996	1.32
926.8159790	1.13
927.6499634	0.24
928.7116699	0.08
930.3796387	1.17
938.3349609	0.09
941.5661011	0.06
947.8666992	0.96
953.7033691	0.49
960.0173340	7.93
960.6409302	5.56
961.2636108	0.26
961.9743042	0.11
966.2482300	21.57
967.0090332	1.19
969.0573730	0.44
974.0944214	0.86
974.7808228	0.10
976.4858398	0.55
977.4147949	0.51
978.3242798	0.45
979.9666138	0.75
983.8727417	2.75
984.9499512	0.11
989.7886353	45.12
990.7077026	1.92
991.9028320	0.22
992.8987427	0.11
993.8711548	0.08
1000.0490110	0.44
1009.9340210	1.07
1010.6416630	0.21
1012.0018920	0.54
1013.5471190	0.23
1016.7075200	0.09
1020.7022090	0.14
1026.8853760	7.15
1027.7769780	0.17
1028.7304690	0.15
1032.4508060	15.04
1033.0957030	26.50
1034.0290530	2.27
1034.9750980	0.86
1037.3046880	0.16
1040.6723630	0.86
1041.3762210	0.29
1043.8305660	0.25
1044.6688230	0.15
1051.8020020	0.23
1053.7695310	0.76
1054.4252930	0.58
1058.6168210	0.12
1060.4652100	1.12
1061.3503420	0.30
1065.8726810	20.19
1066.8697510	2.76
1067.6618650	0.62
1068.5949710	0.09
1074.3327640	0.29
1074.9709470	0.51
1078.2994380	0.94
1083.7204590	12.61
1084.6492920	1.00
1085.5637210	0.30
1089.9478760	0.31
1092.3094480	0.16
1107.6237790	0.13
1108.9219970	0.44
1110.3430180	0.48
1112.4962160	0.14
1130.0617680	0.11
1137.6147460	0.22
1139.1054690	1.47
1139.7332760	0.37
1152.0239260	0.14
1174.6868900	1.87
1180.3559570	0.08
1181.5396730	0.26
1188.8424070	0.46
1202.8518070	0.32
1219.6383060	0.26
1222.2608640	0.08
1224.7193600	0.50
1225.9904790	0.07
1238.7149660	2.29
1239.5947270	0.44
1242.0366210	0.48
1243.8759770	0.33
1244.7827150	0.06
1246.2989500	0.20
1264.8630370	0.11
1287.9722900	1.07
1289.2216800	0.59
1301.4510500	0.27
1309.3040770	0.35
1310.2025150	0.53
1311.0975340	0.29
1312.1048580	0.15
1323.4044190	0.34
1324.3448490	0.34
1366.8552250	0.19
1372.5369870	0.09
1375.6440430	0.33
1384.4249270	0.19
1389.6970210	0.18
1411.6181640	0.12
1417.4165040	0.46
1425.9133300	0.10
1453.8533940	0.11
1474.8579100	0.17
1484.9863280	0.11
1635.7847900	0.12
1671.6101070	0.13
1724.8996580	0.64
1763.6193850	0.17
1839.3680420	0.08
1899.9232180	7.07
1932.8659670	0.35
1946.9796140	0.08
1949.5926510	0.07
1955.4426270	0.12
1982.1324460	2.60
1983.4182130	0.12
1987.4753420	0.27
1992.6309810	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.1523
Annotation	Unknow
Peak:m/z	Relative Intensity
166.9599762	0.70
180.2322083	0.05
186.6819153	0.14
199.0083923	26.78
247.8850098	0.21
259.2088623	0.16
273.1973267	0.13
275.1729126	0.13
309.9414673	0.25
311.1452026	0.09
313.1003418	0.06
340.9449463	0.10
346.4466553	0.23
347.9823608	0.19
350.8923340	0.06
361.2969971	0.12
364.8805542	0.05
365.8817139	0.08
379.1301270	0.24
380.1559448	0.12
380.8931274	0.12
404.1149902	100.00
406.8125000	0.53
409.1663818	0.24
437.9406738	0.11
452.2272949	0.20
478.9111938	0.28
495.0327759	0.12
503.1906738	6.38
504.0172729	0.06
505.3409424	0.44
523.3400879	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	285.22
Annotation	Vitexifolin C
Peak:m/z	Relative Intensity
76.8896637	0.16
81.00785065	0.42
82.99000549	0.67
86.96136475	0.06
91.02817535	0.72
92.98324585	0.50
95.01722717	3.64
96.97447205	2.30
100.8930206	0.95
104.9447784	0.06
107.0597382	0.50
109.024086	1.95
111.0426941	1.42
114.8187332	1.06
118.8235626	0.36
121.02285	0.22
123.0889282	2.29
123.9603043	0.34
125.0160751	0.64
126.995285	0.09
129.0017395	3.67
131.1351013	0.33
132.7765503	0.21
135.2239075	1.09
137.0817871	2.35
138.040863	0.29
140.9064941	0.92
141.9446716	0.12
143.0065918	8.10
144.0196228	0.25
145.1717529	0.39
146.9630737	2.35
148.70755	0.64
151.0691376	1.20
152.0025024	0.15
153.1135406	0.22
154.9834595	3.40
156.9523468	4.05
158.8416138	0.14
159.9214478	0.23
160.9659729	0.83
163.5464172	0.44
164.4779053	0.63
165.0952759	0.04
166.0961151	0.10
167.0617828	0.14
168.013504	0.27
169.1181641	2.13
171.0719299	8.77
172.9604797	1.10
178.9891968	0.79
183.005249	1.59
185.0220947	4.39
187.0851746	1.76
188.9023743	1.35
191.0109863	0.76
193.0286713	0.11
195.0772705	0.56
197.1036682	2.65
197.8947754	0.39
199.0733337	0.09
201.047699	0.58
203.0340881	0.23
205.1489868	0.16
206.4538574	0.37
207.1653442	8.09
208.3177795	0.59
211.1144409	1.14
213.8761597	0.41
215.1135254	0.11
217.2946777	0.35
219.1833801	0.77
221.1203308	0.13
222.948822	0.59
224.0800781	0.40
225.2075806	2.31
226.2936707	0.22
229.0950012	0.86
236.0482483	0.14
239.0530701	2.31
240.3626709	0.15
241.7335205	0.81
243.1547546	5.19
244.1074524	0.46
249.2695923	4.84
253.2984009	0.12
254.3583679	0.18
257.2304688	1.25
267.2133179	100.00
268.0991821	0.55
268.9391174	0.16
275.9091797	0.96
276.9029846	0.10
285.2301636	0.63
298.7585754	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	273.96
Annotation	Unknow
Peak:m/z	Relative Intensity
114.9361115	4.55
115.9490204	3.50
131.0098267	0.15
132.2925415	0.10
158.9605713	100.00
159.9108887	95.17
160.8965759	0.07
199.0822754	0.28
199.9949036	2.96
201.8411560	0.16
217.4890137	0.23
218.1177368	1.56
229.8235779	41.15
230.5039978	0.09
237.2725220	0.14
246.1406555	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
98.8261871	0.19
100.9521484	7.63
106.9105530	0.13
112.9901123	19.70
115.0478439	0.31
116.7847748	0.44
118.9027100	13.26
119.7300339	0.35
125.0644760	4.19
127.7765656	0.59
130.9595947	7.04
143.0614166	17.13
148.9718781	5.75
161.0117493	20.13
174.2685852	0.09
178.9068909	100.00
179.5489502	0.31
203.0543365	0.16
209.0126343	0.15
221.0219116	1.24
250.9171143	0.25
253.2503662	0.18
254.9214783	0.24
280.7731934	1.60
295.1314087	1.06
323.3942566	2.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	574.2112
Annotation	Unknow
Peak:m/z	Relative Intensity
177.1786194	0.05
221.9984741	0.05
225.2009430	0.10
230.7670441	0.11
232.1522827	0.28
233.2278442	0.12
248.2169952	0.05
250.0272522	10.05
265.0645447	1.06
282.3359680	0.66
283.0403442	3.35
296.2592773	0.02
328.2085571	0.10
330.1151123	0.12
339.9080200	0.07
348.9800415	0.14
363.1656494	0.06
365.0581055	0.06
380.8405151	0.03
382.1498413	0.27
394.0250244	0.19
395.4046631	0.07
396.8921509	0.25
398.4161377	0.09
400.1528931	0.03
403.7249146	0.08
406.1475220	0.09
410.3873901	0.05
412.1253662	100.00
412.7608032	0.28
414.0670776	0.06
427.3409424	0.03
428.1682739	0.15
436.8527222	0.03
440.2841797	0.19
442.2299805	0.11
443.2111816	0.07
445.1098022	0.43
457.5610962	0.04
458.3614502	0.05
459.1914062	0.07
478.2937622	0.06
481.4355469	0.08
485.9654541	0.03
489.1735840	0.20
491.7377319	0.14
493.3635864	0.05
497.0765991	0.12
499.1774292	0.27
502.1812134	0.06
517.0510254	0.13
519.4846802	0.05
520.2230225	0.10
529.8529663	0.08
531.2565308	0.16
535.2609253	0.35
536.9823608	0.05
539.4488525	0.03
541.3439331	0.04
547.9242554	0.22
549.5916748	0.30
553.1661377	0.12
553.9558105	0.07
555.8453979	0.36
556.4532471	0.99
557.5792236	0.07
562.0128174	0.28
564.5355225	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	147.11
Annotation	Lysine
Peak:m/z	Relative Intensity
72.9458313	0.02
83.9705353	2.07
93.0367126	0.02
100.9942169	0.32
101.9530945	0.03
111.0249634	0.02
114.8892365	0.01
128.9860840	9.88
129.9529724	100.00
130.8770752	0.04
137.8991241	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.83
Annotation	Unknow
Peak:m/z	Relative Intensity
111.0231857	0.03
130.1032867	0.01
137.0189819	0.02
146.9023743	0.04
182.9928589	0.06
193.0142670	0.01
194.7974548	0.02
196.9248962	0.61
212.7855530	100.00
213.5918884	0.00
236.8900452	0.04
262.4521179	0.03
263.0914307	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
102.9966431	0.19
105.0324631	0.24
106.9125366	0.47
109.1014252	1.40
111.1723328	1.14
120.9431763	2.50
122.934845	1.70
129.1551056	0.64
133.0804596	0.25
135.0552368	4.45
135.8659668	0.30
137.2489929	1.22
143.0261383	0.74
145.147522	0.52
146.9591064	1.38
149.0696716	1.33
150.1122437	0.30
151.1167297	1.98
152.8963623	0.27
154.0480957	0.09
155.1334229	0.14
156.8203125	0.42
161.0648499	3.01
163.0148926	0.53
165.07724	2.13
169.0061188	0.92
171.1259613	0.45
172.9065552	0.88
175.2260132	0.98
179.0927124	0.19
181.0892029	0.77
182.9386902	0.52
185.3284454	0.30
186.9880066	1.69
188.9575806	1.10
191.105896	0.92
193.2292786	0.30
196.1002808	0.26
197.0215454	1.38
199.144516	0.60
200.9671631	0.46
203.1302795	0.79
205.3218079	0.39
209.2745056	0.63
210.986145	2.02
213.1434326	0.94
215.3917542	0.13
217.0694885	0.69
219.1445923	0.27
223.0318604	1.94
227.1671448	0.55
228.4070435	0.21
229.1677551	0.89
230.8777161	0.71
233.2200317	0.07
235.0934448	0.51
239.019928	0.29
241.081543	0.44
243.0990601	0.50
245.1456604	0.67
246.1514587	0.81
247.2254944	5.98
249.0780029	0.82
250.4490356	1.09
251.2313232	0.46
252.1349487	0.10
253.1746826	1.21
255.2354126	0.45
257.7493896	0.29
259.003479	0.36
267.2809448	1.77
268.52771	0.23
271.1835938	0.77
276.9852295	0.65
279.2138062	0.55
280.1091309	0.35
281.2637634	0.91
285.4371338	0.77
287.1330261	0.17
289.291687	0.18
295.2614441	2.22
297.2136536	0.30
299.0604248	1.91
300.2356567	2.09
305.1109009	3.27
307.1470337	0.38
311.0491943	0.57
313.2251587	0.70
317.7827759	0.48
323.2409668	100.00
324.2296448	3.23
324.9680481	1.54
326.0089111	0.37
327.0700073	0.25
340.3083801	0.72
341.245575	1.45
354.9857788	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
109.1152191	0.29
126.8477859	0.82
171.2478027	1.44
173.0971069	1.28
183.3899994	0.22
185.1345825	1.59
187.3082581	1.04
189.2307129	1.01
190.3182068	0.35
193.0800934	0.38
199.190506	2.68
201.1206665	1.64
202.9690552	0.74
213.2935791	0.20
214.1011963	0.60
215.0498962	2.33
216.1737671	0.23
222.8102112	0.35
227.3786011	1.68
229.1795654	0.59
230.9697266	0.50
241.4877625	0.22
243.1547546	1.41
245.3246765	0.17
255.1397705	1.98
257.1725464	3.62
259.010498	2.07
263.3484497	3.74
265.6134644	0.17
269.2507324	1.81
271.2512207	3.57
272.2276611	0.51
273.1127319	0.53
279.1989136	0.22
281.1651917	0.64
283.2698364	1.76
285.1582031	1.57
287.251709	0.83
295.4195557	0.40
297.2366028	4.45
299.3760376	6.21
300.2870483	0.17
309.3944092	0.58
313.1504517	2.93
315.1828003	3.78
315.8017578	0.21
321.3733826	2.28
323.4358521	5.56
325.0810852	0.64
329.1112061	1.37
339.2575073	100.00
340.2373047	1.19
341.2478943	13.46
359.2269897	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	242.0341
Annotation	Unknow
Peak:m/z	Relative Intensity
83.9584732	0.05
86.9705505	0.52
88.0623169	0.10
99.9885864	0.05
101.9582367	0.07
109.0306091	0.22
109.8939362	0.06
111.0677643	0.27
113.9077606	0.32
122.1701508	0.08
123.4519958	0.25
128.3477478	0.25
138.8688965	0.18
141.9878387	0.20
145.0692596	0.12
151.1469879	0.20
155.0007172	0.22
172.2132263	0.06
178.1483612	0.11
181.9968109	0.07
183.0017853	0.20
185.3182678	0.05
186.1361542	0.18
193.4275513	0.06
196.0110626	0.59
198.9045715	0.23
200.9478607	100.00
204.9076233	0.12
206.2093658	0.85
213.9629669	3.16
215.0440674	0.29
218.1299896	0.81
218.9121857	0.66
220.2462463	0.76
221.5615997	0.63
224.0941772	2.50
225.1523132	0.28
230.4074249	0.44
231.2066040	0.10
232.8332367	0.15
235.7553101	0.61
236.4417725	0.06
253.7556000	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	637.1499
Annotation	Unknow
Peak:m/z	Relative Intensity
295.0318604	100.00
315.9157410	0.07
345.4290161	0.13
385.1489868	0.36
424.2714844	0.06
444.4591064	0.08
445.3005981	0.08
461.0837402	0.05
462.8002319	0.05
470.1570435	0.59
506.0573120	0.33
507.1293335	0.11
508.0974731	0.10
509.9854126	0.13
516.4566650	0.13
539.3911133	0.09
562.6192017	0.15
590.7209473	0.11
619.1821899	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2416
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
84.67514038	0.21
86.11066437	0.08
92.9693985	0.09
95.12898254	1.57
97.03045654	1.51
98.85084534	0.12
105.0060959	0.75
106.8651123	0.12
108.9732056	0.96
110.9465179	0.58
113.194664	0.21
115.8334808	0.41
117.122345	0.16
118.8844528	0.61
120.8528442	0.83
121.8586578	0.13
122.8970642	2.46
124.990242	0.68
126.9269714	1.12
129.0877533	0.48
130.8847656	0.23
134.1334229	0.11
135.0580139	2.66
136.0134888	0.10
137.0194702	1.45
139.0263367	4.36
140.9819641	0.49
143.1105957	1.45
145.0164795	0.41
146.1876831	0.27
147.0835876	0.61
149.0987091	0.61
151.0825806	0.08
153.0060425	0.81
154.9646606	0.64
156.9138947	0.57
159.1115875	0.76
163.0116272	1.13
167.077774	0.88
169.0391846	1.07
170.4960327	0.18
171.1987915	0.31
173.982193	0.23
174.7793579	0.38
177.1798401	0.69
179.1100159	1.81
181.2761993	0.58
183.052475	2.86
184.5359955	0.43
185.1957703	0.83
189.20047	0.70
191.2725525	0.49
193.0591431	0.31
195.0921478	1.34
197.0365906	5.22
199.1396179	0.51
201.1372681	0.95
203.1392212	1.47
207.250946	0.43
208.2037964	0.20
209.1256104	2.20
211.1148987	0.87
212.415863	0.18
213.2095032	0.96
215.3426208	0.86
217.1573181	0.48
219.2684937	2.62
220.4190063	0.28
221.2489929	2.59
223.1966248	1.40
225.1868286	1.84
227.2458801	0.54
228.9786377	0.07
233.1195374	1.28
234.065033	0.15
235.3061523	0.24
237.2832642	4.88
238.1776123	0.42
239.2131348	9.68
241.1219482	0.43
243.2084656	3.03
247.5578308	0.24
249.1242065	0.14
249.9693604	0.40
251.1072998	1.91
253.1321716	1.39
255.2583008	1.48
255.9372559	0.23
257.0065308	0.76
261.2364807	3.96
267.4034424	0.19
269.0031128	0.75
269.6414185	0.73
277.0358887	0.11
279.2385254	100.00
280.3346558	0.12
281.016571	0.34
287.884552	1.56
288.8093872	0.11
297.2003784	0.37
297.8735657	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	alpha-D-Galactosyl-(1->3)-1D-myo-inositol
Peak:m/z	Relative Intensity
97.01249695	0.57
100.9013672	12.34
103.1569366	1.54
106.9435654	0.73
113.002594	23.26
115.0274658	0.41
118.869751	28.64
124.8942719	4.14
130.907196	10.23
143.0281677	29.02
148.938446	2.52
160.8479919	19.32
176.126236	0.73
179.0538177	100.00
190.7903595	1.15
195.1417236	0.61
220.8471985	1.88
222.9945679	0.41
226.1756897	0.83
236.9273071	0.70
253.1008606	0.51
254.0791626	1.08
254.9362793	1.37
256.736145	0.61
261.059021	1.18
268.8605957	0.32
273.0602722	0.45
277.1631775	1.23
280.3856201	1.61
281.1784668	4.03
294.9482422	11.32
296.4083252	0.81
305.4012451	0.25
306.9368286	0.64
310.225769	0.55
321.9811096	0.55
323.1491394	1.72
326.1375427	1.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
119.0349426	0.15
142.9007568	0.35
153.1094055	0.48
154.8708191	0.33
157.2071686	0.86
159.1447144	0.55
167.0912781	0.24
171.3071594	0.33
173.0454254	2.63
181.278595	0.46
182.9965363	0.60
185.2561951	0.95
187.0544281	1.93
199.2306824	1.00
201.0545349	3.40
203.1500549	0.17
210.8036041	0.52
213.2675781	3.09
215.2677612	2.41
217.0718689	0.59
225.171814	0.88
227.1827698	2.96
229.0339661	2.86
231.0632935	0.79
234.3614807	0.57
236.5394592	0.30
241.4071655	0.39
243.2814636	4.28
245.3627625	1.94
253.0575562	0.46
255.1522217	1.39
257.0278931	5.18
257.6449585	0.54
259.210144	2.46
261.5602112	0.60
263.3574219	1.44
265.3869629	0.35
269.352478	2.25
271.1355896	4.33
273.3251343	1.03
281.4254761	0.24
285.3301086	8.02
287.244751	0.81
289.1419067	0.29
295.3725586	0.26
297.3599243	4.47
299.2611694	6.17
301.1694031	0.24
309.0839233	0.33
311.3417664	2.52
312.7546387	1.45
313.4127808	0.48
315.2295532	3.71
321.3378296	2.55
323.3964233	8.46
325.2044373	0.74
327.8255005	1.38
329.2915039	0.85
337.3379211	0.39
339.2433472	100.00
339.9211121	0.20
341.291626	25.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	589.07
Annotation	Unknow
Peak:m/z	Relative Intensity
171.0738678	0.02
174.0037231	0.04
174.9339600	0.17
177.0138855	0.06
181.2406006	0.08
185.4767914	0.02
186.9343109	0.64
189.8230591	0.06
199.0175171	0.90
200.9985657	0.14
203.1444550	0.15
204.6976318	0.08
208.9170227	0.03
211.1391754	0.12
213.0693665	0.23
214.6728973	0.03
215.5001221	0.05
216.3676147	0.09
217.0462036	0.33
219.0070953	0.04
223.2981720	0.06
224.9086914	0.30
227.0236664	0.13
228.9628296	0.16
230.1389313	0.17
231.2704315	0.10
232.2180328	0.06
234.0076141	0.06
235.0172729	0.93
237.0273132	0.04
241.2254944	0.02
244.1105804	0.30
245.0336304	0.31
246.4162292	0.31
247.1687622	0.15
249.0314941	0.05
250.1141052	0.05
250.9986877	0.04
253.1325073	0.11
254.9382629	0.04
257.1832275	0.21
258.1101685	0.17
258.8889160	0.20
260.7292175	0.18
263.1351929	0.07
264.8177185	0.46
267.0988464	0.14
267.7978821	0.06
269.0759888	0.04
270.9290771	0.27
272.2174377	0.03
274.9731445	0.37
276.9572754	13.01
277.5880737	0.02
279.1703491	0.03
281.0064392	0.14
282.5729980	0.17
284.2084351	0.13
284.8954773	0.06
287.2907104	0.05
289.0355225	1.54
290.0783386	0.02
293.0707397	0.13
295.0791016	1.26
296.9302979	0.03
298.0683594	6.70
299.1304321	0.02
300.8567810	0.21
303.0807800	1.52
305.0556641	0.60
306.9764404	26.05
308.4000244	0.03
310.8967896	0.11
313.2212524	0.76
314.1511230	0.07
319.0316467	3.83
320.0241089	0.04
320.9262695	0.39
322.0709229	0.03
323.8626099	0.03
324.9071655	0.29
326.2594604	0.04
328.3145752	0.05
329.0999146	0.09
331.0230713	0.46
335.1678467	0.15
336.8996582	8.23
337.5222168	0.04
343.0797119	0.74
343.8828735	0.13
346.9249268	0.88
348.8494873	0.91
351.3880005	0.24
352.1654663	0.20
352.9725342	0.52
355.1403809	0.34
357.0007324	0.04
357.7873535	0.10
359.1351318	0.03
360.8672485	0.77
362.0123291	0.02
364.1318970	0.08
365.0474243	0.28
366.9277344	27.00
367.8979492	0.20
370.5758667	0.10
373.0852661	2.95
374.3567505	0.12
375.1432495	0.02
377.1432495	0.07
378.9952393	0.58
382.1365356	0.20
382.9301758	0.34
385.2576904	0.14
386.4060669	0.03
387.2843628	0.03
388.7922974	0.16
390.9923096	13.24
391.5991821	0.09
392.2980347	0.08
394.0733643	0.05
395.5760498	0.16
396.9807129	24.36
397.6027832	0.12
398.4730835	0.03
399.2374268	0.11
402.3220215	0.29
405.2396240	0.08
407.0935669	0.08
409.0416260	64.21
415.3236694	0.14
416.3621826	0.19
417.3984375	0.05
419.4462891	0.14
420.3788452	0.02
422.2974243	0.09
423.1370850	0.06
425.7371826	0.63
427.0274048	100.00
428.1421509	0.11
434.2081299	0.03
438.0164185	1.73
439.1071777	0.55
441.5435791	0.28
442.2733154	0.44
443.2977295	0.07
446.8035889	0.18
455.2362671	0.13
456.3759155	0.08
456.9815674	0.09
459.5298462	0.50
460.1800537	3.39
468.7667847	0.51
472.4041748	0.22
473.2468872	0.28
474.4863892	0.21
476.2178345	0.12
476.9260254	0.06
481.2293701	0.10
484.1121216	0.10
485.1550293	0.04
490.8540649	0.12
492.4500122	0.17
496.2783203	0.09
497.2821045	0.10
499.0226440	1.59
500.5214844	0.16
504.4934692	0.07
509.2950439	0.64
511.0159302	0.29
514.1106567	1.21
516.5133057	0.15
517.6557007	0.11
519.1028442	0.16
522.1812134	0.11
529.3088989	0.22
537.9158325	0.07
540.2026367	0.34
542.9942017	0.05
543.9459839	0.62
545.1309204	2.52
550.7357788	0.30
552.9230347	0.83
553.5924683	0.01
555.9848022	0.18
557.1787720	0.19
562.1137085	0.55
563.0375366	0.03
564.4180298	0.30
565.6166382	0.24
567.8801880	0.60
570.9758911	11.84
572.2376099	0.64
576.8224487	2.50
577.6472168	1.47
578.3449097	0.12
578.9833984	0.20
579.8721313	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	588.0593
Annotation	Unknow
Peak:m/z	Relative Intensity
172.1580811	0.08
175.4396973	0.06
183.2422791	0.08
186.2864075	0.17
189.9023438	0.39
192.9784393	0.13
195.8132935	0.28
210.9122009	0.26
216.1158447	0.42
217.7125549	0.10
219.0877533	0.08
225.9647217	0.10
230.1900330	0.10
233.0170288	0.14
233.9768372	0.14
245.3276978	0.28
257.9564209	0.18
259.0223694	0.07
259.9615479	0.37
262.0576172	0.09
275.0902100	0.44
276.1832581	1.32
283.8576355	0.13
293.9653931	0.34
297.9273071	0.18
301.8737183	0.90
303.3987427	0.06
305.0817261	1.51
305.9874268	5.24
309.2458496	0.24
309.9319458	0.36
311.0973206	0.08
313.2168274	0.45
316.9493408	0.16
317.9118042	0.52
319.7984009	0.16
322.1083984	0.08
326.2999268	0.10
334.8272095	0.39
335.8831787	0.54
341.0020752	0.08
346.1411133	0.44
347.0825806	0.06
352.7244263	0.28
353.8493652	0.15
360.1561890	0.56
363.9632568	3.69
364.9082031	0.92
365.6286621	1.61
366.2603149	2.45
372.4024048	0.08
374.1830444	0.21
378.1110840	0.07
379.8931274	0.35
382.0214844	21.66
390.0288086	2.56
394.9451904	2.45
396.0127563	5.33
398.0999756	0.87
407.1962280	2.97
408.1160278	8.62
409.2426758	0.28
412.2486572	0.37
413.4200439	0.40
414.0219727	0.06
425.8115234	39.30
426.5002441	0.13
427.2284546	0.10
439.3396606	0.42
441.2079468	0.16
442.5817871	0.06
450.2017822	0.06
458.9494629	1.01
460.2619019	0.90
466.8993530	0.17
469.1786499	0.08
472.4691772	0.81
476.1132812	0.72
482.1481934	0.13
485.3289185	0.09
489.2827148	0.19
490.0374146	0.09
491.9191284	0.06
498.3245239	0.06
506.2681274	0.24
507.4166870	0.14
512.8717041	0.21
520.6082764	0.43
526.2163696	0.06
536.6109009	0.28
541.9734497	0.29
544.0930786	100.00
548.7988281	0.51
549.6429443	0.64
551.0891113	0.49
552.1692505	0.31
553.7655640	0.08
567.0896606	0.87
568.1684570	2.45
569.7827148	5.46
570.6269531	1.90
572.6660156	0.86
573.5351562	1.75
576.2697144	8.62
577.0935669	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.1571
Annotation	Unknow
Peak:m/z	Relative Intensity
135.0515137	1.30
141.0047150	0.11
143.0346527	0.70
145.0825195	2.60
147.0115967	1.44
151.2606506	0.26
153.2416840	0.39
154.0436707	0.15
158.9943848	1.65
160.9942322	0.41
163.0148926	0.67
166.2308655	0.16
168.9233398	0.38
169.8854675	0.19
171.3172150	0.06
173.0723877	12.21
174.8812561	0.11
179.1234741	0.39
182.9533691	0.19
187.0053406	9.48
187.6096802	0.08
188.6698608	0.58
189.3197327	0.71
191.0172577	3.05
197.1093445	0.77
205.0668945	26.02
205.7917023	0.26
207.0459442	15.17
207.6723328	0.09
215.1186371	17.85
228.3630981	0.47
233.1197510	50.58
237.1608276	0.13
240.9367676	0.32
243.9915314	0.14
245.2609558	0.20
247.1408386	0.23
249.1546326	0.11
251.0351562	100.00
251.8773499	0.50
263.2967834	0.27
265.2510071	0.26
266.8547058	0.22
268.1567383	0.10
269.0698853	0.78
270.1994019	0.30
273.2835999	0.29
273.8985901	0.04
276.1875305	0.30
283.2375488	1.17
290.1157532	0.33
293.2994690	0.66
308.3963318	0.19
311.0583496	0.64
312.0396729	0.08
318.2810059	0.27
318.9558411	0.09
321.8865051	0.10
326.4128723	0.09
337.0202026	4.62
343.0604248	0.33
345.0108948	0.48
351.1521301	0.13
354.8115845	2.17
356.1967773	0.64
356.8646851	0.15
358.4265747	0.34
365.2429810	0.22
368.8686523	0.25
371.4541016	0.56
372.3049927	2.45
386.2106628	0.07
388.3126221	0.24
389.8968201	0.49
390.4993896	0.28
412.6281433	0.13
415.1243896	0.32
416.1631165	0.26
422.3052673	0.07
430.4316711	0.25
432.0411072	7.05
433.2755127	0.33
435.7668152	0.17
436.4984436	1.13
448.4267578	0.37
450.2824097	0.45
452.8131409	0.70
455.0944519	0.06
458.1220093	1.51
459.3872681	3.03
463.2494812	0.85
467.2890015	0.37
489.5260620	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
84.95703888	0.11
88.79004669	0.09
90.97428894	0.75
92.83869934	0.11
94.84844971	0.92
96.93204498	1.54
98.97197723	0.70
100.877327	0.41
102.8861008	0.12
107.0025482	0.25
109.0738831	0.76
111.0125809	0.63
113.2219849	0.52
115.0522156	0.11
116.8037262	0.08
118.9891739	0.18
121.0775146	0.97
122.9656601	1.58
125.0051117	0.39
132.9579468	1.02
135.1771545	0.95
137.0918427	0.64
138.0004578	0.14
139.04599	8.46
141.0556946	0.22
143.1077881	0.49
144.7618103	0.38
147.106308	0.34
148.9893188	0.75
151.0693054	0.57
153.104126	1.68
156.9646606	0.89
159.2282104	0.09
161.0453339	0.26
163.0927429	0.40
165.0695801	0.39
165.8154907	0.10
167.2538757	0.11
168.913559	1.13
170.3255615	0.05
170.9960632	0.32
172.4477997	0.21
174.9740601	0.35
176.0763245	0.06
177.1976166	0.09
179.0656738	0.81
183.1950378	1.08
185.0810699	0.74
189.1189728	0.24
193.1525879	0.34
195.2096252	0.31
196.997818	5.89
199.1877136	1.19
199.9148254	0.16
201.2153015	0.16
203.2386475	2.27
205.4787292	0.11
207.2532349	0.32
209.2046814	0.80
211.0855408	1.13
213.2981567	0.94
215.4486389	0.17
216.2719421	0.13
217.2704163	0.04
219.2077942	0.55
221.2181091	3.82
222.6338501	0.18
223.284729	0.62
225.0917969	0.96
226.2474365	0.07
227.2322998	0.18
228.8459473	0.12
233.2172852	0.42
235.1879883	0.18
237.293457	1.39
239.1159668	12.28
239.7305603	0.18
241.1401367	0.81
243.3267212	0.94
247.4412231	0.06
250.0609741	0.13
251.2516785	0.87
252.0139771	0.08
253.2614136	1.00
254.3401794	0.15
255.2046814	1.27
255.8740234	0.20
257.0488892	0.52
261.1902161	2.66
261.9023743	0.07
263.0727539	0.15
269.2094116	0.51
273.9019165	0.20
277.4767456	0.09
279.2350464	100.00
280.2383423	0.40
281.2416687	0.64
298.6427307	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1073.051
Annotation	Unknow
Peak:m/z	Relative Intensity
353.1563110	0.08
373.3902588	0.04
441.2689209	0.08
456.5446167	0.02
516.6244507	0.08
526.6268311	0.11
535.4733276	0.03
553.4406738	0.10
554.6319580	0.34
559.6746826	0.02
571.4067993	0.09
572.3930664	0.05
595.4155273	0.07
666.6849365	0.07
674.4560547	0.09
682.3940430	1.36
683.5526733	1.94
684.7081299	0.27
691.9901123	0.14
693.1005249	0.23
700.4615479	0.05
710.8051758	0.07
727.5521240	0.10
736.7036743	0.08
755.5867310	0.11
763.3207397	0.06
765.5522461	0.05
773.0423584	0.08
778.9932861	0.12
793.5020752	0.14
800.3308105	0.06
801.6323242	0.10
802.7087402	0.15
824.3721924	0.17
842.2385254	0.27
857.6939697	0.32
863.0070801	0.27
866.6311035	0.07
867.4743652	0.13
870.7592773	0.10
871.3781738	0.04
881.2199707	0.04
881.9273682	0.02
882.6236572	0.21
883.6135254	0.28
884.5070801	0.06
885.1170654	0.05
893.6491699	0.57
895.3493652	0.35
900.6757812	0.34
901.6107178	0.38
902.5512695	0.33
908.0086670	0.71
925.9703369	0.04
927.2058105	0.51
928.7098389	0.20
929.4586182	0.12
933.3549805	0.04
934.9278564	0.53
936.0563965	2.43
937.1173096	0.43
937.8908691	0.35
943.0878906	0.04
944.4638672	0.16
945.1741943	0.32
947.4804688	0.34
948.4765625	0.08
949.1607666	0.69
949.8062744	0.11
951.6660156	0.07
956.6912842	1.39
957.9361572	2.67
958.6011963	1.03
960.7999268	0.18
965.4265137	0.72
966.1938477	0.09
969.5023193	0.19
970.1789551	0.18
976.4135742	0.02
978.5552979	3.14
979.7608643	0.27
982.6881104	0.19
986.7475586	2.24
987.6489258	3.06
988.4672852	0.04
992.1433105	0.41
993.7686768	0.14
995.7192383	0.13
999.8089600	0.55
1000.5208740	3.11
1001.2263180	0.76
1004.4738770	0.05
1007.5883790	0.13
1009.2246090	2.25
1010.0289310	1.28
1012.0510250	1.14
1012.7663570	0.20
1018.1596680	0.12
1021.2352290	10.53
1022.1683350	0.70
1024.3078610	0.03
1027.8032230	0.11
1029.9910890	19.60
1030.6228030	8.49
1031.4418950	0.14
1033.9304200	1.19
1034.5637210	0.17
1035.8977050	0.04
1036.6391600	0.05
1043.1169430	29.09
1044.1372070	0.50
1046.0783690	0.02
1047.1689450	0.13
1052.1353760	100.00
1053.1008300	1.41
1054.0273440	0.14
1055.9785160	2.84
1056.7016600	0.96
1057.4082030	0.04
1112.5939940	0.04
1116.5804440	0.07
1126.5137940	0.03
1134.1947020	0.12
1137.6407470	0.11
1141.5805660	0.04
1151.9782710	0.07
1158.7834470	0.06
1169.5319820	0.04
1197.5452880	0.05
1202.1802980	0.24
1203.5711670	0.27
1204.5607910	0.07
1219.7680660	0.16
1221.5311280	0.35
1228.4680180	0.05
1233.8792720	0.05
1234.7775880	0.04
1241.7282710	0.10
1244.1158450	0.05
1246.6335450	0.18
1247.5596920	0.32
1262.1120610	0.03
1263.6612550	0.07
1264.4183350	0.09
1265.6552730	0.16
1266.7669680	0.15
1270.6916500	0.06
1286.8337400	0.09
1303.0185550	0.04
1315.3721920	0.08
1330.6817630	0.10
1336.4715580	0.06
1339.5894780	0.10
1353.9333500	0.09
1358.6422120	0.28
1359.3638920	0.09
1383.7988280	0.09
1384.8316650	0.15
1386.4307860	0.09
1387.8114010	0.13
1401.9659420	0.08
1402.9747310	0.43
1403.6860350	0.66
1404.5614010	0.17
1410.8261720	0.12
1427.7403560	0.06
1429.4940190	0.06
1444.8363040	0.02
1445.5906980	0.09
1446.7133790	0.83
1447.6247560	0.43
1448.7225340	0.26
1480.4176030	0.02
1483.6866460	0.08
1488.5944820	0.08
1505.5600590	0.04
1509.7321780	0.06
1515.7409670	0.21
1533.0078120	0.18
1534.0037840	0.06
1534.9936520	0.08
1557.6788330	0.23
1558.5655520	0.05
1559.7031250	0.03
1576.5443120	0.28
1577.4842530	0.09
1578.8978270	0.16
1589.7407230	0.16
1591.8890380	0.09
1644.8442380	0.10
1645.6549070	0.07
1684.4759520	0.03
1688.5500490	0.41
1689.6618650	0.13
1690.4093020	0.03
1760.1075440	0.12
1762.7852780	0.03
1773.2218020	0.01
1792.4344480	0.10
1852.7860110	0.07
1859.0428470	0.03
1898.9074710	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	267.2678
Annotation	(9Z,12Z)-Octadeca-9,12-dien-1-ol
Peak:m/z	Relative Intensity
78.88275909	2.56
81.00999451	10.85
82.90559387	20.51
85.00249481	0.77
90.89939117	2.30
92.82106781	0.62
94.95291138	29.31
96.99249268	26.79
99.02986908	0.31
101.0108337	0.21
106.9846039	0.44
107.8133545	0.40
109.0395355	33.07
111.0016022	12.70
113.167511	0.46
117.1106567	0.27
121.0471802	1.52
123.0147095	17.06
124.9024048	3.52
126.9670105	2.39
135.0020752	0.21
137.0359802	14.04
138.9569092	2.85
147.0103302	0.61
149.1737213	0.45
150.9732666	14.07
152.7162628	7.34
154.9095154	2.69
157.2357788	0.87
161.2346649	1.27
162.7689209	0.66
165.082489	10.58
166.2367401	0.29
167.1230316	3.04
169.1633453	0.47
170.2874603	0.82
171.1339722	5.29
175.3387604	0.29
179.1374359	7.74
180.3146362	0.67
182.9650116	0.40
185.1251068	7.19
193.2286682	4.91
194.0057373	2.22
203.0431213	0.37
207.2129822	0.88
208.1830902	1.26
210.1657257	0.81
210.9127655	1.08
221.0608368	2.36
223.2595367	0.65
224.0402679	0.49
225.0864105	1.29
225.9478302	0.94
229.1077423	0.44
231.3197021	2.33
235.3810577	0.25
239.1577911	1.99
240.168335	1.30
240.9921265	0.44
249.2544708	100.00
250.2273102	0.96
251.148056	2.02
251.9696655	0.25
257.5293274	0.89
269.0988159	2.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	694.68
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9087830	0.83
239.8479919	0.18
250.9507751	0.30
275.0140991	0.12
290.7613220	7.31
319.6648560	0.14
358.6965942	2.85
374.5953979	2.44
375.2821655	0.16
399.3295898	0.09
402.9323120	0.23
411.1029663	0.06
413.7838135	0.12
442.6001587	16.21
443.2055664	0.33
454.8380737	0.33
458.0296021	1.31
458.6998291	16.04
474.0289307	0.41
474.8204346	0.07
484.2666016	0.15
486.7271118	0.77
490.9356689	0.33
496.3007202	0.11
499.1243896	0.16
504.8413086	0.29
515.2337036	0.11
518.9042358	0.46
519.8803711	0.34
521.1668701	0.73
524.2231445	0.95
526.6641235	100.00
528.5920410	4.60
539.0309448	0.29
540.4254761	0.12
542.5090942	75.69
543.2159424	0.77
550.8901978	0.31
558.2341919	2.71
559.0104980	0.07
564.7595215	0.57
573.9437256	0.16
585.9135132	0.14
588.5806274	27.37
596.2755737	0.13
600.4223633	0.29
607.7992554	1.79
609.3412476	3.03
609.9575806	16.51
610.6038208	71.79
611.4339600	0.17
619.9531250	0.51
622.8029175	0.08
625.5994873	0.41
626.5056152	1.67
627.1595459	0.14
630.6776733	1.01
634.3175049	1.23
634.9381104	2.19
640.9812012	0.18
647.6851196	4.22
648.6514282	8.67
664.7499390	0.06
671.7239380	0.13
677.1380005	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	319.19
Annotation	Testolate
Peak:m/z	Relative Intensity
109.0730591	0.19
118.9728241	0.33
130.8433228	0.53
138.8289185	0.39
167.1296387	0.34
174.7954407	0.26
179.0184631	0.91
182.4463959	0.29
205.0508423	1.08
207.2999573	1.36
208.8059998	0.56
217.3891907	0.51
221.6143188	1.33
223.0227356	0.20
236.283783	0.40
241.2052612	7.87
242.2058716	0.46
243.0421143	0.26
245.9991455	0.73
257.1661987	13.52
258.0361938	0.78
259.5777283	1.00
262.2993469	0.55
273.0779419	1.37
274.9271851	1.56
283.1088867	9.67
284.7453003	0.33
299.2520752	0.85
301.1779785	100.00
302.1358643	2.47
303.1244812	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	784.91
Annotation	Unknow
Peak:m/z	Relative Intensity
241.7685852	0.07
244.1888580	0.18
246.1892090	0.18
303.2293091	0.05
308.1071472	0.08
310.9365234	0.15
312.1114197	0.09
329.3040466	0.12
330.0415649	0.09
340.4609985	0.08
341.4107056	0.08
347.3043213	0.08
357.2061768	1.21
374.2769165	0.23
385.0440674	0.10
394.2824097	0.12
399.3843994	0.29
404.1126099	0.20
405.7775879	0.15
412.5676270	0.17
424.9337769	0.10
442.0641479	0.10
444.5243530	0.12
445.6411743	0.08
455.1845703	0.55
468.4221802	0.50
470.1617432	0.30
471.1817017	0.12
472.2559204	0.15
476.4518433	0.28
483.2225952	0.22
489.5010376	0.53
496.7565918	0.10
499.2520142	0.15
501.3218994	0.66
509.2847900	0.08
516.9107056	0.07
519.1975708	0.27
520.2009277	0.08
524.2742310	0.21
525.8834229	0.26
527.5537720	0.16
539.3767700	0.21
548.1195679	0.20
550.9821167	0.46
553.3739624	0.06
563.2967529	0.11
564.3838501	0.09
566.5525513	0.31
568.4421387	0.42
569.3427124	0.08
570.0507202	0.14
575.9373169	0.27
582.3214722	0.26
583.4701538	0.12
585.4176636	0.05
598.6029053	0.10
599.7070923	0.04
602.3989868	0.50
603.5083618	0.16
610.2810669	0.24
611.6359863	0.45
613.7957153	0.13
616.6858521	0.26
620.5871582	0.09
621.9152222	0.07
623.0187378	0.36
624.4347534	0.45
627.4135742	0.28
631.1304321	0.06
632.3216553	0.69
636.4418945	0.11
637.5301514	0.17
640.1141968	0.28
645.1209717	0.66
647.1098633	0.14
648.6968384	0.26
650.0977783	0.23
655.2438354	0.50
658.4046631	0.73
662.2295532	1.11
663.0748291	0.20
664.6492310	0.86
666.5275269	0.21
667.6215210	0.43
675.2036743	0.30
677.1869507	0.23
682.5748291	1.02
683.7443237	0.39
685.2526245	0.05
686.7941284	0.47
688.3898315	1.06
689.6529541	0.62
691.0982056	0.55
691.7906494	0.29
694.9440308	1.06
696.2702026	0.62
697.0147095	0.22
697.6455688	0.52
698.6663208	0.06
700.7460327	1.76
701.5496216	1.11
702.6549072	0.45
705.1140137	0.54
706.1580200	1.09
708.3258057	0.98
709.4790039	2.78
712.7955933	1.58
713.5081787	0.68
714.6734009	0.87
716.8092651	3.13
718.4989014	1.13
719.3682251	1.34
720.1700439	1.15
722.5481567	1.00
723.4468384	9.07
724.1970215	0.37
724.9028931	0.09
726.0255737	1.80
727.4780884	0.44
729.6500854	0.52
731.0754395	1.07
731.9935303	0.16
733.1095581	0.63
734.4808350	3.67
735.1682739	0.83
735.7752075	0.14
736.5610352	0.06
740.3305664	2.74
741.3462524	0.93
742.9601440	3.35
743.7775879	1.19
744.7164917	30.83
746.4036865	2.36
747.2643433	9.30
748.0838013	2.10
749.9015503	0.23
751.6798706	24.09
752.3767700	9.40
753.6583862	0.54
754.5603638	0.80
756.0702515	0.40
757.0562744	0.33
758.3687744	1.31
759.8648071	0.06
761.5164795	0.19
762.7235718	0.94
765.1632690	0.66
766.0648193	0.71
766.7431030	0.50
768.5969849	1.42
769.3408203	2.07
771.1140137	0.13
771.8770142	0.23
773.0085449	0.60
774.0318604	0.38
775.1296387	0.45
776.6552734	0.42
785.8538208	0.16
789.0372925	0.45
790.7214966	0.17
793.3865356	0.38
794.9914551	0.08
797.3065186	0.14
798.2984009	0.04
799.2055054	0.35
800.7553711	0.13
802.3878784	0.54
807.8714600	0.89
809.1524658	0.26
813.3732910	0.22
814.0322266	0.09
814.8735962	1.04
815.6983032	0.46
819.8130493	0.04
822.6915283	0.06
826.2046509	9.64
827.0736694	4.99
827.7980347	0.16
828.7164307	0.35
830.5225830	0.40
831.7808228	0.14
833.0024414	0.24
834.7083740	0.63
837.4321289	0.33
839.7986450	0.17
845.2661743	3.09
845.9810181	1.78
848.0388184	0.34
848.7337646	0.48
850.6547241	0.27
851.4058228	0.21
855.3223877	1.26
856.0546875	0.30
857.7883301	0.23
858.6928101	1.09
861.3699341	0.31
862.6354370	1.06
863.2986450	0.57
864.2504272	1.07
865.2382202	0.50
867.5648193	0.12
868.9357910	0.74
870.8316650	0.80
872.0830688	0.61
872.9219971	0.84
873.9797974	1.74
874.5906982	0.52
876.9760132	0.34
878.9093018	0.21
880.1419067	0.32
882.7332764	3.42
883.3543091	2.44
884.0731201	2.70
887.6784668	0.33
888.5695801	0.35
889.2922974	0.06
891.0813599	0.57
895.7207031	0.94
896.5754395	0.17
897.3639526	0.74
898.6002808	1.24
900.7053833	0.38
902.5761108	1.64
903.5791626	0.23
906.0578003	0.52
907.6035767	0.50
914.2914429	0.17
915.3707886	0.72
920.7693481	4.04
921.7112427	15.74
922.9750366	0.99
924.3703613	0.11
926.4723511	2.68
927.4360962	0.96
928.5750122	0.64
929.6586304	0.91
930.6331177	0.75
931.4270020	0.87
932.3231812	0.86
933.3285522	1.08
934.0498047	0.18
934.8190308	0.29
935.9094849	0.51
937.1765137	1.12
937.8354492	0.51
939.2798462	0.25
940.1002808	1.24
940.8142700	1.34
941.7521973	0.90
945.1964722	10.29
946.4835815	1.41
947.7746582	0.11
949.6303101	0.27
951.4694824	0.10
953.7754517	0.30
954.5620117	0.56
957.1083984	0.24
958.1425171	1.87
958.9819946	0.38
959.6889038	0.87
961.1083374	0.44
964.0490112	37.25
964.6741333	28.44
965.8247070	0.41
966.6327515	0.39
968.2441406	0.38
969.1372070	0.44
970.7422485	0.34
971.5698242	0.30
972.4079590	0.09
974.6183472	0.14
975.4643555	0.12
977.6396484	0.13
978.6289062	0.76
979.3432617	0.45
981.9984741	0.32
984.9385376	0.76
991.3366699	0.09
992.9721069	2.99
993.6496582	0.47
995.8297729	2.59
996.6984253	0.48
997.4417114	0.17
998.6193237	0.42
999.2225952	0.13
999.9265137	0.10
1001.3325200	8.66
1002.0768430	100.00
1003.9729610	1.80
1005.2617800	2.94
1006.2055050	0.11
1007.0242310	0.11
1007.6632690	0.38
1019.4833980	1.95
1020.4395140	2.24
1021.8073120	0.46
1031.1928710	0.50
1032.2221680	0.27
1033.6396480	0.41
1039.4333500	0.41
1040.5389400	0.35
1045.6562500	0.41
1053.2241210	0.22
1053.9829100	0.64
1055.4638670	0.52
1056.7052000	0.38
1058.8112790	0.07
1060.2358400	0.07
1061.8111570	0.74
1066.5690920	0.10
1069.5788570	0.16
1076.8239750	0.16
1078.3908690	0.07
1086.3264160	0.10
1089.4765620	0.25
1090.2825930	0.19
1095.9390870	0.06
1101.2171630	0.15
1110.9964600	0.48
1111.6608890	0.68
1112.6335450	0.23
1116.2963870	0.06
1117.8997800	0.58
1118.5825200	1.89
1119.3457030	0.59
1121.7089840	0.18
1123.7086180	0.25
1124.8529050	0.11
1127.4389650	0.25
1128.7128910	0.04
1132.5903320	2.28
1133.5662840	0.66
1134.8352050	0.61
1147.2666020	0.06
1149.9577640	0.05
1163.5101320	0.10
1164.7161870	0.16
1174.6588130	0.44
1179.6713870	0.09
1182.4237060	0.18
1183.8121340	0.25
1196.6384280	0.06
1197.7598880	0.13
1200.5810550	0.24
1207.9333500	0.21
1218.6552730	0.55
1220.8352050	0.34
1224.8162840	0.10
1242.5838620	0.16
1245.7004390	0.09
1260.7447510	0.30
1261.7037350	0.11
1262.6785890	0.06
1267.1910400	0.44
1268.6878660	0.14
1275.4510500	0.32
1306.3973390	0.09
1324.0363770	0.18
1339.5777590	0.23
1352.6484380	0.86
1353.6632080	0.26
1369.2437740	0.22
1388.1734620	0.05
1389.8021240	0.07
1421.7895510	0.24
1433.4367680	0.14
1436.3420410	0.11
1445.0817870	0.04
1452.9803470	0.14
1481.0670170	0.07
1517.7265620	0.32
1554.6881100	0.07
1558.9848630	0.19
1614.5832520	0.24
1615.7725830	0.13
1616.9022220	0.06
1650.6375730	0.54
1651.5959470	0.06
1669.8083500	0.11
1747.9470210	0.07
1751.0003660	0.04
1801.3229980	0.18
1820.2044680	0.10
1833.1705320	0.04
1837.0324710	0.13
1910.2146000	0.23
1941.6114500	0.39
1984.1734620	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	786.4012
Annotation	Unknow
Peak:m/z	Relative Intensity
227.2581177	0.78
234.3744507	0.03
245.0005493	0.06
270.0733337	0.11
283.3131714	0.07
295.2149353	0.09
327.1539917	0.28
349.3813477	0.11
353.3406982	0.03
355.4257812	0.07
394.1976318	0.20
399.0909424	0.04
415.6857300	0.05
426.3677368	0.08
438.3687134	1.91
439.3851318	0.78
440.0170898	0.06
447.7990112	0.04
451.4125366	0.12
453.9741211	0.20
463.4031982	0.22
464.4461670	0.25
465.3192749	0.17
471.4449463	0.04
476.8154297	0.13
482.4191895	0.10
493.2668457	0.10
495.2687378	0.35
519.2729492	0.12
526.3639526	0.25
527.4895020	0.46
532.4565430	0.11
542.9544067	0.08
551.3725586	0.30
553.4214478	3.91
554.3368530	3.51
555.4143677	0.25
558.4378662	0.44
564.8967896	0.32
567.1792603	0.21
570.0197754	0.40
579.4501343	0.09
581.3609009	0.09
582.3610229	0.08
583.6495972	0.13
584.2837524	0.27
585.4762573	0.31
589.7950439	0.19
592.5089722	0.24
593.8530884	2.68
594.5281372	1.70
607.4559937	0.67
610.3757935	0.17
612.5128784	0.05
623.3588257	0.30
625.5732422	0.99
626.5232544	0.36
629.3573608	0.42
630.1704102	0.69
631.5502930	0.06
633.7734985	0.09
635.6605225	0.31
641.0315552	0.07
642.5000000	2.11
643.3443604	0.29
644.2796631	0.37
650.9691772	0.20
654.0180664	0.09
657.4588013	0.03
658.2877808	0.26
663.5778809	2.03
664.5319214	2.03
668.6217041	0.11
670.0906372	0.21
671.0592651	0.39
672.1527710	1.00
673.0874634	5.33
674.0444946	0.18
675.2876587	1.24
676.0939941	2.72
676.9713135	0.81
678.1923218	0.58
679.6549072	0.47
682.9006958	0.29
684.8657837	61.82
685.6459351	14.68
686.4630737	0.37
689.0172729	0.15
694.5988159	0.26
698.4771729	0.34
699.5200806	0.14
701.0537720	0.30
703.0138550	0.46
704.0957031	0.58
705.1718750	0.97
705.9535522	0.27
706.7789917	0.16
707.4898682	0.32
708.1850586	0.28
711.3999634	0.19
713.3202515	7.84
714.0819702	3.44
719.3606567	4.62
720.0233765	2.03
720.6253052	0.21
721.5072632	0.04
728.3417969	2.56
729.1045532	1.30
733.4003296	0.14
737.8660278	0.42
739.3988647	0.11
741.1857300	0.63
742.1102905	0.10
743.1859741	0.72
743.8342896	0.13
745.6401978	0.37
746.8759155	0.67
747.5549927	1.00
750.0575562	0.36
754.1484985	21.12
755.0426636	2.04
756.0411377	1.48
756.9129639	1.49
759.9302368	3.87
760.6290894	1.73
761.7312622	0.06
763.1017456	100.00
764.1614990	5.91
764.8561401	0.50
765.5888672	0.12
769.0369873	66.86
770.0609741	3.53
772.0982666	21.81
773.2034912	1.17
777.9099121	16.63
778.6860352	0.51
779.2973633	0.13
817.5088501	0.10
829.5853882	0.13
861.5126343	0.05
872.6021118	0.10
873.4325562	0.36
874.7759399	0.13
878.4697876	0.31
879.3229370	0.10
890.7658691	0.16
891.7126465	0.04
898.7372437	0.55
908.5734253	0.10
909.5662231	0.31
912.2240601	0.15
913.5596313	0.09
927.7437134	0.51
966.7683105	0.26
970.3067017	0.08
971.3183594	0.14
972.7756958	0.52
973.6207886	0.12
974.5411987	0.05
979.5634155	0.09
982.2221680	0.14
983.1643066	0.07
984.6917114	0.43
990.2912598	0.12
990.9230347	0.17
993.4024048	0.13
999.6589355	0.13
1000.5723270	0.14
1001.3503420	0.05
1002.3987430	0.79
1003.4777220	0.11
1009.8397830	0.09
1019.9768070	0.97
1020.6804810	1.38
1021.4657590	0.29
1042.9865720	0.05
1068.6531980	0.42
1069.5457760	0.34
1072.5589600	0.06
1081.4547120	0.09
1090.4851070	0.05
1098.6801760	0.34
1099.5205080	0.11
1117.6967770	0.69
1118.4547120	0.23
1188.6390380	0.99
1199.6550290	0.32
1211.5798340	0.05
1227.3303220	0.09
1228.5993650	0.10
1246.4324950	0.27
1259.6070560	0.18
1285.8171390	0.26
1287.6113280	0.21
1312.7786870	0.04
1317.9108890	0.18
1327.5311280	0.12
1328.8109130	0.71
1329.5814210	0.20
1330.6545410	0.15
1340.6923830	0.44
1345.6715090	0.15
1346.5664060	0.60
1347.1831050	0.15
1348.0125730	0.17
1352.6950680	0.31
1353.5345460	0.07
1354.4818120	0.19
1367.2943120	0.11
1369.1242680	0.05
1369.8514400	0.16
1370.6331790	1.00
1371.8251950	0.12
1372.8651120	0.17
1388.5540770	0.07
1409.4493410	0.09
1410.9957280	0.54
1426.4084470	0.37
1427.6446530	6.18
1428.7490230	1.46
1429.5767820	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	568.0427
Annotation	Unknow
Peak:m/z	Relative Intensity
165.1306610	0.05
198.1925507	0.10
199.1845093	0.09
206.9496460	0.36
220.1403809	0.06
235.0385437	0.18
244.2594452	0.06
253.3559265	0.31
278.2339478	0.23
286.2671509	0.05
304.7998047	0.17
338.2329712	0.06
352.6848145	0.10
364.0885620	0.32
389.2150269	0.14
406.2971802	0.07
420.0817871	0.26
426.2280273	0.05
431.4272461	0.24
436.2104492	0.23
462.5033569	0.46
465.4765015	0.09
467.3989868	0.83
471.8692017	0.18
475.1412354	0.30
492.4293213	0.32
493.3326416	0.19
498.3956299	0.46
509.6740112	0.22
510.4929810	0.07
516.2697144	0.42
524.2205200	0.14
532.2780151	0.16
535.0109253	0.05
535.8647461	0.06
539.1305542	1.54
540.6001587	0.18
548.7729492	0.04
550.1595459	0.19
551.6206665	0.27
556.3355713	0.33
557.5337524	0.05
559.9067993	0.43
562.1082764	0.52
580.0260620	0.37
594.6186523	0.27
625.4016724	0.04
637.1112671	0.03
661.7926025	0.45
676.4098511	0.42
685.3012085	12.34
685.9374390	0.51
686.8047485	0.28
705.7846069	0.20
708.8550415	3.22
709.6121216	0.24
711.5137329	0.26
712.7241821	0.25
718.3182373	100.00
719.5228882	0.95
720.2636108	0.32
721.3843384	0.47
724.1018066	0.06
725.4513550	0.23
777.3679810	0.03
791.0139771	0.15
825.1292725	0.34
825.7710571	0.05
827.4498901	0.09
838.3847046	0.04
843.5083008	0.05
855.3329468	0.14
875.3853149	0.22
915.5198364	0.08
916.6943359	0.07
930.2875366	0.11
953.9998169	0.21
1027.1540530	0.52
1027.8154300	0.11
1039.6713870	0.13
1083.6397710	0.08
1134.8095700	0.18
1141.7764890	0.27
1354.5448000	0.26
1355.6676030	0.07
1515.6961670	0.17
1593.6959230	0.08
1670.1737060	0.04
1892.2174070	0.11
1941.1944580	0.51
1959.9862060	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.96
Annotation	Ribose-1-arsenate
Peak:m/z	Relative Intensity
115.0034485	4.69
125.1129150	0.03
131.0506287	0.39
158.9425354	100.00
159.9281616	0.07
172.8660736	0.04
182.2475891	0.03
198.9702148	2.54
201.0044250	0.05
216.9883423	0.93
227.1958313	0.08
228.9399109	28.38
229.8346252	0.02
244.9282837	0.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	867.1238
Annotation	Unknow
Peak:m/z	Relative Intensity
285.1563110	0.12
291.3321228	0.05
320.0350342	0.04
393.6497803	0.05
424.3091431	0.18
432.0639038	0.13
438.7208252	0.05
461.2846069	0.13
478.5911865	0.04
484.0738525	0.03
490.0319824	0.15
515.2568359	0.14
524.4299316	0.09
528.0490112	0.10
534.5432739	0.08
535.5447388	0.09
537.2909546	0.23
542.6448364	0.10
552.2402954	0.21
563.4543457	0.17
570.3471069	0.03
607.5352783	0.05
609.3893433	0.10
620.4626465	0.14
623.1000366	0.16
634.7222290	0.20
645.2230835	0.16
648.8198853	0.07
661.4240112	0.19
723.6260376	0.15
726.1188354	0.06
733.3777466	0.07
739.2362061	0.05
750.4148560	0.13
757.4334717	0.12
760.3053589	0.15
763.1229858	0.13
765.1398315	0.31
765.8890991	0.12
771.3862915	0.43
772.4448242	0.13
774.2560425	0.50
779.4682007	0.22
780.4978027	0.63
782.5291748	0.31
783.3748169	0.34
790.5484009	0.06
791.3228149	0.06
798.0512695	1.96
798.6777344	0.03
802.9916992	0.70
806.5018311	0.83
807.7916870	0.04
808.8696899	0.33
809.9237671	0.49
810.7332764	0.53
816.4069214	0.33
817.3475952	0.21
818.0423584	0.33
818.7015991	0.06
821.9149780	0.15
823.4620972	1.46
826.1227417	1.16
827.8310547	29.25
828.6210938	2.76
829.7375488	1.78
830.7867432	1.52
831.4694824	0.07
832.4205322	0.12
833.2841797	0.56
834.7450562	11.59
836.0080566	0.88
836.9047241	0.07
837.9242554	0.16
839.0772095	1.39
839.8110962	1.87
840.5913696	0.14
841.6830444	0.29
842.6488647	0.77
843.2562866	0.79
844.8285522	0.05
845.9920044	0.11
847.8238525	0.24
848.9823608	0.18
849.5933228	0.38
851.0519409	0.07
851.8739014	1.36
855.2256470	0.29
856.1952515	2.66
856.9714966	0.35
858.5366211	0.05
884.3228149	0.28
888.2148438	0.04
899.0336304	0.09
904.3746948	0.30
911.0361938	0.37
912.1103516	0.11
914.6087036	0.54
917.1481934	0.12
918.2660522	0.29
919.1960449	0.18
925.3134155	0.38
929.2454224	0.30
935.5000000	0.07
937.2407837	0.21
939.1977539	0.19
941.6406860	0.28
947.9545898	0.22
949.3417969	0.88
952.3945923	1.22
963.6051636	0.48
967.0167847	0.43
968.9672241	0.82
972.2148438	0.43
972.8820801	0.62
974.0657349	0.62
975.2189941	0.19
976.2865601	0.05
977.4408569	0.23
979.1514282	0.30
981.0457153	0.20
983.5499878	0.29
985.1253052	0.27
988.0581665	0.32
991.9336548	0.87
999.4594116	0.44
1000.2631840	0.47
1002.3427120	0.23
1005.8779300	0.96
1007.0841670	0.38
1007.9555660	0.18
1009.0665890	0.20
1011.2606810	0.33
1017.1480100	0.26
1019.2629390	0.20
1022.4394530	0.64
1026.1206050	0.51
1026.8676760	0.48
1032.5899660	0.13
1034.2570800	0.55
1035.5466310	0.63
1036.2169190	0.84
1037.2294920	0.67
1038.3929440	1.22
1039.2102050	0.60
1040.8031010	0.22
1042.4095460	0.52
1043.0556640	1.46
1044.2731930	3.30
1044.9809570	4.22
1045.7053220	0.51
1047.7984620	0.37
1048.6033940	0.74
1049.3454590	0.13
1050.3842770	0.46
1051.2348630	0.13
1052.2182620	0.12
1056.3448490	1.41
1057.1633300	0.46
1058.0114750	1.28
1059.3885500	0.41
1061.1126710	1.60
1062.1516110	1.57
1063.4840090	9.60
1064.1318360	4.50
1065.1850590	1.64
1065.9238280	1.07
1067.1131590	0.73
1067.9821780	0.46
1068.8398440	1.24
1069.8264160	0.43
1070.9427490	0.95
1074.1843260	1.04
1075.2879640	2.52
1075.9458010	0.11
1078.8085940	0.16
1079.7529300	2.43
1080.3776860	5.50
1081.2625730	1.55
1082.2204590	0.28
1083.7009280	0.65
1085.8576660	2.27
1086.6219480	0.45
1087.3858640	0.69
1088.3896480	0.98
1089.7199710	0.43
1091.2152100	0.43
1094.0671390	1.47
1095.4360350	0.92
1096.3315430	1.54
1097.6136470	0.79
1098.6594240	0.53
1099.9088130	0.72
1101.9832760	4.16
1102.7634280	2.36
1103.6320800	3.58
1104.6875000	1.15
1106.2207030	2.35
1107.0919190	1.84
1108.0546880	0.61
1112.1046140	14.00
1112.8852540	100.00
1114.3942870	2.47
1115.1044920	0.18
1115.9503170	0.36
1117.1522220	1.79
1118.4606930	7.52
1119.2878420	5.75
1120.2014160	0.06
1121.8090820	0.42
1123.3116460	5.96
1124.1865230	0.80
1129.0795900	0.21
1145.5568850	0.41
1146.9658200	0.26
1147.5783690	0.24
1155.3022460	0.11
1156.5623780	0.21
1158.6037600	0.17
1160.0671390	0.05
1170.4855960	0.24
1172.0155030	0.14
1182.5852050	0.17
1183.6997070	0.06
1191.0798340	0.16
1194.5561520	0.11
1198.7021480	0.10
1200.3591310	0.05
1213.3382570	0.15
1217.0561520	0.29
1226.7061770	0.10
1234.6816410	0.05
1238.5063480	0.23
1243.0732420	0.10
1243.8220210	0.05
1249.9733890	0.24
1251.3592530	0.08
1257.3719480	0.11
1262.6981200	0.41
1266.5809330	0.24
1267.2966310	0.14
1267.9029540	0.20
1269.9031980	0.28
1282.5902100	0.19
1286.6741940	0.10
1296.1551510	0.06
1299.5032960	0.06
1303.2938230	0.14
1308.7642820	0.23
1319.7934570	0.16
1325.5238040	0.19
1339.3481450	0.55
1347.4996340	0.81
1348.2789310	0.33
1348.9470210	0.46
1363.8826900	0.09
1366.2021480	0.33
1373.1468510	0.36
1377.7032470	0.10
1379.1295170	0.25
1394.1693120	0.04
1399.8305660	0.21
1404.1971440	0.04
1409.6827390	0.62
1426.7425540	0.13
1433.2766110	0.22
1438.6497800	0.32
1446.0059810	0.08
1447.5665280	0.06
1449.6342770	0.18
1450.7117920	0.05
1452.5321040	0.85
1453.5662840	0.43
1478.7281490	0.07
1483.6600340	0.11
1492.7684330	0.20
1508.0927730	0.11
1508.7987060	0.24
1523.1295170	0.04
1525.7041020	0.19
1527.1368410	0.98
1534.9720460	0.06
1537.0656740	0.20
1538.5457760	0.19
1543.0727540	0.14
1553.5361330	0.09
1559.7683110	0.33
1563.9697270	0.39
1575.7225340	0.14
1576.7196040	0.27
1587.3626710	0.08
1597.4842530	0.14
1611.2521970	0.13
1612.0626220	0.07
1616.7630620	0.30
1626.2745360	0.05
1645.6502690	0.06
1684.8055420	0.04
1710.3551030	0.14
1715.3620610	0.06
1749.3829350	0.06
1755.2916260	0.05
1772.1657710	0.08
1798.5490720	0.11
1845.7908940	0.03
1914.2102050	0.14
1921.2238770	0.18
1934.9449460	3.48
1940.0479740	0.14
1947.4621580	0.08
1951.8055420	0.04
1957.8547360	0.12
1970.5655520	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0026
Annotation	SC-58125
Peak:m/z	Relative Intensity
129.0773926	0.18
130.9813843	0.07
145.0207977	0.07
173.0140381	1.26
184.9421234	0.03
190.9854431	100.00
197.1658630	0.02
200.9061584	0.07
213.1056366	0.05
240.9647827	0.05
253.2385864	0.07
253.9503479	0.03
255.0246887	0.11
259.1127930	0.06
272.0037231	0.13
272.9377441	0.03
289.3674316	0.03
298.9126587	0.45
317.0612793	0.96
333.0968933	0.05
342.5953674	0.06
359.1941223	0.02
361.1526184	0.03
376.8988037	0.03
384.0595093	0.04
385.1246033	0.20
403.0945740	2.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.2594
Annotation	2-Hydroxyoctadecanoic acid
Peak:m/z	Relative Intensity
92.88169098	0.41
115.0337219	0.43
125.3777313	0.43
143.3722229	0.26
150.9367065	0.26
165.0381012	0.33
184.2131653	0.39
185.0870972	0.35
194.8446198	0.24
199.2630615	0.24
205.2127075	0.86
215.1154175	1.04
219.103241	0.28
225.3948975	4.38
227.162323	9.63
230.6420288	0.52
231.2659607	0.31
234.2048645	0.49
237.1951599	3.23
239.3389282	0.87
251.3060913	0.22
253.2611694	51.71
254.1610107	1.17
255.2783813	22.90
257.1102905	0.33
260.960144	0.30
261.8444214	0.73
263.3013	19.28
263.9451294	0.61
271.3886108	0.34
279.2160034	8.52
281.2485657	100.00
281.8911133	1.38
282.9993591	9.51
283.835022	0.74
299.3456421	0.60
302.3346863	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.2375641	0.08
106.9982834	1.17
109.1069641	2.62
117.0864563	0.26
118.9568939	0.58
121.0392075	4.61
123.0497284	1.78
127.0043335	0.06
129.0687561	0.39
131.1306763	0.42
133.118576	1.05
135.0534973	2.91
137.0119019	0.27
139.2052917	0.88
140.5121765	0.08
143.0719299	0.31
145.1456451	0.30
147.0244293	1.72
148.9954224	2.07
151.1029663	0.87
154.9977722	0.94
157.1080933	0.70
159.0043488	0.21
161.0641785	2.40
163.1145935	0.80
165.0698242	1.33
166.9701691	0.22
169.0033264	0.56
170.9141846	1.38
173.0558167	1.07
175.121582	0.54
176.0901642	0.44
177.1233826	0.21
179.05867	0.18
181.1350555	0.26
182.079361	0.11
183.1131439	0.74
185.1195068	0.72
187.1925354	1.02
189.1005859	0.54
191.3646851	1.07
192.9575043	1.25
195.1122284	0.21
196.2626038	0.25
197.0126648	0.08
199.1296539	0.99
201.1626892	0.40
203.0942078	0.16
204.9405518	0.11
209.0629272	0.34
211.1155701	1.07
213.1973877	0.36
215.2445374	0.13
217.1950684	1.16
219.0125732	0.22
223.3369141	0.59
224.8562622	0.29
227.4158936	0.36
228.8661804	0.69
231.1564331	1.05
233.0845337	1.21
237.148468	0.12
238.0877686	0.15
239.2794189	1.11
240.9947205	0.91
243.069397	0.17
245.3342896	0.40
247.289093	4.89
251.2307739	0.76
253.2564087	2.32
254.0215149	0.18
255.177124	0.94
257.1911926	0.60
258.3413391	0.41
259.1551514	0.30
260.1842041	0.29
265.3488159	0.21
265.9987183	0.16
267.0820923	1.03
269.1647644	0.22
270.3914185	0.38
271.3103333	0.98
272.3084717	0.14
277.8023071	0.24
280.2905884	0.14
281.3765869	0.20
283.0992432	0.40
284.4049072	0.25
285.3740845	0.27
287.3909912	1.12
291.9321899	0.15
295.1156311	2.61
296.3586731	0.47
297.097229	0.58
299.4590454	1.02
300.241272	0.19
301.0864563	0.19
303.4823914	0.30
304.766449	0.44
305.3699341	2.85
312.4143372	0.32
313.0830078	0.31
313.7183838	0.21
320.5916748	0.10
323.2382812	100.00
324.2734985	0.14
332.7562256	0.43
341.2374268	2.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0965
Annotation	Ethotoin
Peak:m/z	Relative Intensity
86.9174042	0.01
108.9379578	0.01
114.1092682	0.01
115.0875854	0.01
117.8982239	0.13
122.7060394	0.04
131.2300110	0.03
132.0099030	0.01
144.7727814	0.03
159.0857239	0.18
163.9351501	0.05
177.0555267	0.01
187.9620972	100.00
188.7824249	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	610.72
Annotation	Unknow
Peak:m/z	Relative Intensity
190.6265717	0.07
207.0863037	0.12
216.1949158	0.03
274.9483948	0.18
290.8646240	2.52
296.7966309	0.06
358.8040771	1.13
362.9135132	0.04
369.1615601	0.07
374.6298218	0.76
375.3765869	0.02
380.4473267	0.18
398.0440674	0.03
402.8092041	0.18
414.7707520	0.05
415.4145508	0.16
420.5320435	0.04
434.3333130	0.10
437.2766724	0.04
442.6567383	14.25
444.7410889	2.24
445.5568848	0.02
448.9810181	0.13
451.8297729	0.11
454.8890991	0.02
456.1903687	0.20
456.9973755	0.17
458.5197144	5.22
459.1926270	0.05
466.8504639	0.06
473.7575073	0.05
474.7200928	1.36
480.8612061	0.38
486.9799805	0.02
490.8918457	0.19
501.7396851	0.06
502.4121704	0.19
503.9401245	2.19
504.7317505	10.55
506.7670288	0.12
511.8086548	0.02
517.2674561	0.07
523.2183228	0.05
524.0206299	0.03
524.9426270	0.10
526.5990601	100.00
527.3962402	0.14
528.5082397	0.02
534.2733154	0.08
538.6453857	0.21
542.5665283	2.53
546.5126343	0.54
550.7704468	1.24
564.0110474	1.72
564.6769409	4.73
568.7426758	0.13
593.1929932	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.03
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
193.1815491	0.47
198.8893433	1.61
210.9829407	5.05
225.1319580	0.62
241.0462799	6.34
262.2767029	0.10
264.8240356	0.19
270.9620667	0.21
276.7824707	0.17
280.0894470	1.39
283.2689209	0.13
295.1148682	0.25
301.0225830	0.18
302.1803589	0.23
304.9353638	0.07
313.0255737	4.48
316.7640686	0.10
323.1549683	100.00
325.4417725	0.12
326.8413696	0.07
329.0030518	1.18
334.2598267	0.08
337.8889160	0.05
343.0486450	8.23
344.9396362	1.30
352.0682373	0.45
354.2104492	0.19
356.3207397	0.30
361.1562500	2.64
364.1146851	0.38
374.2583008	0.08
378.7053223	0.04
379.9711914	0.17
382.0316162	0.95
384.8819580	0.14
391.7279663	0.20
398.2719116	0.11
403.1409302	1.25
404.0786133	0.10
407.0552979	4.73
409.3264771	0.09
410.9755859	0.10
412.8337402	12.35
415.1514282	0.67
416.5765381	0.47
417.3262939	0.07
419.1423340	0.26
421.3613281	0.07
423.0544434	0.57
424.1809082	2.70
425.1486816	40.02
428.8311157	0.17
432.0539551	0.08
432.9989624	0.09
434.8099365	0.28
436.1011353	0.26
439.8106079	0.70
440.9909058	10.53
446.8269653	0.04
450.7969360	89.54
451.8825073	2.77
454.0895996	3.44
457.1533203	0.15
467.0569458	23.60
468.7253418	0.84
472.1156006	0.94
475.1754150	2.57
479.0800781	0.08
480.8398438	0.06
483.1072998	14.85
490.2272339	0.13
496.5610352	0.39
500.4909668	0.95
501.0935059	0.05
502.7462769	36.80
503.3596802	0.22
508.0755615	0.75
518.7227783	4.37
526.1835327	0.77
540.6992188	1.74
542.0770264	0.15
544.0532227	15.83
569.1220093	26.61
571.2540894	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	440.1562
Annotation	Mandelonitrile rutinoside
Peak:m/z	Relative Intensity
128.0144806	0.38
154.0019836	0.07
218.1962891	1.36
219.1852417	0.41
234.1107483	0.50
255.0220642	0.09
266.2210999	0.15
274.0235291	0.31
278.0881958	100.00
279.2088318	0.06
299.9087524	0.13
311.1466980	0.08
320.2663574	0.34
332.3752747	0.12
353.3927917	0.05
366.3122253	0.08
370.9583130	0.07
393.9338684	0.13
396.1307373	0.05
396.8164978	0.07
406.1215820	0.08
408.1081238	0.08
422.2198181	0.17
423.3073425	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
95.01683044	0.04
102.9874649	0.17
105.0281296	0.15
106.9895172	1.30
109.0650787	1.69
110.7999496	0.27
113.0574875	0.03
114.8332901	0.04
116.4030151	0.02
117.0734634	0.31
118.9768982	0.31
120.9893341	3.32
122.9977112	1.12
124.9637756	0.16
126.7277374	0.06
129.0001221	0.39
130.9780731	0.60
132.9989624	0.62
135.0716248	4.40
137.000412	0.66
139.0505371	0.03
140.9317017	0.14
143.028717	0.82
143.9512024	0.04
144.8794861	0.35
147.0053406	2.61
149.0634918	2.32
151.1766663	0.61
156.9850311	0.91
158.9006195	0.57
160.0289917	0.10
161.0619202	2.75
163.0541382	1.23
165.0415039	0.45
167.0542603	0.22
168.4368591	0.12
169.062561	0.92
170.1225281	0.10
171.0995483	0.45
173.0484772	0.86
174.979187	1.70
177.0309143	0.66
179.1549377	0.07
180.6565247	0.03
182.8825684	0.95
185.1070862	0.21
186.0317383	0.08
187.0650177	1.34
189.0930939	1.43
190.5669098	0.07
191.1985168	0.59
192.9868011	0.24
195.4963074	0.14
197.0076752	0.42
199.112915	0.19
201.0881195	0.48
203.0942993	0.86
205.2288818	0.72
207.1747131	0.11
209.1465759	0.42
211.034668	0.82
213.3847046	0.16
215.12323	0.23
217.0665588	1.54
219.3770447	0.09
221.4142151	0.24
223.116333	0.28
224.9822998	0.31
227.3239746	0.54
228.9692078	0.39
229.9808655	0.02
231.1922302	1.42
233.367981	0.04
235.2513428	0.02
237.2266235	0.14
239.101593	0.16
241.3789062	0.10
242.0881348	0.16
243.0549622	0.11
245.116333	1.43
247.2271729	4.74
248.1419373	0.13
251.2885132	0.09
253.147583	0.28
255.1002197	0.20
257.1860352	0.12
259.2528687	0.30
263.3900146	0.02
265.1313477	0.11
267.3555298	0.11
268.0852661	0.04
269.2708435	0.44
271.3251343	0.17
272.3172607	0.03
273.2553711	0.07
274.2427979	0.07
277.1619263	0.22
279.3228149	0.17
280.3149414	0.08
281.1905518	0.18
282.9910278	0.22
285.2622375	0.78
286.2208252	0.02
287.2819824	0.37
292.3297119	0.06
294.1847534	0.11
295.3433228	0.76
296.1264038	0.03
296.8297729	0.11
297.5403442	0.14
298.3408203	0.08
299.1820374	1.14
303.1565857	0.06
305.2755127	2.04
306.3949585	0.04
307.2641602	0.05
309.2971802	0.02
310.3439941	0.05
313.3703613	0.23
317.9425659	0.02
323.2284851	100.00
324.0386353	0.40
325.722168	0.04
332.8196411	0.16
341.2985535	1.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	227.98
Annotation	Unknow
Peak:m/z	Relative Intensity
67.8474731	0.02
85.1402130	0.02
90.8542938	0.09
95.1205902	0.02
97.0030212	0.04
98.8984375	0.02
109.0108490	0.22
109.9396973	0.11
119.2097931	0.03
121.9465942	0.01
135.0576782	0.19
141.0336761	0.06
143.6808472	0.03
148.1529388	0.03
149.2841034	0.05
154.1254883	0.08
154.9679718	0.07
156.1693573	0.08
166.1814117	0.03
166.7867584	0.05
167.8350830	0.02
170.1898651	0.11
172.5157318	0.03
182.1819000	0.14
183.8781281	0.05
184.6933441	0.02
186.8498077	100.00
188.1093903	0.02
191.2857666	0.08
192.2781830	0.20
193.1525269	0.03
199.5120850	0.18
204.6752319	0.46
207.4447174	0.11
209.7551117	0.89
210.3750153	0.09
211.1926575	0.11
223.9095306	0.05
227.8866119	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	468.1445
Annotation	Unknow
Peak:m/z	Relative Intensity
142.8958282	0.93
145.0476074	0.07
145.9990234	0.23
159.9814453	0.56
165.9874420	0.04
167.2260132	0.05
170.0802612	0.06
170.9223480	0.09
177.0546722	1.98
178.9872437	1.52
185.1062012	0.31
190.9478455	0.04
192.1126709	0.20
197.0575867	0.12
210.1724091	1.69
213.0905151	0.16
216.9093628	0.10
228.2078094	0.03
230.9207916	0.04
236.0606384	0.10
242.1453400	0.21
243.9828796	0.04
254.1077881	12.15
272.0687256	11.20
272.7109375	0.18
288.1332397	13.64
293.2575684	0.11
306.0961914	100.00
320.2565308	0.06
337.2979736	0.04
338.8591003	0.12
353.7506104	0.04
360.1109314	0.18
380.2528076	0.08
381.3100586	1.37
382.2665100	0.02
393.2059021	0.07
406.5567932	0.05
421.9337158	0.22
424.3535461	0.20
431.9596558	0.05
439.6870728	0.13
449.9587708	0.95
450.6163025	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.83126831	0.23
105.0715485	1.93
107.0396423	1.08
108.9486465	2.16
112.8615112	0.81
115.2397003	0.13
117.0431671	1.27
119.1375351	0.96
121.0561371	4.20
123.1696548	1.31
123.9785767	0.22
125.2040176	0.47
129.1179504	0.37
131.1244507	1.18
132.9690247	1.49
135.1284943	3.80
137.0314026	0.78
140.9740601	1.05
142.9794159	6.17
146.9168701	0.82
149.0813904	2.11
150.9464111	1.19
151.9576111	1.25
152.8717041	0.35
156.9052429	1.47
159.0141907	4.25
160.8943634	1.48
163.1655884	1.11
164.4017639	0.38
165.0862122	1.12
166.019989	0.19
167.1022491	1.54
168.1744537	0.13
169.0801086	3.37
169.878006	0.75
170.9311218	0.60
172.9445496	3.53
174.9983673	1.78
177.1335449	0.32
182.966217	2.16
184.9734497	0.49
187.0063477	2.76
189.138916	0.75
191.2577515	0.61
193.0510864	0.62
195.0546722	0.98
197.1097717	1.51
198.2453308	0.17
199.2068024	0.15
201.4307861	0.15
203.1184998	1.14
205.0262756	1.14
209.0167542	0.31
211.0994568	5.25
213.0793152	0.61
215.0820923	1.89
217.0473328	0.15
218.9561157	0.26
221.2232971	1.53
222.5594482	0.10
225.2048645	0.17
226.7689209	0.60
228.1589661	3.71
229.1165466	6.65
231.2618103	0.69
233.0899353	1.22
235.2842712	0.48
237.2802429	0.65
241.0412903	0.88
242.3349915	0.99
243.1192627	0.79
244.172699	0.60
245.2031555	1.06
247.2137451	8.61
248.2764893	0.30
249.1557922	0.47
251.2748413	2.14
253.0672607	0.28
255.2630005	0.48
259.2654114	0.16
265.0027161	0.45
265.8796387	0.13
271.2221069	0.67
275.2352905	0.14
279.4019775	0.35
281.427002	1.13
282.1035156	0.19
283.0169678	0.42
284.0714111	0.61
285.4542236	0.14
287.2519531	0.50
288.297699	0.34
291.9980469	0.19
295.2699585	3.14
296.9852905	1.05
297.8954468	0.30
299.1887512	1.72
300.2042236	0.74
301.2573853	0.22
305.2550049	5.59
313.2288208	1.05
321.3736267	0.53
323.2286072	100.00
324.378479	1.58
331.8773193	0.88
341.230072	1.58
342.5491333	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.2161
Annotation	Unknow
Peak:m/z	Relative Intensity
176.1995850	0.04
201.2705078	0.03
213.1880188	0.02
232.1401062	0.02
250.0468292	0.42
265.0933838	0.17
282.6404419	0.43
283.4207153	0.01
308.3206177	0.03
311.2581787	0.01
330.3734741	0.04
331.3897705	0.03
342.3402100	0.06
356.4509888	0.04
374.9381714	0.03
386.4782715	0.03
399.3066406	0.09
400.1607056	0.02
406.9071045	0.08
409.4868164	0.05
412.1325073	100.00
412.7721558	0.42
420.2229614	0.02
438.5145874	0.01
442.1685181	0.05
443.6823730	0.01
451.0994873	0.02
457.7812500	0.04
491.3045654	0.04
508.4584351	0.08
512.3758545	0.07
522.2539062	0.18
528.1508179	0.06
530.3115234	0.07
536.3302002	0.06
540.2354736	0.17
548.7557983	0.24
549.5084229	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
84.95368958	0.13
93.12705231	0.07
94.97064209	0.65
97.08424377	1.02
98.91971588	0.65
105.0742798	0.26
106.9580536	0.28
108.0250015	0.17
109.0850296	2.33
111.0732346	1.91
113.0584641	0.18
114.8921356	0.12
117.0266953	0.15
119.0979309	0.73
121.0461349	1.02
122.9552612	1.92
124.489151	0.32
125.1778336	0.46
127.0204849	0.37
128.8015747	0.13
132.9567719	1.07
134.9277344	1.63
136.9152527	0.90
139.0228271	3.47
140.8269348	0.26
142.9693909	0.50
145.0751648	0.35
147.0090027	0.14
148.5015564	0.07
149.1149292	0.93
150.9637451	0.39
152.9703064	1.91
154.5064087	0.13
155.1243896	0.74
157.0265198	0.92
158.0505066	0.26
159.2887878	0.24
161.0887451	0.47
163.2049561	0.48
164.3732758	0.09
165.1438904	0.50
167.1236267	0.67
169.1132355	1.29
171.10849	1.06
175.0678406	0.12
176.0481873	0.05
176.9539795	0.36
179.0021057	0.73
181.2277222	0.20
182.9417725	1.77
184.9338989	0.81
187.2869568	0.15
189.3869476	0.13
191.137085	0.45
192.0085907	0.14
193.0989685	0.73
195.1924438	0.81
197.0049744	3.51
199.1595154	1.12
201.1647949	0.70
203.1496277	1.31
205.1927185	0.06
207.0664368	0.93
209.1391907	0.79
211.0108337	3.42
211.7015381	0.32
212.9846191	1.14
215.132782	0.68
219.2731323	1.86
220.1109619	0.06
221.20755	2.14
223.1322021	1.00
225.1698608	1.82
227.3393555	2.02
233.1471252	0.80
234.6048279	0.14
235.3130493	0.34
236.2244873	0.08
237.1763916	3.38
239.1855774	8.33
241.312561	0.45
243.2911682	2.04
249.2199707	0.15
251.1415405	1.93
252.2510681	0.52
253.1256409	1.57
254.2189941	0.17
255.070343	1.52
256.0751038	0.62
257.15625	0.61
258.927124	0.07
261.1947327	4.19
261.9676514	0.23
269.0723572	0.99
277.4060364	0.69
279.2332764	100.00
280.5124512	0.35
281.1444092	1.86
287.8474426	2.07
288.7960205	0.63
295.5265503	0.66
297.523407	0.25
298.4252625	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1088
Annotation	alpha-D-Galactosyl-(1->3)-1D-myo-inositol
Peak:m/z	Relative Intensity
100.3396835	0.40
101.0036469	6.04
113.0139008	18.88
114.998085	0.53
118.9867783	16.54
125.024704	1.92
131.0072937	7.15
143.0457611	21.05
149.0320892	6.38
160.0229187	0.29
161.0490112	23.03
174.0557556	0.12
176.993103	0.80
178.396225	4.87
179.0482788	100.00
181.2444763	0.11
193.2102966	0.15
207.1559143	0.16
219.8574829	0.25
220.888855	1.37
223.0964966	0.34
224.9284363	0.15
241.317749	0.47
243.3667297	0.11
256.8128967	0.39
258.5442505	0.52
277.246582	0.28
278.8600464	0.21
280.3722839	0.30
281.0405273	2.20
282.1552734	0.65
295.2467346	2.48
323.6109619	0.40
326.2891541	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.158
Annotation	Unknow
Peak:m/z	Relative Intensity
131.8091431	0.35
144.0067291	0.10
144.9128876	0.17
159.0018921	0.09
161.9174957	2.43
162.9200745	7.26
164.0667114	7.62
165.3544159	0.13
166.2564545	0.05
178.9207306	8.63
179.9512634	3.59
180.6565247	0.15
189.1122437	0.08
196.9793549	0.07
200.3835754	0.08
201.3780975	0.11
229.0899506	0.15
230.3027039	0.04
232.4803925	0.59
233.1772766	1.80
234.0664368	0.50
234.9915009	0.11
238.2430725	0.25
244.9308167	0.13
246.9481201	0.09
257.2383728	0.09
260.4527893	0.09
261.4755554	0.12
271.0563965	0.04
272.3078003	0.09
290.2301636	0.49
291.1267395	0.60
292.1832275	0.15
308.0966492	85.89
309.0971985	100.00
310.4497681	0.10
329.4191284	0.27
332.2860718	0.07
338.4501953	0.23
340.9647217	2.07
342.0559387	2.52
354.9924927	0.07
356.2617188	0.33
363.1972656	0.10
368.2129517	0.15
372.2594604	0.23
385.4940491	0.22
388.3434143	0.15
392.3635559	0.18
395.1419067	0.25
396.0688782	1.31
399.3713684	0.19
409.4360046	0.04
411.0718079	0.05
425.1417542	0.08
427.7579041	0.32
435.3658752	0.05
453.1871643	1.38
453.9161682	0.42
462.4559937	0.39
463.4035339	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	568.29
Annotation	3'-Deoxydihydrostreptomycin
Peak:m/z	Relative Intensity
217.0438385	0.04
226.2456512	0.02
238.0069885	0.10
261.3712463	0.04
275.2057800	0.07
308.2377014	0.13
327.2367554	0.07
332.3184814	0.12
333.9964600	0.08
364.0048828	0.04
367.3103638	0.11
376.0902100	0.03
392.6655884	0.24
406.3911133	0.11
429.3651733	0.06
432.8928833	0.05
435.0117798	0.21
437.1384277	0.15
444.0198975	0.25
448.2233887	0.07
449.8736572	0.15
471.4762573	0.17
474.8319092	0.46
479.0478516	0.32
480.3369751	0.05
487.3455200	0.32
493.0005493	0.07
496.3375854	0.19
507.9586182	0.03
510.4547729	0.28
513.0639038	0.33
523.8237915	0.12
528.2774658	0.10
535.8037109	0.13
539.0166016	1.55
541.6876221	0.03
542.5564575	0.13
550.0745850	0.17
550.9393921	0.10
553.9669189	0.25
559.1332397	0.40
596.1113892	0.24
632.7277832	0.10
642.0537720	0.15
643.8325806	0.46
648.4585571	0.16
658.0219116	0.11
671.1546631	0.18
679.2575073	0.05
685.3732300	14.08
687.3154907	0.10
688.7061768	0.13
690.7572632	0.33
696.4765625	0.12
705.8804321	0.54
709.0632324	2.49
712.3575439	2.01
713.0971680	0.05
718.3836060	100.00
719.4362793	0.24
720.4192505	0.59
721.4209595	0.04
722.0852661	0.28
727.7800293	0.20
730.8011475	0.04
731.9818726	0.10
755.3004761	0.16
794.7785034	0.27
808.3027954	0.15
830.7595825	0.27
875.4015503	0.06
879.3793945	0.04
891.4113159	0.22
896.4157715	0.13
906.2837524	0.25
909.3459473	0.16
916.2440796	0.20
935.1772461	0.25
939.8301392	0.03
963.1094360	0.30
973.6000366	0.19
996.4103394	0.17
1002.3781130	0.29
1027.3334960	0.64
1028.0446780	0.13
1196.5286870	0.16
1238.7413330	0.04
1251.0516360	0.05
1270.7642820	0.15
1801.4510500	0.52
1874.7946780	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1223.2017
Annotation	Unknow
Peak:m/z	Relative Intensity
359.7946167	0.24
406.3597717	0.22
446.2396240	0.07
465.5479736	0.14
483.3252563	0.56
523.3414307	0.12
526.2537231	0.14
607.8334961	1.02
610.5229492	0.41
631.9874878	0.80
639.5612793	1.31
648.0302734	0.49
649.6354980	0.61
654.5223389	0.16
659.5343018	0.33
665.5160522	0.12
666.2120361	1.50
672.4819336	0.13
675.7288208	0.22
680.9136353	0.76
695.9020386	0.74
697.0598145	0.41
697.8403320	0.68
703.4561157	1.03
709.1624756	0.08
709.8565674	0.63
714.0296631	1.54
715.0366211	0.80
720.7267456	0.33
730.4569092	0.38
733.5034180	0.40
739.7375488	0.55
742.8079224	0.42
748.6475830	0.54
749.7785645	0.37
766.4352417	0.32
770.5194702	1.00
771.5617065	0.15
788.9080811	0.77
791.4801636	3.79
792.6544189	3.83
793.4777832	0.77
798.5815430	0.21
800.4420166	0.27
802.2096558	0.29
806.6362915	0.26
809.3840942	1.50
813.9224243	0.24
817.1609497	0.17
818.5526733	0.22
823.2406006	0.55
824.4659424	0.49
825.4729004	1.52
826.1386719	1.17
828.0176392	0.76
829.1997681	0.63
838.6060791	0.65
842.1409912	1.39
842.9775391	0.73
845.4451904	0.14
846.0720215	0.28
848.6850586	0.43
849.7926025	2.48
850.6689453	1.83
852.0703125	0.50
853.1958008	0.14
854.8745117	0.19
858.6307373	0.27
862.1289062	3.96
863.6066895	1.31
865.4587402	0.52
867.1124268	1.00
868.6817627	0.56
869.3621826	0.13
870.0299072	0.44
872.8084717	0.62
873.5710449	1.38
874.5313721	1.66
877.7995605	6.26
879.0327148	0.56
880.2781982	0.38
881.3847656	1.78
882.5415039	0.98
883.4682617	2.10
888.1102295	0.40
890.0595703	3.53
891.4427490	1.42
893.3403320	2.02
894.5562744	0.72
895.2791748	0.27
896.1015625	1.54
897.3231201	1.49
898.6186523	0.36
899.7729492	2.52
900.4703369	0.21
901.1346436	0.25
904.3188477	0.31
905.0521240	0.67
906.2406006	1.85
908.4429932	6.87
909.5861816	0.64
910.8522949	3.28
911.4970703	0.15
912.3577881	0.45
914.3044434	0.79
916.0852051	0.75
917.6181641	0.11
922.6052246	0.83
924.3708496	1.85
925.0875244	2.72
925.9702148	2.70
928.9453125	0.88
932.6214600	0.35
933.9692383	0.58
936.5012207	0.39
939.8935547	1.05
940.5123291	1.18
944.4804688	0.89
949.1691895	1.03
950.9661865	0.10
951.9311523	0.38
958.5277100	0.99
960.6820068	0.13
966.7659912	0.82
976.0302734	0.41
977.3457031	0.23
978.6062012	0.08
979.6248779	0.18
980.8115234	0.26
983.4846191	0.14
987.6400146	0.31
992.8818359	0.18
993.6668701	0.18
996.5354004	0.50
998.4194336	0.93
999.6547852	0.08
1000.6434330	1.03
1004.0477290	1.09
1012.8825680	0.28
1020.1304930	0.87
1022.7888180	1.96
1026.4575200	0.39
1029.7517090	0.92
1033.1580810	0.37
1038.6575930	1.11
1039.6386720	0.32
1040.9882810	1.54
1045.2825930	1.30
1057.1345210	1.79
1060.5808110	0.33
1061.3549800	0.77
1062.5219730	1.30
1063.1257320	0.81
1064.4555660	0.93
1065.9268800	0.20
1068.8843990	1.08
1070.2817380	1.40
1071.1551510	0.10
1072.1968990	1.33
1073.3001710	0.14
1078.7546390	0.26
1079.6970210	1.14
1081.6090090	0.67
1085.7917480	1.09
1086.6850590	0.19
1088.0578610	1.91
1089.1513670	2.55
1091.6103520	0.19
1096.6721190	0.57
1101.5452880	0.20
1103.5156250	2.06
1104.9776610	2.77
1105.8530270	0.61
1107.9426270	0.17
1110.0659180	0.42
1111.8586430	1.43
1112.6831050	0.65
1113.6190190	0.75
1114.6573490	1.51
1116.2180180	0.15
1117.2199710	0.25
1120.1997070	4.09
1121.3712160	2.21
1122.1528320	0.85
1127.8579100	3.07
1128.5258790	0.32
1129.9843750	0.31
1132.0017090	0.64
1133.2880860	0.84
1134.1743160	2.00
1135.8396000	2.88
1136.7882080	1.02
1137.7473140	0.98
1138.5222170	3.77
1141.4571530	0.65
1142.3452150	0.86
1143.2788090	3.64
1143.9493410	7.36
1144.9172360	1.23
1145.7609860	1.31
1146.4957280	0.92
1147.7669680	2.22
1148.5727540	1.04
1149.5488280	1.38
1152.4248050	1.17
1153.7033690	2.02
1154.7281490	1.68
1155.4155270	0.77
1157.1522220	4.77
1158.0474850	2.93
1159.2211910	6.03
1160.1478270	3.26
1162.7768550	5.61
1163.7084960	4.85
1164.6416020	0.71
1165.6081540	3.46
1166.2352290	1.32
1167.8513180	4.38
1168.8629150	7.52
1169.5623780	3.08
1170.2156980	0.38
1170.8652340	0.79
1171.6298830	1.20
1173.0977780	4.61
1173.9691160	9.93
1174.7421880	11.32
1175.6538090	2.88
1176.2716060	0.28
1178.1938480	3.80
1179.2373050	11.39
1180.3760990	20.76
1181.2414550	9.26
1182.3217770	0.14
1183.5036620	3.03
1184.3167720	16.92
1185.3242190	40.58
1186.1831050	6.24
1187.1262210	1.85
1189.2659910	12.02
1190.4742430	51.27
1191.4570310	52.00
1192.6362300	11.10
1193.4833980	0.44
1195.2968750	42.06
1196.2932130	74.65
1197.3310550	4.71
1197.9794920	0.45
1200.4766850	8.87
1201.5263670	100.00
1202.1828610	63.25
1202.7883300	56.08
1203.6970210	0.12
1205.4342040	2.15
1206.0988770	7.37
1206.7624510	33.19
1207.9455570	3.74
1208.5922850	1.37
1209.4492190	0.27
1229.0593260	0.66
1230.5786130	0.26
1238.9353030	0.73
1244.0540770	0.19
1245.5899660	0.40
1246.5988770	0.32
1254.0936280	0.60
1254.9810790	0.39
1256.0822750	0.10
1258.3459470	0.45
1262.7208250	0.32
1264.3542480	0.72
1265.0231930	0.30
1265.8198240	0.14
1266.5505370	0.14
1270.5273440	1.89
1271.5273440	0.13
1272.9731450	0.77
1277.7637940	0.33
1281.8604740	0.14
1282.4785160	0.26
1283.4763180	0.42
1285.4627690	0.19
1287.3916020	1.07
1289.5296630	0.17
1296.9532470	0.19
1298.2497560	1.29
1299.5278320	2.13
1314.8956300	0.85
1316.1777340	0.10
1325.2021480	0.47
1326.8303220	0.32
1327.7539060	0.59
1331.4168700	0.34
1332.5648190	1.11
1333.6752930	0.15
1339.9884030	0.38
1340.9259030	0.07
1341.8425290	0.33
1344.6538090	0.16
1345.9808350	0.11
1347.4791260	0.76
1350.2402340	0.76
1351.6448970	0.82
1352.6739500	0.49
1353.6693120	0.64
1354.6744380	0.45
1355.5113530	0.58
1356.4061280	0.67
1358.6691890	0.81
1359.9108890	0.86
1361.2642820	1.76
1362.0799560	1.48
1362.8356930	0.52
1363.6214600	0.89
1365.3353270	2.10
1368.4755860	1.57
1369.2039790	1.61
1370.9617920	0.22
1372.8629150	0.35
1374.0819090	1.94
1375.0399170	0.68
1376.1143800	0.98
1376.8763430	1.87
1378.3653560	2.91
1379.2702640	0.29
1380.9085690	0.76
1381.6457520	1.55
1382.5841060	1.89
1384.1488040	1.34
1384.8620610	0.62
1385.9094240	2.70
1387.4737550	0.47
1388.5666500	0.79
1390.1810300	6.87
1391.0690920	7.11
1392.3629150	1.21
1393.0079350	1.35
1394.1458740	4.85
1394.9349370	0.13
1395.6177980	2.13
1396.2464600	0.82
1397.5614010	4.55
1398.5667720	2.40
1399.7299800	0.57
1401.3559570	1.21
1402.2762450	1.25
1403.1875000	0.26
1406.2239990	12.17
1407.5286870	8.21
1413.9188230	1.48
1414.7520750	1.15
1416.2706300	0.96
1418.8504640	0.20
1423.0303960	1.32
1424.0317380	0.68
1426.3638920	0.13
1427.5463870	0.55
1428.4864500	0.28
1429.3531490	0.84
1430.5753170	2.07
1431.3204350	0.22
1434.9016110	0.18
1440.5296630	0.23
1456.6220700	0.24
1462.4116210	0.99
1479.3955080	0.44
1494.6201170	0.12
1496.3492430	0.55
1497.0766600	0.61
1498.2823490	0.51
1510.9416500	0.61
1513.3554690	0.21
1515.6717530	0.39
1518.7813720	0.25
1527.4171140	0.75
1528.6870120	0.13
1532.2198490	0.23
1540.6705320	0.60
1544.0140380	0.27
1549.0537110	0.17
1557.4064940	0.21
1558.8455810	0.36
1559.6827390	0.23
1561.6549070	0.55
1565.0773930	0.40
1573.0783690	0.29
1578.4383540	0.56
1579.8436280	0.18
1583.3917240	0.30
1586.3194580	0.19
1596.6290280	0.17
1597.8391110	0.46
1602.9066160	0.25
1605.0225830	0.18
1607.7019040	0.57
1619.4354250	0.30
1621.7425540	0.98
1633.6241460	0.16
1638.8621830	0.14
1650.6260990	0.19
1651.7193600	1.36
1653.5174560	0.10
1660.5472410	0.59
1672.8288570	0.66
1681.4029540	0.36
1690.3260500	0.66
1690.9978030	0.75
1697.8563230	0.73
1699.3356930	0.47
1705.7691650	0.60
1706.5860600	1.04
1707.3631590	0.83
1708.4718020	0.85
1709.2393800	0.61
1714.0061040	1.24
1715.3267820	1.27
1716.1228030	0.92
1716.7287600	0.34
1721.8612060	1.64
1722.7833250	1.71
1723.7669680	1.59
1730.7435300	0.68
1731.8669430	4.31
1732.5130620	1.24
1737.8397220	0.10
1738.8756100	0.91
1739.8988040	2.53
1740.7938230	1.23
1743.6392820	0.76
1747.1485600	0.20
1748.9010010	6.56
1749.8543700	1.74
1750.7591550	0.41
1753.0778810	0.23
1754.5494380	0.39
1756.3236080	0.46
1757.4395750	0.12
1759.3397220	1.03
1761.3883060	0.32
1773.5753170	0.16
1783.9875490	0.63
1784.7030030	0.87
1788.8919680	0.45
1790.1623540	0.85
1791.2321780	0.19
1793.0358890	0.13
1794.0124510	0.23
1803.4713130	0.58
1804.6417240	0.44
1805.8531490	0.20
1807.3176270	0.74
1808.5723880	0.41
1809.9157710	0.13
1815.8082280	0.11
1816.5266110	0.18
1817.8719480	1.66
1818.8992920	0.59
1823.5794680	1.10
1824.6448970	1.20
1825.5139160	2.22
1826.7049560	0.95
1832.8736570	0.60
1833.8726810	0.64
1842.6461180	0.16
1847.0113530	0.14
1849.1280520	0.27
1850.0300290	0.41
1850.9713130	0.86
1852.0064700	1.28
1852.8094480	0.49
1862.8953860	0.56
1869.8614500	0.11
1880.1540530	0.25
1881.8542480	0.17
1882.7703860	0.28
1883.6353760	0.99
1900.6268310	0.56
1903.5695800	0.31
1921.8485110	0.15
1938.4709470	0.25
1942.4538570	0.09
1993.8298340	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Lactulose
Peak:m/z	Relative Intensity
205.0286255	0.02
222.9474182	0.02
225.3294983	0.05
265.2692261	0.01
279.2406921	0.01
341.1409912	100.00
341.7566528	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	603.204
Annotation	Unknow
Peak:m/z	Relative Intensity
182.9593353	0.10
194.7823486	0.10
197.0836792	0.11
213.0700684	0.25
229.2472076	0.21
247.1310883	0.28
251.2489166	0.61
271.1814575	0.05
282.1082764	0.18
313.9983521	0.18
316.2518311	0.23
321.1851196	0.14
345.8594360	0.08
348.2437134	5.21
357.2678833	0.09
373.3969727	0.53
387.1658936	0.15
397.4745483	0.12
405.0226440	0.14
409.1212158	0.98
417.2231445	3.45
418.2001343	0.36
422.2507324	0.06
422.9890137	0.16
425.2691040	0.10
431.5450439	0.10
436.1551514	0.08
439.2175293	0.15
441.3344727	0.38
445.2387695	0.97
450.1215210	0.36
454.2590332	0.26
455.1486206	0.21
457.3041992	0.25
460.2350464	0.46
462.9552002	0.08
471.9237671	0.73
474.1325684	0.37
483.4707031	0.20
487.9901733	0.42
489.3004150	0.56
494.3285522	0.35
506.2454224	5.73
507.2267456	0.17
512.7893677	0.08
518.3337402	0.66
521.3972778	0.08
522.0757446	0.54
523.0267334	0.27
527.3215942	0.16
530.1241455	0.32
536.9942017	0.77
542.1806030	0.29
557.3537598	0.09
558.1366577	0.42
559.3520508	0.23
568.1146851	0.15
569.5676880	0.84
574.2789307	0.12
579.8151245	0.78
586.1934204	100.00
586.8451538	0.38
587.8565674	0.11
588.5704956	0.85
591.2509155	0.32
594.3624878	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	628.174
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9933167	3.92
183.3535156	0.09
184.1518250	0.04
188.3556213	0.12
193.1708984	0.05
195.0780334	0.06
211.0501099	0.14
212.1188202	0.06
214.8846130	0.41
216.1352539	0.10
230.1399078	0.04
232.3094635	0.20
233.0227661	2.46
237.1848755	0.06
245.0153809	0.12
249.3292694	0.25
251.0865784	0.09
254.1411438	0.22
267.2088318	0.10
268.1032715	0.08
272.2258301	0.14
273.9714661	0.08
284.2334595	0.08
285.4931641	0.07
290.1511230	0.66
290.9184570	1.09
295.1983643	0.25
296.2108154	0.16
297.9304199	0.05
303.1564636	0.03
308.1068726	100.00
314.8933716	0.05
315.9556885	0.08
317.8629150	0.08
320.3263550	0.07
321.0738525	0.46
322.2233887	0.08
336.8277588	0.17
343.7650146	0.07
358.9413452	0.26
362.0625000	0.21
368.2523804	0.17
369.1430054	1.44
370.2531128	0.10
371.2327271	0.03
376.2958374	0.15
378.8795166	0.25
380.2982788	0.37
392.1965332	0.09
396.1839600	0.10
401.1346436	0.08
409.1737671	0.25
410.3729858	0.04
415.3495483	0.04
416.5915527	0.16
423.1802979	0.19
424.0555420	0.28
427.3911743	0.09
428.2322998	0.06
432.9066162	0.06
435.0202637	0.06
435.7883911	0.49
437.3419800	0.06
438.7305908	0.06
446.1926880	0.15
447.1198730	0.17
448.5952148	0.03
455.2235718	0.10
462.9616089	0.17
464.0690308	0.22
465.2373657	0.17
466.2944336	0.36
477.0341187	0.31
478.1680908	0.14
480.6232910	0.09
481.5656128	0.25
483.4364014	0.38
484.2523193	0.09
490.5928955	0.06
494.8992920	0.06
497.1749268	0.99
498.1449585	1.26
499.2261353	2.72
500.2037964	0.07
509.4955444	0.49
513.1443481	0.27
517.1151733	0.07
526.3304443	0.14
530.2969360	0.08
531.2770386	0.20
538.5468140	0.08
539.2075806	0.07
541.3921509	0.16
542.5248413	0.11
548.2459106	0.13
550.2530518	0.07
551.2010498	0.10
557.3375244	0.57
568.4136353	0.23
569.1760254	0.30
570.4349976	0.17
584.0881348	0.61
586.8831177	0.49
589.9714355	0.17
592.0464478	0.21
592.6897583	0.15
602.7211304	0.10
607.4278564	0.12
609.2362061	1.47
610.3590698	2.42
611.5306396	0.59
616.8771362	0.51
618.9409790	0.39
619.8091431	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	618.86
Annotation	Unknow
Peak:m/z	Relative Intensity
273.0729980	0.33
275.0468140	0.17
276.9653320	0.19
288.8838501	0.24
356.3101196	0.03
386.8627930	0.06
388.0700684	0.21
388.9996948	0.37
389.8157959	0.21
391.0922241	0.59
405.9913940	0.14
418.9664917	0.15
421.2644043	0.03
434.9891968	0.05
443.0060425	0.67
445.1137085	0.09
459.0684814	0.65
461.1153564	0.16
491.3137817	0.12
501.8354492	0.09
502.9374390	3.11
503.9032593	1.56
504.9161377	4.15
516.8680420	0.17
528.7709351	0.09
532.8629761	0.04
544.8038940	0.84
545.8684692	0.03
550.8259888	0.23
555.1420898	0.16
561.1336670	0.13
563.0560913	0.04
572.8081665	100.00
573.4306030	0.16
574.9740601	0.92
588.9213257	0.08
590.7189331	0.07
591.6624146	0.04
592.9822998	0.04
595.8429565	0.08
600.8612671	0.40
602.0488892	0.22
603.2633667	0.14
609.0454712	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	529.2252
Annotation	Unknow
Peak:m/z	Relative Intensity
160.9703827	0.25
169.0192261	0.05
178.9775696	0.60
187.1237488	100.00
203.1523743	0.19
221.1757355	0.09
246.1332703	0.03
247.0035095	0.18
276.0252075	0.16
280.9460144	0.34
300.8803711	0.10
320.3653564	0.07
321.8944702	0.10
323.2592163	0.06
335.1490479	0.15
341.2045288	34.50
349.3400879	0.06
352.8884277	0.11
364.2073364	0.07
365.0667114	0.11
378.3143311	0.12
394.9443970	1.04
411.1006470	0.09
412.1683350	0.07
415.7348022	0.18
432.2104492	0.05
444.9434814	0.03
455.2104492	0.07
483.2075195	0.14
493.2935181	0.13
511.1206055	0.22
512.0200195	1.99
530.3463745	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
141.2817383	0.34
156.9716187	0.64
158.9468994	0.94
171.0592041	2.52
173.199585	0.81
185.0604401	0.86
187.1986389	2.40
189.0298462	0.47
199.0805054	2.38
201.0299835	3.18
203.3417664	0.25
213.1699829	2.84
215.2182312	7.87
217.200592	0.81
227.0997925	2.42
229.177063	5.86
231.1468811	2.38
241.1429443	2.07
243.2454529	3.27
255.2905273	1.21
255.9988098	0.81
257.1686401	3.65
259.3188477	0.96
263.3128967	1.58
265.2637329	0.43
269.0185547	1.81
271.2062988	3.32
273.1057129	0.79
283.4140625	1.52
285.3785095	7.40
287.3003845	0.62
295.2111206	1.76
297.421875	3.97
299.2359314	4.65
301.1605225	2.28
303.3916016	1.23
307.3122253	0.21
310.2084351	0.19
311.3348694	1.63
313.1513062	2.82
315.3757324	6.72
321.5264893	1.65
323.2617493	6.03
325.3316345	0.56
329.3952332	0.55
339.2503052	100.00
341.2796936	19.28
348.1263733	0.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0852
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
77.02275848	0.41
79.13417053	0.59
80.95423126	0.83
82.94495392	1.08
85.23552704	0.32
94.98629761	2.55
96.76899719	0.15
98.97499084	0.22
100.9933624	0.18
103.0185852	1.14
105.0860901	2.50
107.0775146	0.86
108.9129028	1.87
110.8386993	2.00
113.1482086	0.20
114.9290619	0.45
115.7477875	0.11
118.8640289	0.72
121.0508881	1.14
123.0341644	3.13
125.0010376	0.64
127.0438232	1.12
128.0214996	0.20
128.9024658	6.38
129.9137115	0.45
131.3384857	0.23
132.9895172	3.43
134.9712677	1.23
136.9839783	1.21
138.9058838	0.89
140.9286346	2.15
142.1137085	0.20
146.9315186	1.09
148.7420044	0.65
150.9416351	53.24
152.0300293	3.34
153.0851593	2.21
154.8936005	1.41
156.0085907	0.33
156.9888306	1.16
159.0549469	0.27
161.318222	0.84
164.4881439	0.46
165.1520538	2.32
166.0707855	0.55
167.0139008	4.89
168.0346985	1.11
168.9520874	2.75
170.0101471	0.60
171.0155182	0.74
172.0749054	0.20
173.1323395	0.78
175.0567932	0.83
177.0146179	0.83
178.4865723	0.44
179.0936279	3.63
181.0155182	1.90
182.2412415	0.25
183.0540924	2.38
185.1031342	1.48
186.0972137	1.02
189.0832977	0.53
191.119278	2.01
192.0593414	0.30
193.1387787	2.29
194.0745239	0.20
195.1556091	1.40
195.9503937	0.62
197.1369171	11.85
199.1414642	1.36
200.325058	0.19
206.2567596	0.22
207.1676941	4.98
207.9607849	0.32
209.0579224	1.56
210.1094513	0.74
211.1784821	6.00
212.1426392	0.50
215.3796082	0.20
217.2238617	9.97
217.999527	0.34
220.056366	1.66
221.21315	0.20
222.0003967	0.43
222.9943085	0.63
225.0274963	10.87
226.2450714	1.64
233.8603973	0.15
235.1539307	37.76
235.9930573	0.56
238.15242	11.94
239.103653	0.67
244.2857666	1.30
251.0044403	0.83
253.0875397	100.00
254.2115021	17.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	642.1794
Annotation	N-Trifluoroacetyladriamycinol
Peak:m/z	Relative Intensity
186.0962524	0.07
186.8323975	0.05
188.1024780	0.30
193.0274506	0.07
194.0968475	0.09
198.8681946	0.31
200.0349426	0.16
201.1999512	0.15
216.9196625	2.25
235.0235291	0.70
245.1294250	0.08
247.1537323	0.24
257.8821411	0.06
259.1305542	0.29
265.2811279	0.08
266.9669189	0.07
276.0272827	0.18
277.0429993	0.79
279.1315002	0.27
282.0983276	0.32
285.1602478	0.15
288.7141418	0.03
298.1301880	0.05
299.9406128	0.47
302.0650635	0.36
303.0552979	20.40
304.0456543	0.70
305.0956116	0.29
313.0474243	0.13
318.7865601	0.08
326.2778931	0.28
331.1426392	3.49
335.4301453	0.09
337.0079346	0.21
342.7651978	0.30
348.9344482	100.00
349.7241211	0.45
360.4717407	0.07
361.4370117	0.45
366.1738281	0.35
366.8790283	0.05
367.9755859	0.23
371.4819946	0.12
373.7008057	0.14
376.2634277	0.14
378.0313110	5.21
379.1212158	8.34
379.9861450	0.09
384.4188843	0.21
390.1873169	0.28
390.9591064	0.39
396.5812378	0.25
409.1376953	0.37
421.1347656	0.13
426.1536255	0.49
433.2677612	0.16
435.7807617	0.39
436.8950195	0.98
444.4051514	0.09
445.1291504	0.08
450.8628540	0.68
452.3171387	0.20
454.5314941	0.15
462.9244385	0.31
467.0420532	0.18
469.5125122	0.18
474.9993286	0.25
480.4230957	5.58
481.0343018	31.70
481.9512939	0.19
485.4265747	0.04
493.1253662	0.17
495.6891479	0.25
497.2642822	0.16
507.0092163	0.41
510.4289551	7.57
511.1527710	18.78
523.0178223	0.64
528.1170044	0.07
535.4276733	0.12
553.0684204	0.09
557.1665649	0.12
562.9289551	0.06
570.4498291	0.18
578.5097656	0.19
584.4453125	0.05
589.4486694	0.11
590.5801392	0.45
594.9113159	0.76
596.6057739	0.34
597.5160522	0.16
598.3500977	0.04
599.1288452	0.13
600.5917358	0.04
606.4428711	0.24
613.4151611	0.28
614.1209106	0.21
616.0871582	0.73
625.1879272	0.83
626.8143921	0.46
633.0782471	0.78
634.6131592	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	738.93
Annotation	Unknow
Peak:m/z	Relative Intensity
211.0310211	0.05
241.1004486	0.75
252.9225464	0.02
259.1428223	0.03
280.0865479	0.04
294.9931030	0.01
323.0809326	11.53
329.1689453	0.10
337.0023804	0.03
351.4068298	0.02
359.0791626	0.85
374.6552734	0.02
377.1434937	0.65
381.8904419	0.01
388.2648926	0.05
390.8824463	0.03
402.7643433	0.02
414.9785156	0.12
422.8751221	0.03
425.2007446	0.02
428.8468628	0.18
434.8156738	0.14
435.9478149	0.03
441.1243286	0.77
451.0457764	0.01
458.9832764	1.91
466.8008423	0.79
467.8129883	0.05
469.9412231	0.02
483.1675415	0.74
494.8289185	0.91
496.0880737	0.20
497.1414795	0.16
507.8631592	0.01
512.0226440	0.18
532.7867432	0.03
550.7933960	0.07
558.9852905	0.07
560.0942993	1.30
562.9561157	0.04
564.6885376	10.90
565.3292236	0.06
566.7365112	0.02
570.8145752	0.66
575.2082520	0.03
576.9243774	0.15
579.0292969	0.02
581.9557495	0.10
582.8544312	0.17
583.8914795	0.21
585.0386353	1.72
586.7996826	0.25
599.9754028	0.02
601.0877686	0.24
602.9181519	100.00
603.7744751	0.81
605.2096558	0.03
606.7541504	0.05
619.0010376	0.39
624.7327271	0.04
637.2366333	0.07
640.7343140	1.75
641.5847778	0.02
650.9846802	0.04
651.7042236	0.24
652.4873657	0.40
654.6481323	4.72
666.9869995	0.06
670.5880737	0.64
678.7887573	0.01
691.6151733	0.03
692.6005859	0.51
696.3419800	0.81
697.0171509	0.04
715.3352661	0.03
716.0287476	0.06
720.7895508	1.50
721.5449219	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	227.9821
Annotation	Unknow
Peak:m/z	Relative Intensity
83.1920013	0.01
84.1513290	0.06
95.0651855	0.12
96.9619293	0.02
97.8756256	0.03
107.1005249	0.13
108.9812622	0.05
112.7697144	0.02
119.1919708	0.05
120.9861298	0.09
122.9514160	0.04
125.0387268	0.07
127.2567139	0.01
128.9111938	0.05
134.9736938	0.02
136.3808441	0.01
138.2008057	0.10
146.3401184	0.02
148.8810577	0.04
156.0053864	0.06
156.9133759	0.09
158.0129852	0.03
164.9492188	0.08
166.0335236	0.08
169.1091614	0.01
170.1259918	0.10
183.7983856	0.03
186.8768158	100.00
191.9984589	0.22
197.2726593	0.06
198.1658783	0.04
200.0251007	0.04
204.3229523	0.19
205.0268860	0.15
207.3748322	0.17
209.4645996	0.31
210.1144257	0.71
211.2737579	0.08
216.3224335	0.09
218.7517853	0.16
221.6105347	0.84
222.4998932	0.02
227.9250641	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	678.2563
Annotation	Altromycin H
Peak:m/z	Relative Intensity
250.9502106	0.07
280.7985535	0.21
323.1818542	1.91
336.1900635	0.25
341.0757141	0.81
363.1699219	0.04
381.3083496	0.07
383.1036987	0.22
394.9894409	0.08
425.2222290	0.31
443.2567139	0.39
462.8559570	0.02
477.1932983	0.10
485.1984253	0.03
503.2094727	100.00
503.8535156	0.20
531.1592407	0.03
532.2376099	0.03
539.0548706	0.13
557.7269897	0.03
559.0426636	0.57
580.1624756	0.04
588.6352539	0.12
635.0454102	0.84
647.4216919	0.03
660.4811401	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	936.8573
Annotation	Unknow
Peak:m/z	Relative Intensity
299.8552246	1.50
300.6599121	0.94
316.2401733	0.07
358.3025513	0.16
385.2508545	0.14
410.9436035	0.44
413.0202026	0.27
429.0284424	1.63
431.3176270	0.79
432.1364746	0.33
468.3023682	0.19
469.4401855	0.23
486.2269897	0.16
526.2948608	0.14
544.2533569	4.45
545.1923218	0.13
551.3154297	0.07
582.3850708	0.34
629.1895142	0.79
638.5814209	0.49
639.2473755	0.77
654.1055298	0.36
656.1249390	1.18
657.0679932	9.95
658.1953125	3.27
672.1801147	0.23
683.4521484	0.52
702.4338379	0.40
757.3161011	0.23
768.5487671	0.46
784.9059448	0.53
786.0347900	0.66
791.9852905	0.48
836.6188354	0.16
841.3991089	1.28
843.5762329	0.43
858.5219116	0.52
871.3507690	1.58
872.0973511	0.83
877.5991211	0.23
878.8480225	0.19
882.8013916	0.22
891.3356934	3.48
892.1361694	0.28
893.5227661	0.76
894.9437866	1.49
897.7470093	28.52
911.3090210	0.45
912.6611938	0.75
914.5300293	4.08
915.6389771	1.50
917.9879150	1.29
918.7057495	0.12
920.3464355	0.97
922.8547974	0.99
970.6154785	2.26
975.0413208	100.00
975.9431763	6.19
976.7120972	0.62
977.6976929	0.42
979.4230347	0.28
983.9284058	0.16
989.6784058	0.44
992.4489746	0.37
996.2748413	0.49
998.2681274	0.59
1002.6530760	12.00
1003.7747190	1.17
1005.5273440	0.29
1007.0413210	80.83
1007.7844240	5.20
1008.5749510	0.79
1009.8752440	0.52
1010.8920900	0.09
1012.2101440	0.32
1013.2817380	0.76
1014.9812620	0.58
1016.3024900	0.10
1026.6545410	0.75
1030.8123780	1.01
1033.6373290	0.39
1035.3059080	21.97
1036.5035400	1.20
1037.1862790	0.16
1059.7391360	2.06
1064.1145020	30.50
1065.0074460	0.65
1066.2425540	0.21
1077.8200680	0.15
1083.4272460	0.41
1086.0803220	0.76
1091.9317630	0.89
1093.2174070	0.64
1093.9877930	2.70
1094.8266600	0.46
1096.3081050	11.08
1097.3121340	1.41
1111.1870120	0.82
1113.3930660	0.95
1114.1955570	0.67
1119.2266850	0.13
1123.9831540	1.11
1128.6429440	0.16
1141.6339110	0.17
1215.2135010	0.22
1249.9741210	0.32
1269.9221190	0.27
1307.9105220	0.31
1312.5316160	0.21
1348.1058350	0.37
1350.9034420	0.86
1366.9542240	0.24
1391.0626220	0.20
1681.8873290	0.20
1815.0949710	0.27
1871.3275150	0.13
1991.9139400	2.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	452.28
Annotation	Epoxycytochalasin J
Peak:m/z	Relative Intensity
135.221283	2.61
171.0075684	0.79
184.1769104	1.22
201.4097595	0.81
219.1325378	0.56
237.3195648	2.87
273.3029785	1.98
280.0414734	1.34
291.2268677	0.60
298.285553	1.12
311.253418	60.84
315.0415039	0.66
318.2185974	0.73
321.3170166	2.32
324.1783142	4.07
324.8147278	0.96
332.2472534	0.27
349.1011353	0.41
365.3070984	0.74
366.7401428	0.97
375.1858215	0.30
385.4823303	0.84
391.2547913	5.09
394.3698425	2.36
396.5122986	0.47
402.9272766	0.83
404.5588684	2.22
406.3997803	1.45
407.1983643	0.47
422.2228088	1.38
430.8361206	1.28
434.2684021	100.00
435.4615173	2.97
451.4632263	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.87871552	0.29
81.17098999	0.11
95.08547974	0.65
97.03858948	0.15
101.0480499	0.31
102.9550629	1.95
104.9010468	0.96
108.9842377	0.08
119.9160156	0.14
121.1350555	0.74
122.868576	0.87
128.9513702	5.15
129.8720703	0.32
131.9678345	0.15
135.0857086	0.50
137.194809	0.65
138.9300537	0.47
141.0687714	0.11
146.9826965	0.51
150.9154358	61.68
151.980545	2.58
153.1113739	0.68
154.0809479	0.93
155.0919037	1.51
157.1493683	0.29
164.9607697	0.21
167.1675568	1.64
168.3366547	0.76
169.2115021	1.94
171.2615356	0.75
175.2224274	0.75
178.0466766	1.34
179.2588348	1.84
181.2055817	0.43
182.1593475	0.75
183.2001038	0.29
185.1300049	1.41
186.4233246	0.30
188.7521667	0.23
189.5061798	0.16
190.1821136	0.50
193.1661224	0.28
194.1110535	0.65
194.8743286	0.47
197.08284	3.33
198.0891266	1.21
200.0110779	0.19
211.1367645	1.55
217.1244507	3.16
225.1641998	6.77
226.0235596	0.73
235.1846313	3.48
238.1242523	2.96
239.2528839	0.71
244.1338959	0.96
251.2537231	0.17
253.0861969	100.00
254.1373749	19.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1014.5121
Annotation	Unknow
Peak:m/z	Relative Intensity
310.6935425	0.02
325.4858398	0.05
327.2403259	0.10
334.3077393	0.06
367.3333740	0.04
425.6318665	0.01
436.5820923	0.01
438.3415527	0.13
439.2237549	0.22
440.3726501	0.07
451.5192871	0.02
456.2283936	0.02
464.4154358	0.01
467.1065369	0.05
468.4193115	0.05
492.2359619	0.03
493.2257996	0.03
510.3275452	0.03
511.3038940	0.03
528.3920288	0.01
535.3690186	0.20
536.5679932	0.09
546.2546387	0.09
553.3363037	1.55
554.3413696	1.06
555.3740234	0.54
635.5102539	0.01
664.1179199	0.04
666.3762207	0.02
678.3931885	0.18
684.4531250	0.04
685.9934082	0.01
691.4642334	0.08
694.1366577	0.09
704.5523682	0.03
705.1539307	0.01
713.6390991	0.81
714.4816284	0.22
716.4722290	0.06
719.6606445	0.19
728.2153320	0.41
728.9185791	0.35
729.6197510	0.06
772.5590820	0.06
779.6002197	0.10
780.4006348	0.12
781.7114258	0.01
785.1411133	0.09
785.9851074	0.03
787.5657959	0.12
791.0975342	0.05
792.7851562	0.02
793.5406494	0.01
794.6741943	0.09
795.6114502	0.12
799.5698242	0.11
810.6160889	0.06
818.9902344	0.06
824.0244141	0.03
828.6999512	0.07
829.9715576	0.11
831.7338867	0.03
833.5700684	0.17
834.2185059	0.84
835.2210693	0.04
837.4910889	0.03
838.3905029	0.15
842.5467529	3.89
843.1628418	7.30
844.2109375	0.49
851.7861328	0.05
852.6790771	0.05
855.4510498	0.09
860.5885010	0.03
864.8748779	0.03
878.8292236	0.06
880.0500488	0.06
882.6353760	0.03
886.5471191	0.09
887.4943848	0.08
892.3345947	0.14
893.5494385	0.01
894.8142090	0.06
899.4412842	0.27
900.5037842	0.25
908.2255859	0.10
909.0903320	0.19
910.1682129	0.20
913.2974854	0.10
914.4967041	0.03
919.7670898	0.11
922.4340820	0.16
927.0163574	0.03
931.4458008	0.44
932.3303223	0.01
936.1364746	0.12
937.0170898	0.04
939.3529053	0.04
941.0699463	0.29
941.9644775	0.07
942.8729248	0.03
948.7570801	0.04
950.1691895	2.98
951.0579834	0.04
952.1198730	0.05
958.0181885	0.09
961.9736328	0.03
962.8359375	0.18
970.7648926	0.04
972.6103516	0.01
975.7989502	0.27
978.6181641	0.52
982.5035400	0.08
984.6147461	8.24
985.5509033	0.61
986.9353027	0.06
988.3813477	0.16
993.6414795	100.00
994.5512695	2.14
995.5441895	0.25
997.5007324	1.24
998.1833496	0.25
998.8151855	0.03
999.6296387	0.02
1000.6552730	0.07
1006.7070310	0.60
1007.3481450	0.02
1021.4685060	0.08
1037.7915040	0.05
1065.5616460	0.04
1089.6584470	0.04
1099.7756350	0.04
1131.5686040	0.03
1148.5063480	0.06
1150.8571780	0.04
1165.6143800	0.01
1179.2150880	0.03
1188.6408690	0.03
1189.6383060	0.04
1206.5363770	0.11
1208.7077640	0.01
1223.6395260	0.06
1228.6450200	0.03
1231.5419920	0.01
1241.3178710	0.10
1251.0653080	0.07
1251.7636720	0.07
1252.6022950	0.03
1259.1376950	0.07
1260.4433590	0.06
1291.6560060	0.05
1303.1544190	0.17
1304.5998540	0.13
1305.7121580	0.02
1311.6942140	0.02
1322.6051030	0.03
1328.6068120	0.01
1329.9549560	0.09
1330.8238530	0.01
1345.6947020	0.21
1347.4039310	0.10
1348.1790770	0.10
1348.7985840	0.08
1358.4768070	0.01
1370.8635250	0.04
1388.3217770	0.04
1426.7664790	0.04
1431.4243160	0.21
1432.6149900	0.62
1433.5693360	0.69
1434.6986080	0.22
1437.0782470	0.05
1439.6002200	0.03
1440.6678470	0.04
1441.7636720	0.06
1442.7293700	0.07
1456.6912840	0.07
1457.5128170	0.11
1458.6588130	0.57
1459.6732180	0.42
1460.8398440	0.23
1471.0858150	0.02
1475.5302730	0.11
1476.6636960	0.54
1477.6298830	0.52
1478.8840330	0.03
1486.5562740	0.02
1529.3612060	0.02
1530.8399660	0.22
1540.8675540	0.03
1555.6904300	0.08
1556.5592040	0.03
1558.7608640	0.04
1573.6722410	0.08
1575.3582760	0.11
1591.5151370	0.01
1593.1361080	0.04
1658.4133300	0.03
1659.7862550	0.11
1685.7336430	0.04
1703.7108150	0.14
1730.8895260	0.03
1828.5192870	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	165.06
Annotation	Unknow
Peak:m/z	Relative Intensity
58.6754150	0.01
69.8631592	0.01
100.9461212	0.40
103.0473175	0.01
104.8476410	100.00
105.6178436	0.01
118.9801941	0.06
122.9918365	3.52
124.0281219	0.09
128.9163666	0.05
133.2735596	0.01
134.9880524	0.01
135.8366547	0.01
136.8290253	0.05
137.4659119	0.01
144.5176849	0.03
146.3541260	0.01
147.1079407	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	919.9263
Annotation	Unknow
Peak:m/z	Relative Intensity
284.3922119	0.26
302.0689392	0.69
309.2836914	0.07
318.0516968	0.08
326.3306580	0.05
353.1161499	0.07
365.3341064	0.17
393.1467896	1.11
396.4332886	0.07
411.1663818	0.33
418.3652954	0.13
429.0954590	1.00
449.5018921	0.30
454.1981812	0.23
463.6618042	0.36
464.2752075	2.99
465.3244019	0.40
466.5305786	0.11
473.2168579	0.07
482.3295898	1.63
483.0675049	0.16
484.2418823	0.41
500.1189575	2.85
501.3962402	0.72
518.3131104	0.46
589.3438721	0.29
598.3135376	0.42
626.1631470	0.20
669.3213501	0.16
672.9280396	0.17
677.9650269	0.16
684.0645142	0.57
696.3580933	0.31
697.4241943	0.47
702.4338379	0.28
711.4825439	0.48
714.3841553	0.15
740.4277344	0.10
745.3278809	0.28
746.6205444	0.49
768.3661499	0.17
769.6295776	0.70
773.7628784	0.10
786.6155396	0.29
789.5905151	1.10
791.0966187	4.13
791.9573364	0.20
807.9009399	0.22
808.5078125	3.00
809.1384888	0.11
813.1465454	0.13
814.7839966	0.19
823.5752563	0.07
825.2705078	0.19
845.4511719	0.12
846.7009888	0.67
849.2769775	0.36
855.1285400	1.04
857.6592407	0.52
861.6821289	10.27
862.5331421	0.57
866.2946777	3.29
872.9246216	0.31
874.5645142	0.49
882.8348999	0.15
884.4843140	0.11
885.4416504	0.11
887.8555908	0.80
888.9048462	0.16
892.9710693	0.13
893.6241455	0.47
897.4388428	0.38
900.2670898	0.85
902.0530396	0.93
904.7142944	0.40
906.5083008	5.22
907.2412720	0.56
908.7419434	0.95
914.3253784	0.11
928.5067749	0.12
937.8125000	0.82
939.6828613	0.06
942.9844360	0.20
945.8662109	8.43
946.7576294	0.66
947.8358765	0.18
951.2736206	0.27
977.9497070	0.16
982.7819824	0.25
988.7002563	7.19
989.3533325	1.52
990.8047485	0.54
993.2190552	0.41
998.4682007	0.26
999.9511719	0.30
1001.2555540	0.38
1005.2263180	0.10
1006.0090940	0.28
1016.1788940	0.66
1016.8906860	0.16
1021.5366210	1.56
1022.2373050	0.65
1029.4095460	0.67
1033.4145510	0.07
1047.9331050	3.27
1053.6257320	3.46
1054.2266850	100.00
1055.1398930	6.95
1056.2034910	0.86
1058.8228760	0.43
1071.4619140	0.67
1072.6500240	0.85
1073.9884030	0.26
1077.8104250	12.39
1078.5405270	1.23
1079.9516600	0.17
1103.9494630	0.85
1105.6145020	0.36
1110.5926510	0.52
1114.9311520	0.70
1120.7738040	4.63
1121.4184570	0.92
1122.8265380	0.27
1127.2270510	0.60
1129.0036620	0.11
1133.8187260	0.08
1149.7011720	0.08
1151.1854250	0.65
1154.3828120	6.57
1155.0454100	0.45
1183.6796880	0.92
1191.6770020	0.24
1241.0764160	0.42
1243.5664060	0.62
1281.7261960	0.12
1283.1561280	0.07
1309.7763670	0.13
1311.3001710	0.21
1327.5671390	0.15
1330.4429930	0.59
1347.0670170	0.04
1351.1691890	0.11
1405.9378660	0.64
1406.5805660	0.09
1426.9346920	0.09
1441.9924320	0.79
1499.2303470	0.07
1529.6534420	0.11
1535.5756840	0.16
1543.9196780	0.21
1673.6379390	0.16
1739.3511960	0.24
1740.5008540	0.07
1757.8204350	0.08
1786.6262210	0.27
1788.9880370	0.23
1794.7233890	0.10
1822.7907710	0.16
1827.8812260	0.10
1865.5728760	0.14
1867.8363040	0.13
1962.6535640	0.15
1968.1960450	11.00
1979.0125730	2.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	384.1137
Annotation	Succinyladenosine
Peak:m/z	Relative Intensity
133.8360901	0.18
136.1078186	0.11
155.105545	0.02
156.1367188	0.04
157.1603394	0.04
157.8873749	0.09
162.1055756	0.10
165.9922333	0.04
176.1203003	0.05
177.3313904	0.08
183.0719147	0.05
184.8517303	0.02
187.4204865	0.08
188.0505676	0.04
192.2447205	0.01
206.2142639	0.66
207.2045898	0.03
212.9342346	0.03
222.0876617	0.29
227.6515503	0.15
231.2063293	0.03
233.9098511	0.54
234.5164795	0.03
248.1956482	0.04
249.2146606	0.04
252.0704651	100.00
253.0905457	0.50
255.2724609	0.08
265.3391724	0.02
267.1202393	0.04
281.0955505	0.12
284.9091797	0.04
293.0350037	0.04
300.234436	0.02
308.0926819	0.03
309.0484619	0.06
310.3841553	0.05
321.2428589	0.03
322.3515625	0.06
323.6324158	0.06
324.7933655	0.05
329.4239502	0.08
338.3188782	0.27
340.1616211	0.08
341.3718262	0.03
342.8453979	0.02
344.3018188	0.10
345.7218018	0.07
349.1026611	0.02
361.32724	0.03
363.6910706	0.60
366.1666565	0.56
366.9060364	0.08
368.1772766	0.53
369.2686768	0.03
374.8453979	0.86
375.6877747	0.03
383.5796204	0.05
391.7090149	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.23171997	0.29
98.96920776	0.06
102.9770432	0.15
105.2137756	0.03
106.979248	2.05
108.9537506	2.16
111.0450592	0.63
114.043045	0.10
114.8435822	0.07
116.7649841	0.56
119.1163635	0.24
120.9980698	6.49
123.0298386	0.53
124.8914032	0.57
128.9706879	0.47
130.1827393	0.12
130.911438	0.51
132.9291687	1.62
135.0822449	7.30
137.1329498	0.59
138.8540039	0.21
140.9871216	0.05
142.9884949	1.26
144.9806976	0.39
147.0031128	0.79
149.0776978	2.21
151.05896	1.69
153.2441101	0.24
155.1646729	0.09
157.062561	3.79
158.154129	0.28
159.0552979	0.46
160.9176788	0.66
163.128418	1.54
164.0641479	0.05
165.1071625	1.48
166.9640808	0.19
167.973465	0.06
169.0354767	1.17
170.2034607	0.11
170.8780365	0.75
173.0209503	2.14
175.0227356	0.17
177.0699615	0.53
179.0826111	0.31
181.1271362	0.17
181.7812805	0.06
182.9634705	2.09
185.3530273	0.03
187.0559082	2.82
189.0817261	0.10
191.0415344	0.46
193.0198822	0.44
195.1949463	0.27
197.1028595	0.49
198.8216553	0.32
201.1320801	0.74
203.3606567	0.06
205.2044067	0.67
209.0783997	0.11
210.1781616	0.18
211.1005859	0.67
213.1572876	0.09
215.0513	0.63
217.1876831	0.22
219.0639648	0.11
223.1839294	0.76
225.0458679	0.29
228.1252136	0.10
229.019043	0.81
231.1494141	0.73
233.0201416	0.70
235.1115112	0.03
237.2935486	0.06
237.9498291	0.04
241.1258545	0.11
242.0878296	0.03
243.1581421	0.35
245.1741333	2.09
247.2485962	12.34
248.1234131	0.03
251.2051392	0.39
253.1763916	0.10
255.2565918	0.14
257.1341858	0.24
259.1999817	3.05
263.158844	0.05
265.3410645	0.25
267.2649536	0.03
269.0901184	0.29
271.2359619	0.23
273.3658447	0.32
277.4032593	0.09
278.4062195	0.07
279.1222839	0.14
280.1828003	0.28
281.2490845	0.39
282.3270264	0.05
283.2467957	0.08
284.4335327	0.05
285.3802795	0.07
286.627594	0.13
287.3771362	0.20
295.17453	0.96
297.2314453	0.19
298.2425537	0.12
299.2747192	6.04
300.0275574	0.06
305.2998962	3.73
306.1564941	0.08
309.3380127	0.08
310.1330872	0.16
313.2432556	1.07
314.0992126	0.10
323.2327271	100.00
324.131073	0.06
332.3027954	0.34
340.6924744	0.42
341.3008728	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.77364349	0.12
104.8977203	0.22
106.9819794	0.86
108.9496918	1.32
110.9621811	0.07
114.9908752	0.19
116.8638	0.80
119.1791763	0.14
121.0021286	1.67
123.1801453	0.04
124.9050293	0.40
128.946991	0.14
130.0585327	0.04
131.0633087	0.79
132.9617004	0.64
135.0273743	2.30
136.1965332	0.15
137.140976	0.68
138.8735046	0.06
140.8388824	0.65
143.0439758	1.96
145.002655	0.67
147.0921631	0.58
148.9628906	1.49
151.1170044	0.32
151.9809875	2.20
153.0766754	1.08
154.2174072	0.05
154.9852295	0.27
157.021637	1.81
157.9004211	0.07
159.0604248	0.83
160.9207153	0.39
162.0408325	0.04
163.1096191	0.55
165.0382385	3.00
166.1377258	1.00
167.0368042	2.54
167.9588928	0.44
169.0919952	3.40
169.9591522	0.10
171.0410156	0.36
171.7802582	0.04
173.0875092	2.18
174.9533997	1.48
175.9436035	0.10
177.2178497	0.30
178.9620514	0.68
181.356842	0.38
183.0590057	1.68
183.9769897	0.04
184.9709778	1.44
186.1190948	0.37
187.0418549	2.40
189.1334229	0.51
191.1192322	0.71
193.0946655	0.37
195.0819397	0.14
197.1516724	0.48
200.0147095	0.04
201.2101746	0.78
203.1068115	0.31
205.1474304	0.98
207.1249695	0.37
208.2356262	0.03
209.0222473	0.31
210.7137451	0.55
211.3305359	0.25
213.1418152	0.08
215.0433044	2.77
216.168335	0.59
217.2261963	0.34
219.0683289	0.54
220.7267151	0.04
223.197052	1.58
225.2460938	0.20
227.2011414	0.55
228.1363831	8.05
229.0161743	16.14
230.0819702	1.49
231.1435547	0.07
232.1359863	0.07
233.0778198	2.79
234.0778503	0.29
235.1014709	0.11
237.2732544	0.18
238.0864258	0.02
239.063324	0.24
241.223938	0.50
242.3023376	0.38
243.2138672	1.38
244.2275391	0.37
245.2790222	1.21
247.0473633	11.26
248.0822754	1.78
249.4456787	0.10
251.0456543	1.18
252.3425293	0.28
253.1604004	0.30
254.9588318	0.10
257.3186035	0.67
259.1937866	0.33
261.1594238	0.40
263.1203003	0.21
265.1968079	0.89
266.1379395	0.16
267.3585815	0.07
269.2310791	0.18
269.8417664	0.16
271.2678223	0.34
273.1968079	0.24
275.0957642	0.03
277.2160339	0.61
278.5005493	0.26
279.2887878	0.40
281.250061	0.14
282.1003723	0.03
283.1268616	0.22
285.4928894	0.10
287.2762146	0.36
288.673584	0.16
292.0210571	0.08
293.5457764	0.04
295.1917725	2.20
296.4645996	0.15
297.6429443	0.05
299.2952271	1.62
303.3141174	0.11
305.1575928	5.63
306.1007385	0.14
306.9524536	0.08
310.0971985	0.05
311.5917969	0.03
313.2791138	2.22
323.2392883	100.00
324.1318359	0.37
324.754425	0.21
325.9673157	0.02
332.1201172	0.07
340.9511414	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.995285	0.37
106.8877106	1.40
108.9354401	2.27
111.0881119	0.22
112.9398956	0.06
117.0800781	0.20
118.7324905	0.21
121.0314789	3.39
122.0203629	0.21
123.0971451	0.86
127.1159058	0.07
130.862854	0.57
133.1549225	0.51
134.9780121	4.07
137.0207825	0.42
139.0494232	0.13
141.0180817	0.21
143.009613	1.06
145.196106	0.71
147.048584	2.34
149.0098267	2.51
151.1024017	0.52
152.2042847	0.13
154.0117798	0.06
155.1588593	0.16
156.2633972	0.21
157.0240173	0.90
158.916626	0.21
161.0295715	2.10
163.1498413	1.90
165.0116272	0.86
167.0498962	0.49
169.0053711	1.61
171.0588989	0.29
172.067215	0.08
173.0812531	1.31
175.0823975	1.12
177.1893005	0.31
179.3753357	0.45
181.1194611	0.09
183.0522461	1.18
187.0481262	1.83
189.0688782	0.58
191.1103058	0.39
193.2792664	0.30
195.0089111	0.12
197.1257324	0.75
200.2513733	0.15
201.0882874	0.62
202.7592316	0.73
205.1763306	0.87
207.2542419	0.09
209.1731567	0.25
211.0072021	1.09
213.1228943	0.52
214.9676819	0.28
216.250061	0.11
217.2124329	0.47
219.3001099	0.29
221.1645508	0.05
223.2857361	0.17
225.273407	0.33
226.4013062	0.25
227.097168	0.55
229.0839539	0.30
231.1474609	1.26
233.0429993	0.16
235.0761719	0.69
237.0068054	0.07
239.2718506	0.36
241.1697083	0.67
242.1576843	0.21
243.277771	0.33
245.1676025	1.40
247.1722412	6.70
249.0828247	0.33
249.9925537	0.13
251.2164307	0.27
252.6304932	0.72
253.2694397	1.12
254.2299805	0.15
255.2819824	0.16
256.7890015	0.28
257.4727783	0.16
259.2161865	0.68
261.1474609	0.04
263.3223267	0.53
265.2251282	0.13
267.184967	0.12
269.4565125	0.11
271.0684814	0.20
273.2025146	0.06
275.0778503	0.07
277.0097046	0.23
278.8167114	0.05
280.4118042	0.29
283.1942139	0.69
285.2997437	0.36
287.371582	0.46
291.9210815	0.15
293.710083	0.29
295.2583923	1.42
297.2719116	0.16
297.8996277	0.18
299.1958008	2.50
299.9637451	0.38
305.1807861	4.84
313.1350098	1.18
323.2372437	100.00
324.1347656	0.20
331.981781	1.35
334.5330505	0.14
341.0817566	2.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	785.16
Annotation	Unknow
Peak:m/z	Relative Intensity
244.1647339	0.17
246.0774231	0.92
256.0139465	0.12
262.5202332	0.07
284.1941528	0.06
299.5395813	0.16
301.3234253	0.24
311.0222778	0.09
312.1320190	0.27
328.8827515	0.16
356.9848022	1.07
358.4055786	0.15
374.4455566	0.50
375.3963623	0.08
386.2523193	0.07
391.1175537	0.14
397.5007324	0.20
404.4524536	0.29
408.2799072	0.24
411.5497437	0.10
413.3704224	0.13
437.0507202	0.32
438.1980591	0.08
442.4002686	0.15
444.2317505	0.15
446.2233887	0.14
449.2116699	0.20
450.2973022	0.18
455.3793335	0.25
457.5267334	0.06
469.4723511	0.13
470.2713013	0.10
482.8445435	0.60
484.9156494	0.08
489.4251099	0.54
490.1538696	0.06
502.3526611	0.18
507.2474365	0.07
507.9911499	0.06
520.4131470	0.13
524.4955444	0.29
527.2090454	0.13
528.2230225	0.17
531.4698486	0.36
537.4061890	0.12
540.2521973	0.28
543.9249268	0.13
550.2904053	0.18
566.8212280	0.12
567.4929810	0.27
580.6567993	0.23
585.3122559	0.22
586.4429932	0.74
594.4689331	0.26
598.6016235	0.23
602.7811890	0.38
604.2330322	0.89
606.9595337	1.09
614.5269165	0.26
615.6632690	0.20
617.4313965	0.15
620.4458618	0.75
622.3974609	0.36
627.6986694	0.64
629.2890015	0.10
631.1968384	0.11
637.5848999	0.35
639.4650269	0.21
640.1397095	0.12
647.0894165	0.07
648.0078735	0.09
651.5913696	0.10
653.0050659	1.41
654.6587524	0.11
655.4401245	0.79
656.4997559	0.56
658.8430786	1.15
659.7620239	0.41
662.3706665	0.51
663.7156982	0.50
664.6115723	0.07
666.6632690	0.93
668.6369629	1.48
670.1870117	0.21
672.7610474	0.65
677.0548706	0.74
678.3587646	0.63
679.1619263	0.15
683.0485229	0.81
684.9620361	0.74
686.0693970	0.26
688.3152466	0.60
691.4805298	0.90
692.1958618	1.36
693.7296753	0.36
694.4019775	2.23
695.2539062	0.07
699.2776489	0.06
700.5088501	0.80
701.1484985	1.42
702.2116699	0.33
703.0793457	0.77
704.7728882	1.77
705.9927979	3.34
706.6834717	0.27
707.7214966	0.59
708.9774780	2.28
710.1299438	0.75
711.3399048	0.97
713.0324707	1.43
713.7135620	1.39
714.7122803	0.20
715.4142456	0.30
716.4103394	1.32
717.3568726	0.16
718.9801636	7.23
719.8311768	0.51
720.4713745	0.13
721.3603516	0.20
723.3449707	9.68
724.5106201	1.92
725.8928833	0.58
726.6287231	0.72
727.5722046	0.23
729.8069458	3.48
731.4936523	0.15
733.8101196	1.47
734.6552124	2.27
735.3762817	1.17
736.0548706	0.85
737.0942993	0.54
737.7245483	0.56
739.7058716	1.27
740.5971069	3.25
742.7520142	1.93
743.5001831	3.39
744.7444458	27.26
745.4081421	5.23
747.1893921	11.97
747.9086304	4.24
748.6097412	1.24
749.4404907	0.33
751.7180786	29.02
752.7028809	3.36
753.3807983	0.98
754.7118530	0.68
755.5374756	0.50
756.4048462	0.75
757.1776733	0.10
758.0175781	0.07
758.6760864	0.51
763.9494629	0.43
767.8834229	1.21
768.5679321	0.74
769.5473022	0.71
770.5285645	0.04
771.5074463	0.39
772.8566284	0.83
773.8767700	1.02
776.0736694	1.17
779.4428101	0.48
788.5668945	0.72
789.4400024	0.08
794.7800293	0.13
808.0137329	0.85
808.8071899	0.21
814.1503296	1.04
814.8607178	0.12
816.0402832	0.55
817.1659546	0.82
821.3858643	0.17
822.3169556	0.18
826.2213135	10.23
827.1537476	5.24
828.0498657	0.10
831.6136475	0.60
836.1633911	0.53
836.9899292	0.67
838.5838013	0.26
839.7453003	0.66
840.9857178	0.10
844.2088013	0.46
845.3499146	6.33
846.1746826	1.12
848.1294556	0.36
850.9492798	1.35
855.3450317	0.46
857.6486206	0.63
858.7560425	1.13
864.2850952	0.30
867.6309814	0.39
868.6932373	0.90
870.2326050	0.33
872.5825806	1.01
873.5567627	1.32
878.7640991	0.66
881.0903931	0.25
883.1162720	6.56
883.8273315	4.62
884.7009277	0.58
885.4394531	0.13
888.5682983	0.59
889.4032593	0.15
890.4380493	1.07
891.0839233	0.56
892.2236938	0.90
892.9931030	0.15
898.5117798	0.45
900.8964844	0.14
901.9235229	0.67
906.7982788	0.06
907.6786499	0.06
909.4282837	0.36
910.2786255	0.13
911.6384888	0.50
914.2304688	0.42
915.5526733	0.50
916.4248657	0.57
919.0422974	0.21
919.6713867	0.28
920.5036621	0.49
921.5178223	17.15
922.4369507	2.72
923.3789062	0.37
924.6394653	1.06
925.9514771	0.80
926.6985474	0.50
929.7866821	0.68
930.8190308	0.64
931.7828979	1.84
932.6250610	1.06
934.5020142	0.81
935.8225098	0.48
936.5051270	0.96
937.4295044	0.24
938.7160645	1.79
939.9580078	1.92
940.6967773	0.41
941.4386597	0.75
945.3364258	7.69
946.3325806	1.22
947.8457031	0.36
949.5873413	1.25
951.4436035	0.33
953.2294312	1.11
954.1277466	0.39
956.6952515	0.45
958.2665405	1.62
959.0381470	1.02
960.2543335	0.55
961.3018188	0.25
964.2227173	53.29
965.1769409	6.71
965.8632202	0.26
966.7905273	0.13
968.7871704	0.69
971.1171875	0.46
972.9289551	1.48
974.8461304	0.34
975.5812988	0.72
976.6582031	0.99
977.3462524	0.06
978.1488647	0.69
982.7395020	0.25
983.7824707	0.17
991.4094849	0.28
992.5516968	2.69
993.4890747	1.41
994.2177124	0.84
995.8392944	3.45
996.4897461	5.30
997.5161133	2.31
998.6723633	0.27
1001.8942260	100.00
1002.7172850	23.08
1003.6911010	1.17
1004.9606930	2.02
1005.8270870	1.10
1006.6613160	0.36
1010.7766110	0.26
1019.6234740	3.45
1020.4730830	1.97
1021.3261110	0.44
1027.1134030	0.64
1028.6159670	0.35
1031.5454100	0.23
1032.7119140	0.16
1039.7509770	0.85
1040.5672610	0.42
1048.8020020	0.12
1051.6777340	0.42
1056.5147710	0.27
1057.2407230	0.14
1060.7197270	0.20
1068.5877690	0.35
1071.7282710	0.30
1088.4711910	0.22
1091.3107910	0.40
1093.1425780	0.11
1104.0369870	0.26
1105.0690920	0.12
1108.5816650	0.16
1110.6635740	0.08
1111.5529790	0.84
1112.5854490	0.30
1114.4991460	0.39
1118.6000980	3.09
1119.8454590	0.67
1123.8122560	0.48
1124.8227540	0.45
1125.6862790	0.37
1126.4293210	1.10
1127.6195070	0.22
1132.5133060	4.12
1133.4353030	0.71
1134.4899900	0.43
1135.9873050	0.15
1145.2607420	0.27
1149.3288570	0.23
1152.0302730	0.32
1165.8859860	0.34
1180.4267580	0.56
1182.0614010	0.10
1183.2121580	0.20
1183.8750000	0.81
1210.9455570	0.09
1211.7829590	0.07
1218.8111570	0.15
1221.9428710	0.30
1222.6818850	0.21
1225.8237300	0.39
1240.6951900	0.66
1241.6484380	0.17
1257.5777590	0.16
1260.8052980	0.64
1261.8068850	0.36
1263.0976560	0.18
1267.0748290	0.32
1281.6324460	0.07
1288.1137700	0.47
1323.8446040	0.36
1325.8326420	0.23
1336.4870610	0.06
1344.5639650	0.82
1347.8822020	0.12
1352.1114500	0.31
1352.8227540	0.30
1353.6623540	1.25
1354.4818120	0.42
1355.3883060	0.24
1365.6414790	0.07
1371.8575440	0.08
1389.9566650	0.10
1404.0600590	0.06
1423.0034180	0.12
1472.9005130	0.29
1531.3574220	0.26
1548.3807370	0.15
1578.7248540	0.20
1586.9357910	0.18
1588.1365970	0.11
1632.8464360	0.33
1653.1121830	0.25
1668.2877200	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.77024841	0.06
99.19958496	0.03
100.8727875	0.05
102.983139	0.06
104.9405136	0.19
105.9626846	0.09
107.0008469	1.38
109.0396729	2.44
110.977417	0.58
116.8482742	0.27
119.3379822	0.12
121.0369797	4.24
122.9977112	1.09
124.9057312	0.25
125.8344421	0.22
128.958374	0.31
130.7922058	0.50
132.9531555	0.38
135.0696564	3.43
137.2820282	0.22
140.911026	0.19
143.0484924	1.68
145.1845703	0.24
146.9711151	2.28
149.027771	1.53
150.8316345	0.24
151.4420166	0.42
155.0710449	0.06
157.1108856	1.65
159.0119324	0.39
160.985199	2.23
162.9458466	1.08
163.9251709	0.18
165.1608276	0.55
165.7878113	0.12
167.1707458	0.08
169.1324463	1.46
171.0142517	0.34
173.0160522	2.19
175.1114655	1.65
175.7798615	0.03
176.8496552	0.57
181.0917053	0.24
182.0783234	0.08
183.0103607	0.60
185.1524811	0.37
187.1441345	0.85
189.140625	1.86
191.1809235	0.13
197.0635376	0.49
199.3745117	0.42
201.1159668	0.88
203.1391907	0.76
205.0776367	0.35
207.1371307	0.16
209.2733765	0.31
211.1547546	0.63
213.1788025	0.35
215.2207031	0.33
217.1352234	0.82
218.2227173	0.08
221.1296387	0.03
223.1698303	0.98
223.9759521	0.08
225.1285095	0.37
227.2571716	0.16
228.8640442	1.03
231.1605225	1.16
233.1864319	0.16
234.2224121	0.13
235.4129028	0.09
237.1235962	0.29
239.0394897	0.31
241.0983276	0.46
242.1594543	0.07
243.2852173	0.41
245.0852051	1.75
247.1987915	5.70
249.056488	0.04
250.1549377	0.16
250.9440918	0.67
251.6470032	0.52
253.1605835	0.20
254.2474365	0.11
254.9888306	0.05
257.1965332	0.20
259.1401062	1.24
263.2238159	0.30
265.1367798	0.11
267.3817444	0.16
269.2601624	0.20
271.211792	0.51
273.3434753	0.18
276.5221558	0.06
277.1903687	0.62
279.0854187	0.03
281.243103	0.46
283.3994751	0.52
285.120636	0.56
287.2058411	0.32
290.1155701	0.21
291.3912964	0.06
292.291748	0.09
293.2216187	0.05
295.2730713	1.43
296.985321	0.49
299.2765198	1.35
299.8947754	0.08
301.0030823	0.06
305.3218384	2.82
307.3056946	0.05
310.1767883	0.04
313.1968079	0.28
314.2584839	0.16
323.2473755	100.00
323.8545532	0.68
324.5416565	0.28
332.1005859	0.19
341.1872253	1.04
342.3414307	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
104.9674988	0.25
109.8175812	0.12
129.923584	0.10
148.9283447	0.53
158.9982758	0.24
167.3067474	0.15
168.9653473	0.17
174.3366547	0.24
178.9562836	0.19
179.930481	0.45
181.3752899	0.10
182.9137878	0.21
193.091507	0.43
194.0200958	0.35
195.1386566	0.54
207.0024109	5.30
208.141037	1.41
209.1051941	0.61
221.020462	0.19
222.0337982	2.22
222.981369	3.30
224.0977631	0.26
233.0097656	1.59
234.2118988	0.10
235.2393646	0.19
236.185257	0.25
251.0668945	100.00
252.1153717	15.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	367.1603
Annotation	Unknow
Peak:m/z	Relative Intensity
106.8991089	0.04
126.9080048	0.02
133.0100098	0.01
143.0598297	0.04
160.9279938	0.04
167.9582520	0.03
171.1901550	0.02
173.0712433	0.12
177.3204651	0.05
183.2002869	0.07
184.9250488	0.06
186.7657776	0.02
189.3489685	0.04
192.8223267	0.17
209.2030945	0.02
211.4071198	0.05
213.2436829	0.03
218.1358032	0.08
223.1774292	0.08
226.1702576	0.02
229.1864319	0.05
233.0128784	0.12
237.3365173	0.02
249.0485840	0.02
253.2298279	0.05
260.2773438	0.05
267.1640625	0.04
273.2531128	0.04
277.0049744	0.22
277.7092896	0.03
278.5587463	0.05
279.1896667	0.05
281.0351562	0.01
284.9672546	0.01
286.3911133	0.06
287.2545776	0.02
288.4340210	0.06
293.3248596	0.09
296.1892090	0.03
296.9180908	0.06
304.3166199	0.04
307.0263977	0.05
307.9462585	0.05
309.2554321	0.07
313.1461182	0.07
315.1121521	0.02
318.1377869	0.04
321.2220459	0.22
323.1097107	0.10
323.9440918	0.12
326.3099976	0.04
329.0380249	0.04
334.9804688	0.02
338.6266479	0.06
340.2550049	0.06
350.1348572	100.00
350.8038635	0.33
351.5628052	0.06
359.3435364	0.07
366.1987305	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	319.0781
Annotation	Unknow
Peak:m/z	Relative Intensity
111.1220551	0.08
162.9086456	0.12
172.9563599	0.03
192.0599976	0.07
195.1558990	0.14
203.2228088	0.02
208.0327454	0.02
215.1049194	0.10
229.4360657	0.03
239.1069336	41.42
257.0146179	0.04
272.9281006	0.03
275.2833862	0.02
276.9863892	0.06
283.1821594	1.37
301.0426941	100.00
302.0015259	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	894.9487
Annotation	Unknow
Peak:m/z	Relative Intensity
265.1204834	0.02
326.2166748	0.38
327.2752686	0.31
345.1723633	0.06
353.1227112	0.02
354.0046692	0.02
397.3203125	0.01
424.2998047	0.03
441.0941772	0.12
443.5548096	0.03
500.4384155	0.16
526.4688721	0.40
527.3337402	0.31
528.4930420	0.04
539.5664673	0.09
544.4505615	0.13
545.3894653	0.15
569.5769043	0.03
570.2177734	0.03
571.3912354	0.03
595.9596558	0.06
598.5039673	0.19
609.2590942	0.06
622.9623413	0.13
647.3314819	0.04
652.5867310	0.04
655.5994263	0.02
671.3082275	0.04
674.3529053	0.02
678.9287720	0.14
689.0064087	0.06
701.0370483	0.46
708.3292236	0.03
709.4300537	0.11
710.6051636	0.03
712.0448608	0.06
722.6131592	0.16
723.7563477	0.13
729.6742554	0.10
731.3286743	0.15
734.0445557	0.04
737.1189575	0.02
748.5762329	1.33
749.2791138	0.06
752.6809692	0.13
757.5160522	2.22
758.2680054	0.09
759.4201050	0.28
761.4898071	0.08
767.1076050	0.03
770.4928589	0.96
774.7822266	0.06
778.9218750	0.22
779.5955200	4.79
780.6909180	0.38
783.8971558	0.15
784.5782471	0.10
786.0800781	0.02
788.6403809	0.12
789.9080200	0.09
790.8303223	0.04
792.8984375	0.65
793.6101685	0.07
799.8522339	0.31
806.9237061	0.04
807.9700928	1.00
808.7418213	0.73
810.1580811	0.07
814.7720947	1.04
815.5374756	0.28
821.0214233	0.44
821.9085083	0.32
823.5299683	0.26
828.1333008	0.20
829.9932251	1.10
830.6250000	0.15
833.4480591	0.17
834.0629272	0.55
837.1983643	0.55
838.1607056	0.02
839.0231323	0.07
842.6910400	12.04
843.6846313	0.91
844.5023193	0.13
847.6147461	0.03
849.4443359	0.09
851.6314087	26.04
852.6248779	1.55
855.6030884	4.11
856.5939941	0.36
862.5901489	0.02
864.4845581	28.97
865.2172241	10.66
866.6957397	0.20
873.0175171	4.30
873.6669922	100.00
874.5418091	5.55
876.2362061	0.09
877.4768677	4.35
878.4942017	0.35
886.5335083	1.15
962.7385254	0.07
963.7614136	0.09
970.7216797	0.02
1019.2382200	0.04
1021.5444950	0.06
1032.6652830	0.12
1074.2828370	0.02
1083.5208740	0.03
1100.0408940	0.03
1118.4262700	0.06
1133.6984860	0.03
1148.4838870	0.02
1176.3964840	0.05
1201.6435550	0.09
1202.4614260	0.15
1203.8198240	0.05
1219.7771000	0.12
1220.5155030	0.21
1222.7802730	0.08
1228.2802730	0.12
1241.1640620	0.06
1246.0646970	0.68
1247.3962400	0.20
1248.0778810	0.05
1263.6048580	0.39
1264.4794920	0.94
1265.5057370	0.06
1270.1273190	0.10
1271.8188480	0.03
1286.2606200	0.06
1303.4377440	0.02
1305.7978520	0.03
1313.7207030	0.09
1314.4353030	0.02
1330.6428220	0.11
1331.7713620	0.40
1332.4637450	0.06
1339.8353270	0.02
1340.6320800	0.07
1342.6496580	0.09
1349.6062010	0.10
1357.7108150	0.09
1358.7227780	0.13
1359.7008060	0.07
1384.2630620	0.12
1385.7288820	0.06
1401.1204830	0.05
1402.2840580	0.54
1403.0076900	0.24
1404.2061770	0.15
1411.0123290	0.15
1446.5233150	0.81
1447.5776370	0.27
1448.8642580	0.02
1464.0682370	0.05
1496.3729250	0.09
1541.4935300	0.10
1626.4320070	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
96.91607666	0.60
107.0360718	0.16
126.8197784	0.25
133.053009	0.09
148.9400635	0.21
149.9847107	0.68
161.1671753	0.43
167.1919708	0.35
169.2544708	0.18
174.2370453	0.13
175.03862	0.08
177.2923737	0.24
179.1635284	0.59
179.8457642	0.55
181.1004486	0.33
183.0128784	0.33
193.1303406	0.77
194.1126862	0.12
195.0686951	0.14
204.9746246	0.22
206.282608	0.93
207.1363831	3.98
208.0161133	4.48
209.0950928	0.42
221.9949188	4.14
223.1259918	5.69
224.1541901	0.73
231.35289	0.32
232.9605713	1.11
236.2689056	0.89
251.0838013	100.00
252.1088257	16.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.971
Annotation	Unknow
Peak:m/z	Relative Intensity
152.1628265	0.02
161.8916321	0.01
189.9775696	0.03
202.0047150	0.22
222.8418427	0.02
226.1380920	0.03
245.2561646	0.02
256.4382629	0.03
260.0659790	0.06
261.9647827	0.03
264.1380310	0.03
270.1618652	0.02
273.1692200	0.01
276.0497437	0.06
286.0060425	0.04
291.1651611	0.01
303.9527588	0.43
305.4639282	0.01
306.0664673	0.06
308.3577576	0.02
309.3079224	0.02
310.2859497	0.02
314.1368408	0.03
316.9486389	0.01
329.7016907	0.23
332.0016174	0.30
339.4437256	0.03
347.8941650	1.22
349.8338928	0.01
358.1203613	0.06
362.1854858	0.05
375.0086060	0.06
375.9248352	0.22
391.5238342	0.03
392.1787415	0.08
393.9815369	100.00
394.6001892	0.19
401.0316772	0.03
402.1401367	0.09
419.8972168	1.41
420.5365906	0.03
428.3156433	0.14
429.3218079	0.04
430.0917053	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	539.1382
Annotation	alpha-Sorinin
Peak:m/z	Relative Intensity
161.0343323	1.32
179.0376282	1.50
217.7888031	0.02
219.1185455	0.02
221.0729980	0.36
250.4057922	0.03
262.9212036	0.07
277.9208984	0.05
280.9393921	1.25
281.6087646	0.02
323.0014038	0.62
328.0817871	0.15
330.0906982	0.07
340.5213623	0.49
341.1243286	5.26
354.2851562	0.03
355.3121338	0.07
359.0701904	0.27
368.8436279	0.06
377.2197876	1.47
383.1785889	2.25
393.1348267	0.05
403.0950317	0.02
406.2940063	0.06
412.8057861	0.09
413.5298462	0.04
425.0976562	2.07
425.6990356	0.03
441.3507080	0.02
443.0620117	7.75
443.7620850	0.02
450.2250977	0.03
465.2978516	0.04
466.9051514	0.08
480.1004028	0.13
485.0960083	0.25
500.3042603	0.04
501.2132568	0.02
503.2801514	100.00
504.1678467	0.06
520.9529419	0.11
521.5674438	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
85.03707886	0.06
92.87553406	0.29
94.99697876	2.45
96.86864471	1.35
97.96076965	0.07
98.99595642	0.79
105.1002655	0.08
107.0978394	0.73
109.112648	2.60
109.8153915	0.16
110.984436	0.74
113.0772095	0.89
114.9633942	0.13
117.0306396	0.20
118.960495	0.16
121.0658951	1.11
121.8257828	0.05
122.9698944	1.60
124.0215225	0.20
124.6939545	0.17
126.9431534	0.12
128.8260498	0.21
130.783844	0.40
133.1184387	0.49
134.9659119	0.95
136.2105103	0.52
137.1097412	0.75
139.0728455	3.02
140.9284973	0.17
142.1761169	0.06
142.9138489	0.15
145.118042	0.39
147.0331726	0.62
148.8577576	0.47
150.9732971	0.86
153.0523834	1.24
154.9570923	1.30
157.2580261	0.05
159.1483765	0.21
160.8747253	0.63
163.1408691	0.13
164.9381104	1.38
166.1190338	0.28
166.9136658	0.53
169.1052399	0.70
171.042572	0.98
172.9824371	0.23
175.0376587	0.63
177.2204895	0.27
178.9783783	0.39
181.1336365	0.53
182.9828796	2.63
183.5893402	0.16
185.2498169	0.69
186.0472412	0.05
187.1716309	0.72
189.2635345	0.19
192.9909668	0.16
195.1962891	1.28
197.0085754	3.64
199.2180481	0.85
201.2003479	0.30
203.119873	0.83
205.1323853	0.09
207.1418457	0.54
209.1915283	1.83
211.1272888	2.56
212.9796143	1.12
217.0187378	0.50
219.2858276	1.59
221.1582947	1.90
223.2362366	0.25
223.9559326	0.06
225.2281189	2.43
227.3214111	0.35
228.9841614	0.23
233.2250061	2.04
235.0368958	0.77
237.2233887	3.89
239.2233887	9.16
241.2924805	0.67
243.2961426	2.04
251.1386108	3.39
252.9641724	1.48
254.1358032	0.12
255.2105103	1.88
259.3911438	0.20
261.2297058	3.52
263.5714111	0.23
268.0493774	0.36
269.1190796	0.29
277.2304993	0.11
279.2241821	100.00
280.3990479	0.71
281.1921997	1.12
283.1359253	0.06
288.2289429	1.34
297.1575928	0.07
307.2582397	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2782
Annotation	LysoPE(18:2w6/0:0)
Peak:m/z	Relative Intensity
134.9001007	0.05
153.0565796	0.13
196.1346893	0.15
214.1038818	1.92
219.2259369	0.09
261.329895	0.18
279.2329407	100.00
279.8493042	0.22
307.1175232	0.11
309.4384766	0.14
344.2168579	0.15
380.4315796	0.03
389.8946228	0.09
403.9980164	0.06
430.2322693	0.29
440.2622986	0.07
447.5090027	0.04
448.1833496	0.03
449.5240173	0.05
458.0496216	0.30
459.2878418	0.04
460.2903442	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.15
Annotation	Procaterol
Peak:m/z	Relative Intensity
93.07440186	0.44
108.9405518	0.30
146.9823456	0.88
151.0106201	0.71
159.0324402	0.50
163.2085266	0.30
167.1093903	0.34
171.8675842	0.18
175.251709	0.15
176.001358	0.42
188.8716736	0.12
190.8412781	0.29
193.1484985	0.92
195.0465393	0.22
197.1972351	0.30
199.8904114	0.42
201.0101013	1.15
205.0220642	0.13
209.0657043	0.55
217.0168762	0.49
223.2930603	0.28
224.8357544	1.10
227.2028503	1.05
228.0177917	0.87
229.1392822	0.50
231.1519775	0.50
242.1831055	0.32
243.1806641	1.25
244.8746948	3.21
245.8689575	0.13
247.1308594	0.32
251.2810974	0.79
253.1702881	22.60
255.135376	4.04
257.1467896	0.47
259.0559082	1.10
261.1830139	0.13
262.121521	0.35
263.0593567	0.50
269.1192932	0.23
271.1521606	100.00
271.7897949	1.43
272.4819031	0.12
273.4784546	1.10
283.0144653	0.58
288.8079834	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	288.9366
Annotation	Unknow
Peak:m/z	Relative Intensity
87.0375824	0.12
114.9609680	0.85
130.9826355	1.87
146.9423676	0.47
159.0769348	8.97
174.9133759	100.00
175.9815826	0.03
215.0535583	0.23
216.8927917	0.08
232.9827576	0.12
243.2072754	0.11
244.9264526	28.94
246.0209351	0.02
260.8616638	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2499
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.89129639	0.15
102.8136749	0.05
104.9002533	1.00
107.0737457	1.58
109.0358124	1.65
111.0234299	1.07
112.9830093	0.14
114.1360016	0.08
116.9540253	1.15
118.1065216	0.05
119.0371704	0.19
121.069809	6.60
122.978714	0.45
124.0047913	0.10
125.084137	0.75
126.9023895	0.24
129.1257629	0.20
130.936554	1.47
131.9708557	0.13
133.0123749	1.37
135.1089935	4.17
136.9504395	1.17
139.1227722	0.09
141.0109558	0.32
142.9834595	6.04
144.9399719	0.93
147.1516418	0.66
149.0181274	1.63
150.9985352	0.68
151.9213867	0.17
152.995636	1.06
155.0226746	1.04
156.9827881	0.63
158.9929199	4.29
159.9616394	0.16
160.9418335	1.60
163.0865173	0.91
165.02388	0.60
166.9675903	2.23
169.0203705	5.96
169.8061829	0.26
170.8925476	0.37
172.9456482	9.79
175.0259399	1.03
177.0767517	1.14
179.0800781	1.68
180.9807587	0.40
181.7104034	0.11
183.0976562	1.65
185.0924377	1.43
187.0391998	3.56
188.9799194	0.42
191.0996399	0.28
193.1866302	0.43
195.0042419	0.77
197.0333862	1.35
199.0901184	0.18
200.9131012	0.34
203.2361908	0.44
205.1221313	1.11
208.9598083	0.07
211.0888672	1.23
213.3426514	0.09
215.2240601	2.21
216.1184082	0.13
217.2013245	0.44
219.5724487	0.44
223.1322327	0.73
225.1173706	0.38
227.2828369	0.75
228.0270386	1.93
229.0313721	4.94
230.2332764	0.63
231.1733398	0.65
233.0729065	0.79
234.2951965	0.32
235.0149231	0.22
237.0472107	0.14
237.6671448	0.05
239.1126709	0.47
241.2006531	0.52
242.2921753	0.05
243.3920288	0.44
244.2935181	0.35
245.1703491	2.52
245.7842712	0.15
247.1054382	8.73
248.300415	0.49
249.2721558	0.06
251.1438599	1.04
251.8566895	0.06
252.9577637	0.55
255.1358032	1.13
257.1873779	0.84
259.4710388	0.40
263.4785156	0.17
265.2345581	0.73
266.8923645	0.29
267.5513916	0.07
269.1625366	0.13
271.3410645	0.11
273.3315125	0.48
277.2185974	1.13
280.1069031	0.09
281.1530457	0.90
283.1303711	0.78
285.3367615	0.40
287.194397	1.36
294.1499634	0.13
295.1875	3.22
297.1469116	0.57
299.249939	1.81
300.1062012	0.20
303.3414612	0.10
305.2269897	4.97
305.8733215	0.19
309.2337341	0.16
310.3168945	0.31
313.4623718	0.63
317.4199219	0.07
320.5237427	0.42
321.1259155	0.19
323.247406	100.00
324.2389526	0.44
335.2372437	0.07
341.0845032	0.44
342.0537415	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.97686768	0.04
104.8666229	0.14
106.9494095	1.57
108.0532532	0.15
109.1326294	1.38
114.7327728	0.27
117.0477982	0.13
118.8188477	0.07
121.0246887	3.54
123.0878906	1.69
124.9590912	1.04
126.9613419	0.07
128.9277344	0.12
130.8627777	0.27
133.032486	0.41
135.0515289	4.21
136.9167938	1.13
139.0977173	0.33
143.0715942	0.72
145.0430145	0.25
146.9451599	2.22
149.1112366	1.53
151.0942993	0.96
153.0657043	0.23
155.0002899	0.35
157.0267334	1.07
159.1089783	0.14
160.9370117	2.08
163.0131531	1.69
165.0761108	0.70
166.0661316	0.07
167.1524048	0.22
169.0714417	0.61
171.1092224	1.17
172.9109039	1.39
175.1681519	0.93
176.4506836	0.25
177.0609589	0.15
178.9959717	0.41
180.9514771	0.22
183.26651	0.76
184.9950256	0.35
187.0444183	0.95
189.0101318	0.37
191.0998993	0.93
193.3732605	0.63
195.0120544	1.08
197.1118774	1.16
197.9220276	0.04
201.0593262	0.95
203.1173859	1.31
205.3221588	0.48
207.0297394	0.25
208.9957581	0.51
211.0777588	0.34
213.0019531	0.40
215.0047607	0.22
217.1373596	1.12
218.8440857	0.13
221.1642151	0.29
222.7815857	0.75
223.3952026	0.08
225.1764832	0.39
226.0620117	0.28
227.1376648	0.51
227.7503967	0.07
229.0267334	0.62
231.1126099	0.97
232.1166687	0.21
232.9526062	0.18
234.199646	0.10
235.137146	0.19
236.1017151	0.10
237.1886597	0.16
239.0855408	0.60
241.2275391	0.24
243.2192383	0.29
244.0681763	0.20
245.1632385	2.13
247.2078247	5.78
248.183197	0.20
249.4792175	0.14
253.2484741	1.34
255.1577759	0.39
257.2808533	0.39
259.2564087	0.98
261.2480774	0.17
263.0511475	0.64
264.9369507	0.04
265.808136	0.13
267.1102295	0.38
269.5032349	0.18
271.381958	0.71
272.8846741	0.08
275.1902466	0.17
277.2824097	0.41
279.3447876	0.06
281.569519	0.78
283.0058899	0.38
285.522583	0.29
287.1352539	0.66
293.3279419	0.59
294.1530762	0.20
295.2550354	1.90
296.0691223	0.17
297.3988342	0.79
298.1737366	0.23
299.1046753	1.98
299.8852539	0.30
302.9762573	0.07
305.2312012	4.18
306.9005127	0.35
310.30896	0.46
313.3480225	0.60
317.4883118	0.17
320.9794006	0.38
323.2313843	100.00
323.866272	0.64
336.5037231	0.16
341.276947	0.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.128
Annotation	Tyrosyl-Threonine
Peak:m/z	Relative Intensity
80.9639893	0.15
83.9283676	1.39
85.0404053	0.16
88.8428421	0.08
89.8942490	0.12
90.7850189	0.03
93.0414200	0.28
95.0556030	0.64
97.1304932	0.22
99.0267105	0.03
101.0806732	0.48
107.1528778	0.04
108.9415283	0.42
111.0851746	0.27
121.0258179	0.05
123.0772858	0.32
125.2364502	0.02
129.9888611	30.54
132.9960938	0.59
135.0029297	0.78
137.0173645	87.09
138.0588379	0.03
139.0430603	0.10
141.2754517	0.10
142.0072327	0.09
142.9700317	0.04
146.9944458	100.00
149.0727844	0.58
150.1846313	0.04
151.1162567	0.35
153.6656036	1.43
154.8298035	0.07
157.9113159	0.07
158.9296722	0.33
163.1648865	0.31
165.1240234	0.57
167.1141357	0.09
169.1262054	0.10
171.1798401	0.17
173.0216675	0.08
176.8912048	0.31
183.3515320	0.05
185.0723419	0.05
186.0997925	0.04
187.1763000	0.05
190.9930878	0.07
192.8482208	0.47
197.1044922	0.08
199.0447998	0.08
201.4383545	0.19
202.0725708	0.33
202.7059631	0.08
206.9052734	0.11
209.1539307	0.20
213.0589905	0.14
213.8190918	0.02
219.9909363	0.11
222.0422363	0.04
222.8349609	0.10
224.2282410	0.07
227.3712463	0.18
237.1116028	0.51
239.0645142	0.23
240.1276855	0.13
241.2174683	0.54
241.9949036	0.02
247.1770020	2.18
254.6392212	0.05
262.3314209	0.03
265.2456055	5.60
266.1555786	1.82
273.9720459	0.56
284.3679810	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	742.3601
Annotation	Unknow
Peak:m/z	Relative Intensity
246.0442810	0.04
294.1231384	0.11
297.9184570	0.06
299.2725830	0.09
307.0972290	0.03
323.3302002	0.03
329.1779480	0.07
331.4482117	0.02
340.0972290	0.08
345.4624329	0.05
346.3961182	0.03
349.3634338	0.02
351.2456360	0.03
357.2245483	0.05
363.1165161	0.03
366.6106567	0.20
369.4249878	0.06
375.4006958	0.04
387.4491577	0.07
402.3317261	0.03
403.0288696	0.08
410.8275757	0.52
411.9815674	0.14
420.8713989	0.03
428.2326050	0.05
436.3903809	0.05
444.3479004	0.05
446.3759766	0.03
451.7838135	0.18
455.2977905	0.11
456.4515381	0.17
457.3653564	0.03
460.9310303	0.18
474.6711426	0.08
491.3083496	0.42
492.3833618	0.24
493.5895386	0.04
495.2881470	0.05
531.3166504	0.08
538.3822632	0.05
539.6145020	0.07
541.2654419	0.06
548.4739990	0.08
550.2210693	0.04
553.3197632	0.15
555.3175659	0.28
566.3071289	0.02
569.6285400	0.06
583.6871948	0.15
584.4219360	0.39
585.4638062	0.05
595.8263550	0.07
602.3516846	0.34
603.3836060	0.12
604.7257690	0.96
605.9872437	0.16
610.2811890	0.07
611.6322632	0.03
617.2073364	0.24
620.3391113	0.84
621.4594727	0.72
622.5966187	0.14
623.3744507	0.04
624.6063843	0.25
625.3510742	0.06
630.6716919	0.05
641.4613647	0.30
650.1264648	1.20
651.3367310	0.15
656.1402588	0.15
657.1809692	0.09
668.5139771	0.04
672.2927246	0.11
673.8058472	3.15
674.8221436	0.24
676.6403198	0.05
679.0556641	0.12
682.7393188	0.22
683.7936401	2.40
684.5547485	0.34
688.5278320	9.29
689.5779419	0.15
692.8840942	100.00
693.9669189	1.79
694.6305542	1.25
695.5380249	0.14
696.4219360	0.20
697.6076050	0.36
698.3831787	0.54
699.1157837	0.34
700.6626587	0.04
701.6459351	0.53
702.7026978	0.02
703.4227905	0.01
705.9689331	0.70
707.3464966	1.00
707.9661255	0.16
714.5100098	0.04
715.5054321	0.09
716.6640625	3.77
717.3349609	1.52
718.8157959	0.05
725.0279541	0.44
731.1583862	1.01
731.9037476	0.27
732.6278687	0.20
733.5275879	0.91
749.3444214	0.16
750.7963257	0.15
752.8598022	0.03
759.6409912	0.68
760.5447388	0.07
761.7579956	0.36
768.1471558	0.05
770.6373901	0.02
771.8040161	0.06
775.1154175	0.25
777.6682129	0.09
780.4557495	0.01
783.0243530	1.67
783.8113403	1.63
784.6519165	0.06
786.3618164	0.07
788.3919067	0.07
793.9094238	0.04
798.0512085	0.56
798.8134766	0.25
799.6703491	0.15
802.3688354	0.14
807.5576782	0.19
809.2824097	0.01
810.3213501	0.02
811.3794556	0.06
816.3973999	0.10
817.5002441	0.17
820.4146118	0.67
821.5145264	0.30
822.6362305	0.37
826.3903198	1.69
827.4575806	0.41
828.6062622	0.05
830.4102173	0.06
831.8373413	0.35
842.6514893	0.07
852.8067017	0.11
854.5677490	0.03
859.0327759	0.12
863.2815552	0.19
865.5554199	0.04
866.3591919	0.11
868.1706543	0.17
869.2210083	0.65
869.8749390	0.08
872.2197876	0.17
874.2780762	2.70
875.1369019	0.53
880.7691040	1.02
881.6166992	0.32
882.3015747	0.16
883.6666870	0.01
885.2994995	0.15
890.8807983	0.40
891.5971069	0.41
892.4212036	0.28
896.4653320	0.07
897.9487305	0.25
898.7572632	0.79
906.1013794	0.07
907.9802246	0.10
911.6054688	0.06
912.6616821	0.05
914.3474121	0.02
915.4205933	0.12
917.4970703	4.11
918.2227173	1.00
919.6299438	0.28
921.4677734	0.10
922.7747192	4.26
923.5109253	47.69
925.1161499	0.28
926.1480103	0.12
926.8025513	0.01
927.9616089	0.13
930.0236206	0.26
930.6266479	0.05
932.2453003	0.15
934.8078003	1.08
935.7272949	0.21
938.6488647	0.03
940.4465332	1.84
941.0617065	15.32
942.4017944	0.16
943.0173950	0.07
947.0068359	0.14
951.3815308	0.11
960.2932129	0.32
962.0679321	0.03
975.2134399	0.52
1001.1659550	0.05
1009.3681640	0.18
1010.1876830	0.66
1011.3781130	0.27
1013.6338500	0.03
1014.4168090	0.04
1015.9462890	0.05
1019.2539060	0.12
1025.0410160	3.08
1026.1416020	0.81
1048.5572510	0.03
1050.8111570	0.04
1060.1685790	0.80
1060.7973630	1.00
1061.8940430	0.67
1074.7497560	4.44
1075.5446780	0.76
1076.1771240	0.36
1079.3588870	0.15
1080.2830810	0.05
1097.4473880	0.03
1098.8612060	0.16
1109.4074710	0.51
1110.3012700	1.15
1111.2996830	0.23
1112.4877930	0.07
1122.4255370	0.07
1126.2214360	0.12
1136.5917970	0.07
1138.9155270	0.42
1139.6947020	0.20
1151.6960450	0.03
1204.1464840	0.04
1205.0549320	0.06
1209.2718510	0.02
1228.3802490	0.03
1239.0386960	0.24
1239.8695070	0.21
1245.4935300	0.02
1299.8496090	0.05
1310.2034910	0.11
1311.7454830	0.03
1368.7384030	0.14
1594.5729980	0.07
1622.7342530	0.13
1629.9333500	0.02
1666.0394290	0.03
1862.0003660	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.1175
Annotation	Phenylalanyl-Serine
Peak:m/z	Relative Intensity
83.8662720	0.24
87.7976379	0.06
101.0921173	0.25
106.8931732	100.00
111.4132843	0.02
116.2519226	0.08
119.9148254	0.10
123.9011078	17.24
127.0505371	0.07
129.9682312	21.86
133.0325317	0.03
136.9135742	0.06
139.0898590	0.02
140.8471832	0.03
146.9738770	42.99
148.8001556	0.26
158.9251556	0.02
162.0089569	0.48
169.0914154	0.08
190.0882568	0.04
193.2012482	0.04
195.1802063	0.04
207.0547028	3.60
207.9725037	0.03
212.1713104	0.17
223.7492523	0.02
225.1030121	0.31
229.9091339	0.02
232.9636383	0.03
236.0023651	19.43
236.8464203	0.01
244.0975342	0.07
253.0276489	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
99.03096008	0.11
101.179718	0.04
105.1044769	0.39
106.9889069	0.88
109.1009521	1.12
111.0135422	0.12
112.760788	0.14
116.8917694	0.40
118.9431915	0.20
121.0139465	3.82
123.0330048	0.62
124.980629	0.43
127.1708679	0.16
129.0140991	0.41
131.0279388	0.34
133.0053711	0.65
134.9892426	3.07
136.0726318	0.10
137.0947876	0.54
139.0720978	0.04
141.1559448	0.30
143.0956421	1.36
145.0079041	0.11
147.0300598	2.05
149.0039825	1.90
151.0094452	0.19
155.1348572	0.11
157.0592041	1.16
158.9714966	0.74
160.8858948	0.78
163.07547	0.63
164.1991119	0.16
165.1461487	1.00
166.6844482	0.39
169.1592712	0.40
170.3362732	0.07
171.0964966	0.44
172.5139923	0.45
173.1191406	1.73
175.1681824	2.21
176.7575989	0.28
178.9095459	0.07
179.6615143	0.12
181.217514	0.11
182.136673	0.30
183.1079254	0.97
184.9632874	0.10
187.0187683	1.63
189.0517578	1.14
190.8970947	0.10
193.1150818	0.62
195.1643982	0.53
197.0581055	0.44
198.9364929	0.42
200.7501068	0.51
203.0122528	0.19
205.2539062	0.81
207.5670471	0.27
210.3728638	0.52
211.0827026	1.15
213.0322876	0.31
215.0734558	0.47
217.0995789	1.56
219.2929382	0.15
221.3316345	0.03
223.0610962	0.73
224.0377502	0.16
225.3973694	0.28
227.1601257	0.84
228.1571655	0.34
229.0906067	0.32
230.307312	0.13
231.1876526	0.38
233.0731506	0.94
235.3850403	0.48
237.428894	0.56
239.3667603	1.02
241.2821655	0.77
243.2309875	0.52
245.1447754	1.86
247.2565308	4.91
251.2732544	0.21
253.0490723	0.36
254.1137085	0.15
255.2088623	1.00
256.7023621	0.14
257.3414612	0.23
259.2581787	0.74
265.4750977	0.05
266.9844666	0.24
269.2371826	0.20
270.3366089	0.19
271.1422424	0.05
277.3723755	0.61
279.2512817	0.23
281.2369995	1.24
283.1076355	0.50
285.3170166	0.61
287.1142578	0.57
293.2554321	0.10
294.328125	0.16
295.1322021	1.06
296.3034973	0.08
297.2309875	0.77
299.2047119	1.10
300.1619873	0.69
305.317627	3.24
307.4685059	0.09
311.525116	0.15
313.1122437	0.94
313.844635	0.20
319.0222778	0.34
321.2301941	0.26
323.2480469	100.00
324.1082153	0.26
325.0652161	0.26
331.7087402	0.08
332.6972351	0.81
340.6456909	0.17
341.3627014	1.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	521.1724
Annotation	Unknow
Peak:m/z	Relative Intensity
160.9572144	1.11
177.1006012	0.03
178.9986115	100.00
239.0698547	0.20
278.1851196	0.04
291.9263916	0.13
298.9864197	0.26
341.1533203	0.95
342.0367432	0.07
350.0177612	0.40
359.4923706	0.05
377.1389771	0.06
385.0792236	0.25
390.3544312	0.05
399.0416260	0.15
423.1842651	0.14
426.1247559	0.04
447.2794800	0.04
455.1879272	0.10
477.0122681	0.09
485.2095947	0.20
501.3566284	0.10
503.4809570	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.1395
Annotation	(+)-Cheimonophyllal
Peak:m/z	Relative Intensity
82.9756470	0.13
87.0745392	0.08
93.0460815	0.04
96.9951019	0.01
101.2760010	0.03
105.0723572	0.03
106.8757706	0.01
111.0083084	0.12
112.9497681	0.07
115.1091080	0.03
119.0140533	0.37
121.0809631	0.30
122.9871750	7.18
125.1102219	0.02
133.0080261	0.39
137.0923767	0.16
138.9689636	0.15
142.9910889	0.08
145.1265564	0.97
147.3125916	0.03
149.0387573	0.04
150.1881104	0.03
151.0728607	0.04
153.0214844	1.59
155.1775360	0.07
159.1524200	0.59
161.0921936	0.04
169.1348877	0.15
171.1062622	10.22
175.1086731	0.40
177.0968933	0.01
179.0747986	0.06
183.8916626	0.03
187.6885986	0.07
189.1224670	4.02
191.2000427	0.03
192.8772583	0.02
201.1289062	5.40
203.2805786	0.04
207.1622925	6.17
209.3084106	0.11
217.3119812	0.05
219.1095581	10.68
221.3134460	0.02
222.9337769	0.15
224.9292908	0.12
235.1753540	0.49
237.1053772	100.00
239.1163940	0.02
242.2251587	0.07
252.9695129	0.22
253.8433838	0.03
255.3037720	0.05
260.8332214	0.08
263.0696716	0.39
264.0194092	0.04
265.2219849	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	922.2215
Annotation	Unknow
Peak:m/z	Relative Intensity
329.0278320	0.61
379.0771790	0.03
439.0735474	0.29
457.2191162	0.44
478.4995728	0.07
498.9660034	0.03
519.2827148	0.05
531.8342896	0.13
556.2755737	0.04
604.4207153	0.32
605.4994507	0.49
613.5437012	0.10
622.3107910	0.23
633.5540161	0.10
681.1613770	0.05
685.9641724	0.06
699.0430298	0.09
707.0028076	0.44
721.3242188	0.22
722.4926758	0.17
736.1514282	0.14
745.1856079	0.36
751.3634644	0.11
754.5438843	0.16
755.4618530	0.16
762.2196655	0.09
769.4874878	0.16
783.7406006	0.24
784.4765625	0.08
787.5719604	0.17
790.8134155	0.41
806.1787720	0.09
811.7843018	0.04
821.4836426	0.56
826.6054688	0.64
827.6702271	0.26
833.5759888	0.24
835.9223633	0.12
838.3293457	0.32
839.4827271	0.14
849.3585815	0.97
850.5101318	0.51
851.6265869	0.08
853.3855591	0.15
857.5646362	0.12
858.2448120	0.47
859.5186157	0.62
860.5720215	0.15
862.2604370	0.09
864.6127319	0.12
865.4899292	1.43
866.1990967	0.15
868.7698975	0.40
870.4837036	0.90
871.2498169	0.17
872.7505493	0.04
883.4939575	0.46
884.6618042	0.19
886.5923462	0.66
887.8551636	0.63
889.6919556	0.57
890.5156860	1.26
891.4443359	0.14
894.8756714	1.18
897.1582031	0.15
899.2306519	0.08
902.6004028	0.05
904.7842407	0.51
907.2944946	0.74
908.3272095	0.35
939.0921021	0.43
939.8869019	0.07
946.5553589	0.02
950.2595215	0.57
952.3803101	0.18
954.0776978	0.16
968.8888550	0.23
970.3622437	0.10
974.8920288	0.09
979.0899048	0.12
979.7345581	0.07
981.5515137	0.07
988.3726196	0.05
994.4851685	1.37
995.1215210	0.12
996.8212280	0.81
997.6071167	0.31
1009.9526980	0.16
1010.6452030	0.07
1011.6398930	0.16
1015.7180790	0.20
1016.9586790	0.29
1017.7278440	0.27
1021.5731810	0.12
1022.7187500	0.33
1024.5935060	0.15
1025.6179200	0.16
1028.6496580	2.84
1029.2944340	0.05
1044.9547120	0.28
1050.2800290	0.20
1051.3747560	0.09
1053.6215820	0.07
1055.8144530	0.10
1057.0554200	0.45
1060.2265620	0.14
1067.2287600	0.13
1067.9785160	0.08
1071.6528320	0.33
1072.7729490	0.52
1074.9077150	0.53
1075.5981450	0.15
1076.3453370	0.05
1077.8457030	1.46
1078.5675050	0.27
1079.4350590	0.20
1082.7060550	0.05
1084.4987790	1.01
1086.7606200	0.13
1092.6408690	0.38
1097.2681880	0.08
1098.2600100	0.43
1099.6109620	0.22
1100.5087890	0.36
1101.8748780	0.90
1103.4904790	0.31
1104.5180660	0.07
1105.1684570	0.33
1109.3159180	0.15
1110.4189450	2.04
1111.1120610	0.64
1111.7299800	0.06
1113.6058350	0.40
1114.6787110	0.39
1115.7061770	0.18
1118.8344730	0.67
1120.2189940	6.80
1120.8254390	7.67
1121.7208250	0.86
1122.9433590	0.46
1124.2761230	0.78
1131.3398440	0.44
1138.0440670	1.33
1139.4633790	0.10
1142.0302730	0.28
1144.2429200	0.32
1144.9614260	0.24
1146.1903080	0.03
1147.5416260	5.84
1148.3940430	1.05
1149.1080320	0.41
1151.2261960	0.05
1153.4559330	100.00
1154.9602050	1.34
1155.6551510	0.99
1156.7705080	0.77
1157.5551760	0.09
1158.8750000	0.40
1160.1923830	0.22
1161.0064700	0.44
1162.2416990	0.77
1166.2836910	0.08
1168.1660160	0.16
1169.3665770	0.71
1170.7238770	0.13
1172.3103030	0.32
1174.9017330	0.42
1175.5817870	0.71
1176.4362790	0.42
1177.9770510	0.57
1178.9660640	0.06
1180.9484860	0.16
1184.1707760	0.24
1187.1080320	3.09
1188.1346440	0.50
1188.8041990	0.31
1192.8713380	0.68
1193.5834960	0.32
1194.4846190	0.10
1195.3232420	0.07
1196.0931400	0.25
1212.5003660	0.04
1223.7054440	0.05
1231.3430180	2.28
1232.0075680	0.77
1232.8339840	0.20
1238.9548340	0.63
1239.9968260	0.25
1240.6521000	0.05
1244.9609380	0.05
1253.8110350	0.09
1258.0390620	0.13
1267.6367190	0.09
1268.6619870	0.10
1284.6519780	0.16
1285.5159910	0.10
1295.6431880	0.06
1296.8253170	0.10
1301.6712650	0.47
1302.8294680	0.21
1305.1420900	4.52
1306.0781250	0.40
1308.4698490	0.10
1309.5926510	0.49
1311.6553960	0.26
1313.7113040	0.13
1317.2457280	0.17
1324.6423340	0.58
1325.6014400	0.10
1332.0985110	0.09
1344.6964110	0.11
1345.7613530	0.17
1353.1856690	0.42
1362.4173580	0.13
1369.5069580	0.41
1372.2620850	0.06
1386.6490480	0.03
1402.6656490	0.10
1418.4198000	0.41
1426.9178470	0.25
1434.8026120	0.05
1440.6622310	0.18
1442.3883060	0.12
1455.7542720	0.20
1459.8557130	0.51
1476.8791500	0.07
1479.0043950	0.09
1481.9565430	0.31
1487.5484620	0.32
1491.0631100	0.11
1492.0919190	0.10
1503.2989500	0.18
1509.5308840	0.06
1511.2833250	0.06
1513.3680420	0.43
1524.0277100	0.27
1535.7283940	0.19
1542.5255130	0.17
1544.1131590	0.12
1549.6519780	0.25
1550.3690190	0.10
1551.6431880	0.43
1552.7316890	0.09
1556.1694340	0.14
1560.1859130	0.16
1570.3494870	0.12
1578.6362300	0.09
1580.6014400	0.08
1581.6751710	0.37
1582.7242430	0.17
1592.0231930	0.34
1594.4158940	0.04
1601.2045900	0.13
1604.5031740	0.31
1610.6297610	0.09
1616.8160400	0.07
1621.3992920	0.30
1622.8303220	0.08
1632.8851320	0.05
1638.8161620	0.27
1649.4686280	0.09
1651.0616460	0.05
1651.7707520	0.06
1665.4552000	0.16
1678.8922120	0.16
1706.1964110	0.24
1707.1662600	0.11
1717.5319820	0.22
1756.3596190	0.08
1760.6744380	0.11
1771.8677980	0.06
1779.5306400	0.04
1780.6922610	0.08
1781.9982910	0.08
1799.4816890	0.10
1803.0101320	0.10
1806.9024660	0.07
1807.5787350	0.03
1809.9797360	0.11
1833.6351320	0.09
1849.8638920	0.13
1865.7620850	0.09
1875.2750240	0.04
1881.1898190	0.06
1888.8977050	0.09
1898.3433840	0.10
1930.4700930	0.05
1940.8673100	0.09
1953.2838130	0.06
1969.6815190	0.17
1984.1514890	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	256.263
Annotation	Palmitamide
Peak:m/z	Relative Intensity
73.9840851	5.29
76.7545471	0.48
78.9627991	2.34
80.8849029	4.49
82.2823868	0.87
83.0522995	4.32
85.0196075	5.11
85.9056244	2.89
87.9363327	100.00
90.9825287	1.20
92.9498367	6.23
93.8679657	0.21
94.9492188	5.20
96.9801483	11.02
98.6063538	0.35
100.0508728	3.91
101.9197693	96.66
102.6796417	0.43
104.8972931	0.28
106.9560547	6.52
109.0060272	4.19
110.4495544	0.67
111.0780487	5.05
113.0576935	0.33
114.0501251	5.86
115.9695282	48.35
121.0812683	6.54
123.0229187	2.18
124.0103302	0.50
124.8882751	2.40
126.0718689	0.27
128.0162811	1.69
130.0473785	19.04
135.0391235	5.32
137.3796234	1.21
139.0259552	0.97
141.9247284	0.42
144.0509186	19.35
149.1479034	5.07
150.9670105	0.49
153.0831909	0.66
154.0829010	0.37
155.2835236	0.16
156.0900421	0.71
158.0826263	14.09
163.1346436	2.90
166.9377899	1.28
170.1320648	0.33
172.1116180	13.77
177.1305695	2.11
178.1739960	0.16
179.1820221	0.13
181.0511780	0.34
184.2691040	0.13
186.2060394	16.61
193.4152679	0.09
195.2503815	0.47
196.4266815	0.49
198.2828827	0.21
200.2243195	11.20
211.2529907	0.47
212.2670135	0.48
214.1287079	10.81
219.1886902	2.75
228.2142181	3.17
237.3364410	0.53
238.2302704	1.81
239.1821442	0.78
240.5198517	0.09
241.1362915	0.63
256.3104248	8.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	613.16
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
176.9469299	0.09
179.1379089	0.04
184.8883667	0.01
189.0279999	0.05
199.0578156	0.04
204.9895935	0.08
208.9904785	0.79
211.0215759	0.69
215.3106689	0.02
216.9123383	0.04
231.1325073	0.74
234.8348694	0.36
243.0808716	0.03
247.2236633	0.05
256.1444092	0.18
257.1823730	0.11
262.0513000	0.15
274.1752930	0.07
279.8735962	0.03
288.0966187	0.31
290.3675232	0.09
298.2060547	0.43
322.1459351	0.11
326.1589966	0.06
337.1980591	0.62
338.1229248	0.14
340.3746948	0.08
355.1979980	85.15
391.2722778	0.21
409.1845093	4.26
421.2738647	0.06
448.7496948	0.10
466.1577148	5.83
467.2870483	0.04
484.1104736	100.00
484.7571411	0.15
485.7169800	0.04
498.4988403	0.03
500.9520874	0.04
502.0092163	0.12
519.4926147	0.10
520.2511597	0.17
523.3527222	0.01
538.1933594	3.52
550.2664185	0.04
570.7847900	0.04
577.2045288	0.10
595.1838989	23.05
596.0025635	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	384.1136
Annotation	Succinyladenosine
Peak:m/z	Relative Intensity
119.8511276	0.09
129.0949402	0.02
130.0881653	0.02
135.7695923	0.39
143.1038971	0.02
156.0342712	0.05
157.2358704	0.03
160.2221527	0.02
161.9290161	0.23
166.1636047	0.13
173.9883423	0.09
185.8830719	0.05
187.0459747	0.08
188.2086639	0.11
192.0392151	0.07
199.0951538	0.09
200.7936859	0.15
204.1667328	0.10
205.9970703	0.73
207.8301849	0.07
217.1733093	0.09
221.3210449	0.13
222.0523682	0.09
227.2260437	0.06
234.1380615	0.46
242.0748291	0.14
246.150116	0.03
252.0630493	100.00
253.1045837	0.39
256.449585	0.03
259.4698181	0.02
268.0758972	0.02
269.0552979	0.09
269.7608032	0.13
270.9287109	0.06
272.704895	0.04
278.1441956	0.03
280.2242126	0.05
282.9458313	0.04
284.9917603	0.03
285.7303467	0.08
294.2813416	0.09
299.3660278	0.03
300.8953857	0.05
305.1430054	0.03
310.5500793	0.02
321.4566345	0.05
322.1188049	0.10
324.1866455	0.08
324.9398193	0.06
333.2858887	0.07
336.9890442	0.03
338.0635986	0.10
339.1209717	0.27
340.3181152	0.18
343.01297	0.34
343.6563721	0.13
346.492157	0.10
348.0184631	0.08
352.1659851	0.02
353.1244812	0.03
356.0565491	0.04
360.9526062	0.08
366.0142212	0.54
367.0712585	0.19
368.3231506	0.12
369.6439819	0.26
371.6642151	0.04
374.7396851	0.21
375.3554688	0.29
378.1389465	0.38
385.1270752	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.23
Annotation	Lactulose
Peak:m/z	Relative Intensity
209.2399902	0.26
272.2767334	0.05
281.0432129	0.13
324.3789062	0.02
339.4876709	0.14
341.2349243	100.00
343.0527954	0.02
359.3815918	0.02
375.3359375	0.02
377.3893433	0.04
401.1341553	0.03
409.2401733	0.04
432.0287476	0.03
442.8338013	0.02
535.8639526	0.09
537.1229858	0.02
553.2175903	0.15
577.8923950	0.11
582.3003540	0.05
664.1757812	0.17
665.0169067	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.93554688	0.05
98.80281067	0.08
104.9456024	0.26
106.9652252	0.99
108.9662094	1.34
110.9044952	0.26
115.0161285	0.07
116.9553986	0.88
119.0618134	0.07
120.9840469	4.03
123.068573	0.97
124.7769623	0.09
129.1370697	0.34
130.953064	0.48
133.1014557	0.74
135.0936584	3.28
137.1081848	0.65
139.0130615	0.21
141.1265564	0.14
142.9181519	0.75
143.7333984	0.12
145.0158997	0.36
147.0524597	3.16
149.0559998	3.85
151.1115417	1.06
152.1510773	0.15
153.0513	0.20
155.0674744	0.38
156.9826355	1.25
159.0305786	0.43
161.0288086	1.78
163.062851	1.72
165.1444397	0.55
167.0521393	0.36
168.0760193	0.19
168.9963074	0.71
172.959259	1.15
174.5552979	0.27
175.1762695	1.14
177.1822205	0.72
179.124527	0.32
181.0552673	0.38
183.0588379	0.62
185.105545	0.26
186.999588	1.07
189.2105103	0.56
191.2048645	0.94
192.972229	0.27
195.1266785	0.43
197.1064453	0.46
199.1002045	0.20
200.9009552	0.67
201.5553741	0.07
202.9878693	0.17
204.0756073	0.29
205.128418	0.24
207.0783997	0.06
208.9853821	0.48
209.8728027	0.11
211.0224915	0.45
213.0886841	0.40
215.0432739	0.48
217.1845703	1.95
219.3348999	0.26
220.1216125	0.20
220.9530029	0.25
223.0787964	1.40
224.9656677	0.18
225.8049927	0.16
227.0192871	0.46
229.0198059	0.40
229.9130249	0.17
231.3127441	1.56
235.1958618	0.31
237.9005737	0.15
238.8827209	0.21
240.0657654	0.15
241.0314636	0.84
242.3646851	0.20
243.1363831	0.65
245.1911621	1.55
247.2364197	6.46
248.2012634	0.08
250.2472229	0.11
251.2850342	0.27
253.2468262	0.64
254.0882568	0.07
255.1894531	0.44
256.3168335	0.05
259.1952515	0.58
260.6862183	0.26
263.2523804	0.06
267.2173462	0.69
269.1542358	0.38
271.1838379	0.54
273.2605591	0.09
274.7522278	0.19
276.2513428	0.22
277.1000977	0.19
278.9171753	0.26
281.1610718	0.65
283.229187	0.82
285.2514648	0.93
287.337677	0.15
294.2250977	0.14
295.2492065	0.41
296.6606445	0.22
297.3197021	0.71
299.2972412	1.96
300.2294312	0.40
303.4655762	0.21
305.1539307	3.11
306.8496704	0.16
310.5016785	0.05
313.4768677	0.65
323.244873	100.00
324.2484131	0.36
325.4428406	0.35
341.2709351	1.19
342.5811157	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	838.36
Annotation	Unknow
Peak:m/z	Relative Intensity
242.0005341	0.13
255.3851929	0.17
261.1964417	0.22
279.0452576	0.54
282.0865784	0.13
290.4205322	0.23
307.4325867	0.18
312.3821411	0.46
323.1173096	0.16
325.1373901	0.43
337.2166748	0.27
355.0087280	0.17
389.4462891	0.42
395.3972778	0.10
426.3154907	0.25
431.5031738	0.20
453.4583130	0.30
462.8078003	0.32
464.3977661	0.40
486.9704590	0.45
490.3136597	0.31
492.8747559	0.09
494.1099854	0.09
495.0708008	0.30
498.5297852	0.16
500.9052124	0.17
519.9829102	0.11
533.1738281	0.16
550.0878296	0.36
554.2864380	0.26
557.4318848	0.07
558.3020630	0.20
563.2556152	0.14
571.3557739	0.37
578.2893677	0.25
589.6226196	0.21
599.5584106	0.59
613.3914185	0.46
614.6221924	0.18
619.3579712	0.06
621.4768066	0.20
622.6926880	0.30
623.5620117	0.15
624.3843994	0.29
629.3622437	0.10
631.8359985	0.47
641.4685059	0.80
645.1130371	0.14
647.3801880	0.33
662.9492188	0.08
664.3743286	0.14
665.9036255	0.31
669.4136353	1.08
671.4568481	0.08
673.0153198	0.23
677.2079468	0.23
679.2351074	0.27
694.4550171	0.27
697.5714722	1.97
698.2552490	0.23
701.8453979	0.34
704.3672485	0.06
706.9461670	0.14
718.9509277	0.23
720.5548706	0.31
722.4866333	0.14
726.7742310	0.40
728.1904907	0.21
729.6875610	1.17
730.8021851	0.12
731.5778198	0.10
732.4036255	0.07
735.0391235	0.50
739.4811401	0.49
741.8894653	0.60
748.5833130	0.11
751.1981201	0.18
754.5835571	0.12
756.1774292	0.46
756.7909546	0.45
758.2019653	1.35
759.0419312	0.43
760.5768433	0.88
761.5037231	0.72
764.8016357	0.59
765.5792847	0.65
766.2321167	0.77
768.8545532	1.16
770.1378174	2.04
770.7685547	0.12
771.4115601	0.29
772.4010620	4.40
773.3727417	1.03
774.6881714	0.58
777.9024048	0.63
778.5275879	0.79
779.5114136	1.90
781.1589355	0.68
782.4060059	0.31
784.2522583	1.42
785.2311401	0.29
786.4892578	0.39
787.8847656	3.74
788.9073486	4.84
789.5963745	0.04
791.0619507	0.89
792.1054077	5.59
794.4323120	1.66
795.0516357	0.13
796.1497192	0.42
798.8527222	11.12
799.6399536	0.24
801.3409424	2.82
802.7577515	2.74
803.3886719	0.66
804.4526978	1.44
805.5460815	3.35
806.6110229	1.60
807.2261963	0.57
808.7240601	0.48
809.7128296	3.21
810.4059448	4.17
811.7108765	0.45
813.8591309	4.38
817.8761597	0.67
819.5556641	0.24
820.1694336	0.96
820.9746094	1.77
822.4617310	3.15
824.9045410	0.51
827.1445923	11.63
827.8754272	0.51
828.9376831	0.36
840.4129028	0.11
848.3741455	0.12
850.6509399	0.93
856.2274170	0.58
857.4544067	0.30
858.6777954	0.27
860.6673584	0.79
862.8817139	1.69
864.7178345	0.32
866.0900269	0.16
873.1019897	0.20
875.3749390	0.07
878.3220825	0.12
879.6837158	0.43
882.5795288	0.16
886.4499512	0.36
888.0032349	0.08
890.5093384	0.77
891.3628540	1.48
892.0811157	0.24
892.7754517	0.22
894.5801392	0.29
895.9072266	0.34
896.9508057	0.50
898.2024536	0.86
900.0841675	1.75
901.2190552	0.71
902.3333130	0.15
905.9238892	1.45
909.6918945	0.90
910.7234497	0.08
914.7485352	1.28
917.7456665	0.43
918.8095703	1.28
921.8451538	0.83
923.5420532	0.58
925.8987427	0.25
928.4168091	1.82
929.7268677	0.40
930.3784790	1.42
931.9867554	0.90
932.8214722	0.87
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936.3955078	0.53
937.3363647	0.14
939.2528687	1.74
941.2764282	0.74
943.3847046	1.10
946.1244507	1.14
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948.9970703	0.08
951.7532349	0.66
952.4277954	0.66
953.2985840	0.09
955.5756836	1.53
956.4384155	0.38
958.9390259	0.48
960.4572144	1.60
962.4223633	0.91
963.0363770	1.45
965.1022339	1.97
966.2224121	0.83
967.8897095	3.22
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969.4990234	0.06
970.5346680	1.73
971.4050903	0.36
973.5282593	2.52
974.2650757	2.73
975.3128052	1.33
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978.8670044	0.35
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980.2966919	1.51
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987.7092285	0.56
988.5268555	2.39
989.2941895	0.90
990.7528687	0.08
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992.4714355	1.26
993.0866699	0.15
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996.6204224	0.50
998.0000610	1.99
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999.7212524	0.30
1001.3029790	0.64
1002.0996090	1.96
1002.8617550	2.14
1003.5439450	1.85
1004.1767580	0.75
1005.0177610	1.88
1006.0200810	2.32
1007.0493770	3.36
1008.5440060	2.02
1009.3427730	0.89
1010.7133790	1.24
1011.5313110	2.42
1012.6871950	2.10
1013.8905640	0.72
1014.5679320	3.06
1015.7243650	1.22
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1018.1582030	1.82
1019.2771000	2.39
1019.9799190	3.80
1020.8843380	1.49
1021.5039670	1.10
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1024.6591800	2.71
1025.3264160	2.62
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1030.5344240	1.05
1031.6370850	2.30
1032.5147710	1.21
1035.7496340	13.43
1036.7604980	8.05
1037.7709960	0.42
1039.1740720	0.17
1040.2595210	0.54
1041.4639890	4.53
1042.5581050	2.49
1043.6485600	0.99
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1046.4343260	6.73
1047.1329350	0.29
1048.0638430	1.67
1049.5424800	0.53
1050.3771970	0.75
1051.4089360	1.26
1054.4555660	1.00
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1056.8084720	0.16
1057.8591310	1.66
1058.5002440	0.18
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1059.9965820	0.41
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1067.5998540	0.50
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1070.6142580	2.16
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1073.7968750	25.22
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1079.4680180	100.00
1080.4492190	5.90
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1087.6647950	0.73
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1100.3066410	0.25
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1177.2755130	0.12
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1231.8129880	0.50
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1240.0960690	2.85
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1249.1163330	0.27
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1371.8999020	1.75
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1455.5587160	0.19
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1460.2321780	2.10
1460.9919430	1.11
1461.9378660	0.55
1463.1242680	0.23
1465.3548580	0.46
1466.6351320	0.29
1468.6158450	0.91
1469.8471680	0.21
1470.8414310	1.81
1471.4454350	0.14
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1517.0216060	0.29
1518.0772710	0.95
1518.8253170	0.73
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1522.5570070	0.13
1525.8281250	1.90
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1530.6464840	0.16
1536.5435790	0.43
1537.9913330	0.27
1541.0162350	1.02
1543.3482670	0.35
1544.8513180	0.17
1546.1937260	0.92
1546.8038330	0.34
1547.6148680	0.33
1550.8341060	0.19
1552.0811770	0.17
1552.9864500	3.82
1553.8353270	1.75
1554.5882570	0.89
1555.2843020	0.33
1556.4826660	0.25
1560.7465820	0.19
1561.8184810	0.75
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1570.0753170	0.26
1576.3139650	0.33
1582.5405270	0.72
1595.4212650	0.06
1601.8161620	0.16
1625.1208500	0.52
1629.0856930	0.20
1659.4483640	0.14
1661.9132080	0.22
1743.6527100	0.07
1748.1243900	0.15
1766.8376460	0.08
1773.1481930	0.24
1780.2047120	0.18
1785.0731200	0.14
1863.7277830	0.26
1865.6202390	0.21
1866.2877200	0.14
1905.8483890	0.23
1932.8894040	0.10
1946.5964360	0.26
1950.7291260	0.14
1955.4421390	0.12
1970.5964360	0.16
1971.7611080	0.06
1982.5750730	0.09
1986.5227050	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1230.54
Annotation	Unknow
Peak:m/z	Relative Intensity
353.0715637	0.30
389.3507080	0.80
393.4182129	0.52
398.1266785	0.22
439.2951660	3.70
440.9269409	0.57
450.5401611	0.33
457.0848999	0.42
458.1617126	0.27
489.2666626	0.17
494.5100098	0.30
496.2958679	0.64
506.2257385	0.30
510.8999634	1.76
513.3639526	0.64
524.5388184	0.16
525.2909546	0.36
528.3773193	0.45
534.0292969	0.83
542.7947388	1.05
551.1019897	0.49
552.3892822	1.09
553.0554199	0.26
559.0952148	0.35
565.1906128	0.69
570.2792358	0.70
571.0134277	1.42
581.5500488	0.34
585.1335449	0.61
586.6038818	0.55
589.4523926	0.17
597.1771240	0.17
597.8901367	0.30
601.2294922	0.22
604.1678467	0.34
606.3535156	1.81
608.3275146	1.01
615.5203857	1.12
623.3388672	0.33
624.5517578	3.19
629.2471924	0.75
636.1520386	0.37
639.4791260	0.70
641.4848633	1.13
649.6351318	0.14
652.5675049	0.47
654.3725586	0.97
658.4348755	0.20
669.4219971	0.23
670.4980469	0.92
673.4017944	0.73
681.6072998	1.48
685.8792114	0.71
688.2511597	0.96
689.8165894	1.31
697.2086182	0.89
699.2968750	0.64
700.6800537	0.28
705.2789307	0.82
708.5612183	0.59
709.7404175	0.19
710.4398804	0.20
712.4047241	0.38
714.3890991	0.87
716.1787109	0.23
719.4174805	0.80
720.4291382	2.25
721.3551025	0.53
722.0526733	0.20
723.2990723	0.39
727.6092529	0.44
728.2691040	0.23
732.4489746	0.61
733.6427002	0.43
735.2200928	0.89
737.7284546	0.19
738.3773193	0.53
739.2956543	0.96
740.5361938	0.23
741.7922363	1.19
743.6764526	0.50
750.3519287	0.64
751.1649780	1.58
751.7791748	0.17
753.5885010	1.19
754.6915283	0.61
755.8035889	0.56
756.8681641	0.17
759.9104004	0.91
764.6134033	1.37
768.1567383	0.92
771.3492432	0.31
772.3238525	0.35
783.7315063	0.73
786.1205444	0.30
787.7064819	1.11
790.9448242	0.59
792.3803711	0.53
795.2977295	0.70
802.4738770	0.47
804.9749756	0.84
818.2901611	0.64
823.9796753	0.25
826.4879761	0.15
828.7268066	0.39
829.5279541	2.51
831.4134521	0.28
832.3528442	2.21
833.5853271	0.63
834.2325439	0.22
835.3655396	0.58
837.8586426	0.84
840.8411865	1.02
849.2822266	4.30
850.5521240	3.69
857.2735596	1.42
858.3217773	1.15
863.9630127	0.64
866.6641846	0.32
870.2059326	0.28
879.0905762	1.99
880.7575684	0.43
881.5364990	2.13
882.6069336	1.03
883.5523682	0.84
889.3084717	0.85
890.8845215	2.15
894.6992188	0.75
896.0172119	1.50
897.2841797	0.14
898.5798340	0.96
900.6812744	0.75
904.5489502	0.37
905.2769775	0.99
906.3876953	0.46
907.8692627	0.75
910.7489014	0.96
912.8142090	0.73
924.6315918	0.19
928.5911865	0.63
930.7104492	0.20
932.6096191	1.08
933.2373047	0.82
934.3100586	0.85
939.2563477	2.48
950.2307129	0.33
951.2244873	1.35
954.2272949	2.30
955.1989746	0.90
956.3847656	0.58
961.6439209	0.98
963.9185791	1.19
966.1207275	2.68
969.7586670	3.17
973.0659180	1.27
978.1052246	0.76
978.7519531	0.61
979.6182861	0.56
980.4964600	2.06
983.3909912	0.38
984.2641602	0.52
985.1915283	0.87
986.7558594	0.74
987.7440186	1.29
994.3288574	0.41
996.4998779	4.25
997.5609131	5.32
998.4217529	2.51
999.6940918	1.00
1001.8536380	1.12
1004.5826420	0.58
1009.0087890	0.32
1010.4697270	0.65
1011.5123290	0.09
1012.4210210	0.71
1013.4650880	0.45
1020.4439700	2.88
1021.2135010	0.50
1022.5449220	1.01
1023.1784670	1.81
1024.5979000	1.14
1025.5703120	2.58
1027.2902830	0.98
1029.0938720	1.58
1029.7061770	0.60
1034.7810060	2.05
1035.4467770	1.15
1036.7382810	2.56
1039.4407960	1.27
1040.8791500	2.64
1041.8886720	1.55
1042.8781740	0.98
1045.0373540	0.40
1045.9166260	2.48
1047.2991940	0.50
1048.6231690	0.76
1052.0103760	1.60
1053.3814700	0.17
1055.0056150	1.17
1056.4658200	0.81
1057.8348390	1.21
1059.5366210	2.20
1061.9785160	1.69
1063.4672850	0.33
1065.8259280	0.59
1066.8090820	0.61
1067.8371580	0.91
1068.9937740	0.36
1070.2416990	2.00
1071.8715820	1.22
1073.0103760	3.56
1075.4223630	0.45
1077.2583010	3.21
1078.7747800	3.84
1079.5632320	0.76
1080.6000980	0.25
1082.5327150	1.00
1083.1403810	2.69
1084.0217290	1.16
1085.0205080	0.81
1086.9927980	1.45
1088.0629880	3.02
1089.3090820	6.11
1090.1850590	0.22
1092.2562260	6.59
1093.5458980	0.89
1095.3793950	4.33
1097.2995610	2.56
1098.4152830	3.18
1099.4912110	1.03
1101.8642580	0.56
1103.5424800	1.10
1104.9078370	4.32
1105.7141110	3.69
1106.4294430	0.84
1107.2374270	1.45
1107.9567870	3.51
1109.5471190	2.39
1110.6214600	5.79
1111.3177490	4.02
1112.2830810	2.68
1113.1381840	2.98
1114.3054200	2.24
1115.3320310	8.03
1116.5637210	3.51
1118.9255370	5.21
1119.9085690	2.80
1121.0163570	3.43
1122.1660160	5.80
1123.2850340	1.80
1125.0537110	5.77
1125.7354740	0.59
1126.8000490	1.79
1127.4653320	0.34
1128.8580320	1.32
1130.5225830	4.48
1131.2623290	0.45
1131.9595950	2.78
1132.7741700	4.36
1133.4101560	0.62
1134.0451660	3.01
1134.7399900	0.54
1135.5498050	1.59
1137.8381350	18.43
1139.0399170	12.05
1139.9938960	0.95
1140.8642580	0.84
1141.5192870	0.42
1142.3500980	5.62
1144.3869630	16.00
1145.1657710	1.70
1146.0828860	0.53
1147.8225100	11.11
1149.1049800	10.20
1149.7781980	0.70
1150.5395510	3.63
1151.7758790	1.46
1153.3754880	37.96
1154.1022950	17.62
1155.1398930	5.33
1156.2517090	4.91
1157.0252690	1.88
1158.2047120	1.49
1159.7955320	0.14
1161.0761720	0.52
1162.5014650	3.32
1163.1853030	5.86
1164.3796390	0.98
1165.5100100	10.15
1166.2377930	4.69
1166.9871830	1.61
1168.3469240	10.18
1169.0621340	10.15
1169.9089360	1.07
1171.6066890	19.18
1172.4805910	2.66
1173.3581540	1.28
1174.8433840	10.03
1175.7402340	1.10
1176.6113280	4.16
1177.6331790	56.60
1179.1694340	1.95
1179.9658200	2.57
1181.0993650	25.41
1182.0256350	5.42
1182.8637700	1.29
1183.9572750	2.18
1186.9694820	100.00
1188.2323000	2.57
1189.2857670	1.19
1191.5913090	4.43
1192.8803710	21.39
1193.6904300	0.10
1194.4411620	1.43
1195.9888920	1.40
1197.6654050	5.87
1200.0905760	2.21
1200.8730470	0.30
1201.7055660	0.65
1203.1120610	0.63
1203.7143550	5.54
1206.5119630	3.72
1207.1921390	5.87
1209.3902590	49.56
1210.2412110	1.74
1211.1667480	3.47
1212.2556150	2.58
1212.9052730	10.99
1213.8352050	0.62
1215.3304440	8.11
1216.0052490	2.01
1217.0231930	0.50
1238.7128910	0.74
1239.5786130	0.77
1240.8332520	0.36
1242.0263670	1.30
1243.1633300	0.13
1248.9378660	1.18
1250.8338620	0.36
1251.9150390	0.52
1252.7937010	0.76
1257.4886470	2.04
1259.5728760	1.66
1267.2677000	0.86
1268.5070800	1.20
1270.4107670	0.60
1272.3876950	0.10
1275.4101560	0.26
1281.2597660	2.38
1282.7756350	1.38
1285.3426510	1.87
1288.1027830	0.78
1288.9237060	0.50
1290.9378660	0.98
1291.8839110	0.96
1292.6958010	0.85
1296.0272220	0.93
1297.1152340	1.85
1303.1973880	0.85
1304.9219970	10.60
1305.6835940	0.59
1306.8125000	1.04
1308.4132080	1.36
1312.1350100	1.44
1314.2214360	0.31
1315.9993900	0.79
1320.3227540	1.79
1321.3056640	1.09
1323.5618900	0.98
1324.3552250	0.82
1325.6372070	2.04
1326.7209470	2.59
1330.4279790	1.37
1332.4238280	0.92
1334.5738530	0.36
1335.2146000	0.93
1338.6888430	0.70
1339.7546390	6.04
1342.3730470	0.73
1344.4799800	2.52
1347.1909180	0.86
1350.6883540	0.23
1353.1102290	3.71
1353.8082280	0.25
1356.0065920	0.42
1358.3284910	0.56
1360.3215330	1.83
1361.8739010	1.68
1362.4998780	4.21
1363.3596190	0.13
1365.8065190	0.87
1367.2612300	1.11
1369.1759030	4.42
1369.9967040	4.90
1371.0311280	1.32
1371.6782230	0.39
1380.5172120	1.78
1381.5750730	1.36
1382.3675540	0.23
1383.6424560	0.37
1384.6915280	0.44
1385.5252690	2.96
1386.8890380	1.69
1394.4010010	0.73
1395.5648190	1.52
1397.5622560	0.81
1399.2352290	1.22
1401.9661870	1.58
1402.8016360	0.42
1403.9737550	1.99
1406.0599370	1.30
1409.2989500	1.26
1410.6298830	0.22
1411.5560300	0.30
1415.5621340	1.10
1417.5219730	1.81
1418.3190920	1.45
1419.4516600	2.53
1422.7281490	1.28
1423.6561280	3.24
1426.4963380	6.25
1427.5609130	8.34
1428.3961180	0.84
1429.8316650	1.81
1431.1893310	0.77
1432.0351560	0.11
1437.5128170	0.17
1438.3243410	0.87
1439.9823000	2.30
1441.7945560	0.86
1442.6512450	0.34
1443.7387700	1.86
1447.7218020	1.35
1449.6000980	0.63
1450.5296630	2.96
1451.2385250	0.74
1452.3981930	1.79
1453.8846440	0.47
1455.4949950	0.14
1456.9193120	0.51
1457.7546390	1.86
1459.9163820	5.50
1462.8145750	0.73
1464.5015870	1.39
1465.2374270	0.61
1468.0781250	5.01
1468.7818600	2.08
1470.3796390	1.02
1471.8320310	3.43
1472.6374510	1.36
1473.6807860	1.97
1475.7813720	1.62
1476.5255130	0.76
1477.3536380	1.09
1480.1301270	1.97
1482.7630620	0.66
1484.2401120	1.11
1485.7612300	0.57
1486.7596440	3.01
1487.8184810	2.48
1490.2607420	2.30
1491.4215090	5.26
1492.7655030	0.31
1493.8364260	0.24
1495.5872800	1.76
1497.0043950	0.88
1497.7463380	2.55
1499.5030520	1.88
1500.5233150	3.90
1501.2862550	0.78
1502.0540770	0.67
1503.8031010	2.16
1504.9465330	0.64
1506.9726560	0.70
1507.9686280	0.41
1508.7562260	0.64
1509.7437740	1.41
1510.7537840	2.84
1511.6080320	1.22
1513.8570560	1.03
1516.1054690	1.56
1517.1857910	2.77
1518.4265140	1.00
1519.0782470	1.09
1520.6988530	0.96
1521.3167720	1.09
1523.9378660	0.79
1524.6815190	0.52
1525.5787350	1.03
1526.7386470	2.25
1527.5084230	0.47
1529.6824950	0.38
1531.1322020	2.07
1531.9976810	2.60
1535.2084960	0.50
1536.9406740	2.31
1537.6011960	0.10
1538.8203120	0.44
1540.9964600	0.87
1541.9555660	5.95
1542.6619870	0.36
1543.5866700	1.08
1545.4173580	1.97
1546.7154540	0.56
1548.8363040	1.61
1549.6204830	2.51
1550.3216550	1.09
1552.1478270	2.61
1553.3300780	0.28
1554.1146240	0.42
1555.1607670	2.73
1555.7977290	0.60
1556.9605710	1.84
1558.2374270	0.96
1559.3802490	1.13
1560.5830080	6.25
1561.4760740	3.42
1564.0733640	0.59
1565.1114500	1.28
1566.1600340	0.92
1567.8951420	1.24
1569.8317870	15.31
1572.2578120	2.28
1573.4727780	3.51
1574.3726810	0.81
1577.0084230	1.38
1578.4477540	2.25
1580.7427980	2.29
1582.0148930	0.63
1582.8253170	1.17
1583.4698490	1.16
1584.5994870	0.51
1585.5457760	1.64
1586.5460210	2.26
1589.6409910	0.24
1591.0858150	2.29
1592.1398930	1.26
1592.8817140	0.16
1594.6138920	3.30
1595.4410400	0.42
1597.6912840	0.31
1598.8620610	2.40
1599.9697270	2.44
1600.8659670	0.89
1603.9335940	0.19
1604.9680180	3.86
1605.7054440	1.39
1607.5367430	2.55
1608.5518800	0.95
1610.0048830	3.44
1610.8781740	2.57
1612.1403810	0.73
1613.1202390	0.95
1613.7490230	2.48
1615.7257080	4.36
1617.2219240	2.89
1618.2010500	2.14
1618.8338620	2.22
1620.1381840	0.67
1621.5531010	3.22
1623.5645750	3.96
1624.6066890	1.49
1625.6735840	0.71
1626.6094970	8.26
1628.3670650	2.26
1629.3132320	1.12
1630.7794190	5.99
1632.0422360	0.17
1633.6253660	0.42
1635.7705080	0.68
1636.8641360	1.66
1637.6358640	3.95
1638.3708500	0.81
1639.0531010	0.53
1640.4916990	0.47
1642.2620850	1.19
1644.8643800	0.75
1646.0063480	2.81
1646.9852290	1.70
1647.7758790	1.01
1650.6761470	0.78
1652.0291750	2.77
1652.7792970	0.34
1655.7957760	1.67
1657.5382080	1.56
1659.3392330	0.81
1661.6904300	4.43
1662.4339600	0.36
1664.2773440	1.05
1665.3641360	3.58
1666.8889160	2.90
1668.9611820	4.49
1669.8239750	0.30
1671.0196530	2.77
1673.9166260	1.35
1674.6329350	6.28
1675.3546140	4.69
1677.9930420	7.41
1678.9620360	0.92
1680.1521000	9.96
1681.1248780	8.28
1682.1351320	2.39
1683.4727780	1.53
1684.1229250	4.40
1687.2847900	7.61
1691.0736080	1.21
1694.6690670	3.14
1696.4305420	0.27
1697.4421390	1.26
1698.0974120	0.56
1699.0670170	0.44
1699.7927250	0.28
1701.9089360	0.22
1703.1979980	3.14
1704.0780030	2.09
1705.3446040	2.80
1706.4294430	7.31
1708.6163330	0.76
1709.7303470	2.21
1712.3118900	3.78
1714.4548340	0.61
1715.8469240	3.04
1717.8190920	1.64
1719.6292720	1.63
1721.0280760	9.09
1721.8773190	2.41
1722.8204350	1.64
1727.3480220	0.19
1729.1807860	32.75
1730.0031740	54.00
1730.9520260	15.77
1731.6877440	0.34
1734.1970210	1.04
1735.5906980	0.77
1736.4088130	2.17
1737.7711180	0.48
1738.6892090	0.69
1739.6149900	0.59
1740.8148190	1.29
1743.7933350	2.18
1744.4270020	0.90
1745.0466310	0.40
1747.4898680	0.66
1748.8778080	0.38
1750.4129640	0.46
1751.2987060	0.84
1753.0939940	20.98
1757.2344970	0.51
1761.4934080	0.41
1762.7673340	0.16
1764.9929200	0.16
1768.7415770	0.77
1770.0281980	2.45
1771.0378420	2.32
1772.9895020	1.21
1777.9240720	0.25
1779.6160890	8.83
1780.5510250	3.57
1781.5079350	5.94
1782.1105960	2.77
1783.7839360	0.67
1784.9376220	0.19
1786.9547120	0.98
1789.2331540	0.40
1791.3878170	0.66
1793.5030520	1.36
1795.7142330	2.69
1797.6844480	0.14
1799.2365720	0.30
1800.3952640	0.58
1801.8303220	1.69
1806.8804930	0.57
1807.5130620	0.23
1810.0977780	0.28
1814.8389890	1.18
1817.4635010	0.36
1820.7791750	0.45
1821.6993410	0.55
1827.9869380	0.72
1849.7022710	0.67
1858.8391110	0.53
1864.9206540	0.38
1868.9206540	0.71
1877.9569090	1.18
1880.9533690	0.87
1890.9219970	0.40
1899.7657470	0.68
1912.5511470	0.47
1947.6658940	0.28
1948.4810790	0.25
1949.7575680	0.13
1955.4852290	6.06
1974.3726810	0.47
1975.8536380	0.28
1977.9655760	0.17
1990.5568850	0.26
1994.2164310	0.16
1995.1885990	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3307
Annotation	Unknow
Peak:m/z	Relative Intensity
244.0831299	0.36
255.2588196	0.37
256.5231323	0.15
279.4451904	1.64
281.1834717	0.11
283.2260132	0.09
307.3812866	0.10
308.3670044	0.04
310.2304077	0.09
317.7636719	0.07
391.4984741	0.39
392.4237061	0.43
410.3562012	0.26
417.2603149	0.07
466.3166504	0.09
468.4242554	0.45
476.2890015	0.26
479.4105835	0.25
489.5006714	0.36
500.3557739	0.26
504.3337402	100.00
505.2352905	0.33
509.3402710	0.11
520.2775269	0.17
526.2778320	0.28
528.3381958	0.18
545.1867065	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	588.0594
Annotation	Unknow
Peak:m/z	Relative Intensity
175.0655823	0.39
187.0198059	0.26
198.9760742	1.33
201.0863495	0.47
211.0629425	0.16
216.9217834	0.78
218.9732666	0.25
222.7213593	0.03
225.0915833	0.05
227.0331726	0.10
228.9826050	0.05
231.1990356	0.16
234.1785278	0.10
235.0178223	0.03
237.1747131	0.09
238.2385864	0.05
240.9887695	0.15
242.7991638	0.02
244.8209839	0.21
246.9123077	0.24
250.9588165	0.13
253.1455078	0.08
254.8233032	0.09
258.8646851	0.12
261.0902710	0.09
261.8466797	0.06
263.1459961	0.11
264.4840698	0.24
265.1835022	0.03
268.8178711	0.06
271.1155090	0.19
275.0724487	0.31
276.9669189	16.66
279.1566162	0.03
280.1184082	0.19
281.0513916	0.10
288.0960083	0.18
289.0250854	2.15
291.2128601	0.07
293.9249573	0.08
295.0032349	0.78
298.1622925	3.82
300.8616333	0.14
302.9600830	0.37
305.0830078	0.24
306.8941040	26.24
307.5242615	0.16
308.9450989	0.12
310.6461182	0.22
312.0435791	0.03
312.9248047	0.04
319.0523071	4.38
321.1243896	0.32
322.0557251	0.18
323.1912842	0.51
324.7753906	0.26
328.1866455	0.07
328.9760742	0.29
330.4498901	0.21
331.0972900	0.94
334.1060181	0.12
335.0506592	0.21
336.8376465	10.15
337.5264282	0.15
342.9851074	0.78
346.9782104	1.12
349.0675659	1.61
352.9785156	0.64
353.9251709	0.10
354.8881226	0.92
358.1907349	0.10
359.2977295	0.07
361.0508423	0.64
364.2999268	0.43
365.0964966	0.47
367.0119019	22.62
373.0955811	3.32
379.2175293	0.79
381.3964844	0.17
382.0589600	0.53
383.1688843	0.23
385.3444824	0.03
390.9860229	17.41
391.5906372	0.09
392.3351440	0.07
393.2413330	0.04
394.1259766	0.14
397.0247192	30.35
402.4613647	0.11
404.9242554	0.03
407.9248657	0.84
409.1051636	71.91
410.2932739	0.17
413.6552124	0.06
415.1038818	0.25
424.7638550	0.37
427.0084839	100.00
427.8391113	0.03
437.8997192	0.28
441.0505981	0.30
442.2246094	0.48
443.2975464	0.05
456.2868042	0.43
457.2363892	0.27
460.1389160	2.81
469.0587158	0.12
473.6288452	0.07
474.4472046	0.13
478.0844116	0.04
480.9544678	0.13
482.6924438	0.04
495.8614502	0.13
497.0850830	0.13
498.9966431	1.83
500.9592896	0.25
510.9898071	0.11
514.2058716	1.25
528.9566650	0.17
542.7637329	0.08
544.3057861	0.68
545.0885010	3.18
551.1860352	0.10
552.2223511	0.17
553.1094360	0.78
559.2767944	0.03
570.9779053	16.78
571.7566528	0.23
572.4111938	0.08
573.7435913	0.47
577.4657593	0.96
579.1975708	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	351.2159
Annotation	JWH 073 2-hydroxyindole metabolite-d7
Peak:m/z	Relative Intensity
100.9902802	0.30
122.765976	1.12
142.9237671	0.91
149.0978851	1.41
152.1619568	0.90
158.8704224	0.82
161.9619141	0.34
162.8677673	0.74
170.0401917	0.82
170.9042358	1.44
172.244751	0.34
187.2164612	0.93
205.0784607	1.59
210.2621307	0.38
212.0648346	2.38
219.247345	1.56
223.0475464	1.48
235.3294678	1.11
239.2620544	0.64
243.473114	0.54
244.2219238	0.53
247.041748	1.27
251.1548157	0.85
260.9516602	3.96
261.9987793	2.38
262.6895752	2.74
266.0959167	0.41
270.1913147	0.74
279.0993652	3.69
281.8342285	2.17
284.3182678	0.65
287.0834961	1.78
288.188385	1.74
289.9949036	1.30
292.3150024	0.95
294.2563782	2.08
295.3519592	0.79
297.1504517	0.79
304.5231934	3.66
305.2926331	7.47
307.1967163	1.63
309.1512451	1.65
310.1324158	2.51
315.2886658	7.41
315.9662781	1.37
319.5738831	0.93
323.4187622	1.07
333.1928101	100.00
334.1919861	0.52
342.1512756	10.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	831.4352
Annotation	Unknow
Peak:m/z	Relative Intensity
251.1278229	0.23
254.2361145	0.64
255.3998871	0.16
272.2531128	1.49
276.2241821	0.07
280.1524048	0.44
311.2406616	0.17
319.4136963	0.17
325.3881531	0.13
329.3396606	0.20
338.1247559	0.19
339.0836792	0.10
340.7367249	1.88
349.2250977	17.79
349.8841858	8.03
350.8711548	0.44
352.3916626	0.14
356.3185425	0.08
357.3934631	0.10
363.2023926	0.28
373.2825928	3.32
378.9100342	0.24
391.0008545	0.46
398.7339478	1.87
399.6658325	0.95
405.3506470	0.12
409.1261597	0.38
410.0888672	0.25
426.5081177	0.64
428.2163696	0.23
431.3527832	0.13
440.4250488	0.24
449.3103638	0.44
453.3861694	0.14
462.7953491	0.89
471.2100830	0.17
478.2403564	0.14
486.3775024	3.09
487.5256348	0.68
496.6518555	0.55
502.2702637	0.45
506.0715332	0.26
518.6049805	0.10
521.2562256	0.46
536.3151855	0.48
538.6794434	0.35
539.7315063	0.13
541.1134644	0.17
553.4854126	0.39
556.2935181	0.60
568.3388062	0.38
573.8919067	0.36
583.7514038	0.15
585.3657837	0.37
586.4356079	0.17
594.4149780	0.20
595.4721069	0.40
596.4266357	0.93
600.4738770	2.16
601.5961304	0.53
604.4480591	0.23
607.2817993	0.55
609.0708618	0.16
615.4730835	0.25
622.4421387	1.59
624.3879395	0.37
626.7512817	0.33
654.1449585	0.13
680.4807739	1.54
687.2479858	0.20
697.4806519	68.03
698.5277710	12.71
699.5052490	2.30
701.5496216	0.10
703.0171509	0.58
709.4736938	0.36
711.5299683	0.32
720.2116699	0.64
720.9140015	0.45
723.5504150	0.25
725.4106445	0.21
727.5635376	0.78
733.7781372	0.42
740.6187744	1.49
741.6531372	0.11
742.3421631	0.64
750.3687134	4.01
751.5317993	0.96
753.2108765	0.81
755.5543823	4.85
756.1589966	0.79
757.5510864	0.56
768.1574097	0.25
769.3187256	1.36
771.7473755	1.24
773.7963867	0.16
779.1519165	0.08
783.1527710	0.15
786.7126465	0.32
790.8745728	1.01
792.3225098	0.13
793.5407104	0.10
796.5546265	8.71
797.7053833	2.30
799.6499023	1.46
800.2833862	0.80
801.3095093	2.91
801.9687500	1.57
808.1858521	1.47
809.0962524	1.15
810.1694946	2.53
812.6234741	1.20
813.4312744	0.58
814.4950562	0.07
815.3520508	1.27
817.8812866	0.48
832.8878174	0.37
840.6298218	6.44
841.3494263	0.28
846.1719360	0.16
847.5173950	0.98
849.5133057	2.73
850.4586182	1.04
854.0510254	0.60
855.2107544	0.64
856.6921387	0.84
858.2557373	2.35
861.0399780	2.76
862.1845093	0.16
865.3024292	100.00
866.7742310	2.63
867.5326538	1.00
868.6792603	0.16
870.1303711	1.81
870.8654175	1.42
872.5825806	0.10
873.5268555	0.28
876.7821655	0.38
881.4357300	0.61
882.1835327	0.84
883.9182739	0.34
885.0814209	0.28
887.7938843	0.38
889.3171387	0.36
890.2683716	0.48
891.2511597	1.68
895.9423218	0.91
897.4358521	3.23
898.3264771	1.28
899.3496704	0.20
900.7601929	0.52
903.6480103	1.46
905.8467407	0.18
906.4966431	0.14
908.7433472	0.19
913.8120728	0.24
918.1784668	0.49
918.9611206	0.41
921.5368652	0.57
924.4887085	0.66
925.9406128	0.41
928.0388184	0.17
934.4865112	0.49
936.6102905	0.20
938.6340332	1.96
939.4221802	1.05
944.0209351	0.66
946.4282227	18.82
947.4997559	0.15
949.5521851	0.80
952.0150757	0.77
953.0605469	1.37
960.8691406	1.86
962.5068359	0.23
968.5918579	0.49
969.7377930	0.29
970.6096802	0.74
971.7951050	4.89
972.7716675	0.33
973.5621948	0.40
976.1923828	0.54
979.0899048	0.12
988.1455078	0.22
989.2690430	0.70
992.1738892	0.49
994.0342407	3.77
994.6437988	1.91
996.5875854	2.29
997.5833130	0.50
1005.2731320	0.47
1006.3777470	0.25
1010.4740600	4.27
1011.4001460	1.46
1012.6793820	0.34
1017.3359990	2.67
1018.1372070	0.91
1020.2196660	0.51
1022.5441280	1.60
1028.4836430	14.10
1029.2326660	4.95
1030.0819090	1.12
1034.3134770	0.21
1035.4422610	0.15
1045.3391110	0.50
1046.0673830	1.55
1047.5153810	0.28
1060.7414550	0.30
1061.6176760	0.23
1067.0408940	0.84
1067.7351070	0.16
1068.8041990	0.77
1070.6464840	1.07
1071.4487300	0.37
1072.4764400	0.45
1074.4409180	1.20
1077.4705810	9.26
1078.2751460	0.30
1082.4617920	0.57
1083.2756350	0.68
1084.2189940	0.16
1092.3957520	0.36
1101.1047360	0.82
1104.1865230	0.68
1108.5034180	0.42
1110.0568850	5.86
1110.9747310	1.73
1114.5291750	7.37
1115.3022460	1.38
1120.0417480	47.51
1120.7202150	26.12
1121.5391850	1.52
1122.3852540	0.89
1123.7421880	0.67
1124.4241940	0.56
1126.7154540	0.23
1131.8593750	0.50
1138.7529300	0.25
1139.6733400	1.91
1140.3498540	0.19
1141.3525390	0.54
1144.0227050	1.29
1147.1917720	5.51
1148.0593260	2.93
1149.5271000	0.41
1153.2630620	84.75
1154.2862550	6.78
1155.4221190	0.68
1156.3913570	0.41
1157.5737300	0.47
1160.9714360	0.53
1163.4427490	0.71
1165.7886960	0.55
1166.8060300	0.16
1170.5603030	0.13
1174.2805180	1.25
1174.9000240	6.53
1175.6002200	0.66
1176.9968260	0.09
1188.3447270	0.92
1195.5787350	0.18
1196.2924800	0.21
1197.5599370	0.20
1206.2001950	0.07
1211.5618900	1.53
1214.9559330	1.43
1221.1589360	0.14
1224.1074220	0.21
1225.9011230	0.14
1231.1760250	4.47
1231.9376220	6.51
1232.7103270	0.64
1238.5111080	1.47
1239.4433590	0.09
1240.2346190	0.14
1241.0714110	0.44
1246.4772950	0.41
1248.4566650	0.45
1249.8363040	0.51
1251.5999760	0.12
1255.6734620	0.27
1272.3959960	0.39
1275.7160640	0.22
1281.2875980	1.49
1283.9239500	0.18
1295.6282960	0.73
1302.9548340	0.20
1304.7301030	10.12
1305.5379640	2.05
1306.3110350	0.88
1308.7398680	0.17
1313.8720700	0.16
1322.3702390	0.08
1324.5948490	0.94
1325.7623290	0.95
1338.9227290	0.10
1351.6163330	0.47
1353.0998540	0.38
1354.1778560	0.78
1358.7834470	0.12
1360.8846440	0.53
1369.1531980	1.30
1370.4029540	0.07
1393.8178710	0.38
1397.9986570	0.29
1412.8164060	0.61
1417.3609620	0.85
1433.5673830	0.43
1437.9322510	0.66
1438.8682860	0.10
1449.7392580	0.19
1460.2528080	0.37
1462.9808350	0.79
1468.4412840	0.45
1470.4700930	0.11
1478.6854250	0.33
1502.5950930	0.48
1503.9659420	0.15
1533.9678960	0.47
1541.0850830	0.40
1543.5892330	0.22
1548.7193600	0.37
1551.1713870	0.40
1551.7869870	0.48
1565.2805180	0.09
1580.9229740	0.45
1609.5145260	0.47
1651.4527590	0.13
1652.3812260	0.24
1653.6252440	0.31
1664.8918460	0.27
1665.9431150	0.54
1676.5518800	0.16
1678.6646730	0.28
1699.8856200	0.36
1707.5938720	0.08
1740.8729250	0.21
1780.0047610	0.43
1780.9844970	0.44
1798.8770750	0.19
1801.0397950	0.32
1806.0324710	0.06
1855.5744630	0.10
1865.0352780	0.17
1906.6541750	0.14
1907.6903080	0.44
1924.8078610	0.08
1992.6320800	0.08
1995.0404050	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	574.2111
Annotation	Galalpha1-3Galbeta1-4Glcbeta-Sp
Peak:m/z	Relative Intensity
185.0917053	0.07
232.0967865	0.26
241.179718	0.07
245.3483276	0.08
250.0829468	10.55
258.1688232	0.04
264.5715942	0.25
265.1815491	0.89
280.7183228	0.13
282.9458618	2.55
295.2883301	0.08
334.581604	0.07
341.8637695	0.04
347.1785889	0.02
351.4525146	0.04
357.267334	0.03
361.3475342	0.05
363.0912476	0.02
365.3684082	0.10
372.2233887	0.04
378.446106	0.04
393.3946533	0.16
394.2122803	0.02
396.7577515	0.22
408.2625122	0.16
412.1554565	100.00
412.7640381	0.52
418.2977905	0.06
419.5118408	0.09
424.1864014	0.03
425.1233521	0.21
427.4499512	0.02
428.5147705	0.02
440.0343018	0.02
441.3310547	0.02
442.4889526	0.12
445.0543823	0.24
446.3574829	0.02
454.1947632	0.07
463.6808472	0.06
466.9447021	0.04
473.3753052	0.08
480.7960205	0.06
489.1099243	0.31
491.4675293	0.33
502.5247803	0.03
503.9302979	0.13
509.9391479	0.04
512.8521729	0.06
515.6071167	0.05
517.9984741	0.11
524.1358032	0.13
525.2661743	0.08
529.8865356	0.09
533.3994751	0.20
535.5525513	0.12
538.305481	0.03
541.6325684	0.07
543.3705444	0.33
555.2560425	0.23
556.331665	1.06
557.4393311	0.66
559.3129883	0.05
562.8512573	0.24
564.7971191	0.36
565.5267334	0.04
566.380249	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2785
Annotation	16:0 LYSO-PE
Peak:m/z	Relative Intensity
193.2427063	0.15
196.1004333	3.08
198.0856781	0.06
212.0012512	0.07
214.2089539	1.63
237.1880493	0.04
248.2346191	0.19
255.2307129	100.00
256.02948	0.65
267.4202576	0.20
280.2400208	0.16
320.4616089	0.10
324.1223145	0.36
348.6430054	0.21
368.269165	0.10
384.094635	0.15
388.6430359	0.18
391.1961975	0.34
406.1850281	0.49
408.6089172	0.25
410.2218933	0.13
414.3031311	0.08
416.4536438	0.14
434.0769653	0.28
435.2795105	0.42
437.4100037	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	536.5391
Annotation	Unknow
Peak:m/z	Relative Intensity
157.0506897	0.63
161.2612915	0.26
161.9883728	0.46
173.1254425	1.07
179.8091736	0.28
185.0036163	1.25
201.2228546	2.22
203.2394409	0.49
213.0681152	0.61
216.9696655	0.23
219.1735229	5.70
223.0251312	0.60
253.2020569	1.22
281.2158203	0.34
288.0400391	1.10
306.1130981	1.34
312.1424561	0.15
334.3474731	1.09
344.1224365	1.45
356.2541504	1.26
374.2684937	2.16
378.0531616	0.61
380.3021851	0.64
382.2616577	0.99
387.1959229	0.46
389.1136475	0.42
391.0354614	0.34
399.1342773	0.79
403.1810913	0.36
404.2313843	0.90
407.2897949	2.78
417.5229492	1.16
421.2689819	0.47
424.0120850	0.83
426.3066406	0.15
459.2925415	0.82
475.5574341	0.95
482.6476440	1.73
485.1031494	1.63
491.4281616	1.33
495.0114746	11.64
495.8047485	0.64
496.6206665	0.85
498.3772583	0.85
499.6130981	20.85
501.3871460	0.17
503.0768433	0.89
505.1951294	1.21
506.3020630	3.06
506.9550781	0.95
507.5763550	1.47
508.3745117	0.34
509.4087524	0.59
510.4335327	0.53
518.2356567	0.26
520.6536255	1.47
524.6360474	3.14
525.3124390	1.74
528.0156860	7.58
542.3013306	0.72
565.3286743	0.19
568.7829590	0.23
575.2720337	1.47
575.8945312	1.45
579.2692261	2.12
584.0712280	2.59
586.1217651	2.46
589.0870361	0.43
595.2988892	7.58
603.8844604	1.44
609.9317017	3.41
613.5202026	18.98
614.1960449	9.12
619.4807739	0.53
621.7209473	1.74
632.7568970	6.92
633.5494995	2.72
636.5906372	12.04
637.8662109	4.52
638.7959595	8.88
642.2290649	1.49
642.8356934	100.00
645.1704712	3.40
646.0263672	0.95
651.7659302	1.80
657.0424194	0.32
658.8787231	0.15
670.3692017	2.24
675.9960327	0.70
682.1239624	0.22
685.1320190	0.30
746.6560669	1.07
754.6121826	1.77
755.7299805	1.94
756.6026611	0.35
757.4898071	0.89
759.5321045	2.24
771.3538208	0.93
792.5739746	0.28
803.7498169	0.98
804.6906128	0.81
813.3314819	2.46
837.5700073	0.34
849.5307007	1.09
855.8842773	1.22
857.3403931	8.69
858.3999023	2.96
862.1869507	1.43
870.5316772	0.26
905.2424316	2.66
911.8801880	0.15
914.9209595	0.95
939.6592407	0.36
1366.6546630	0.34
1748.2052000	2.62
1908.7083740	2.57
1923.8739010	1.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	399.1438
Annotation	S-Adenosylmethionine
Peak:m/z	Relative Intensity
136.0048981	3.21
144.9468079	0.18
150.3129730	0.06
156.7940674	0.03
162.0774841	0.08
162.9747620	0.55
165.8802185	0.02
181.8683472	1.16
184.0599976	0.11
204.3212585	0.04
207.1591187	0.10
212.7666321	0.08
214.9908600	0.17
222.8335266	0.01
229.0097961	0.02
232.0242004	0.09
237.2377930	0.27
250.0466919	100.00
250.8500366	0.01
252.9439697	0.14
255.9285278	0.49
264.0382996	3.14
265.9833679	0.16
267.0632629	0.03
271.8806763	0.05
284.0488892	0.06
293.8601990	0.01
298.1685791	39.53
300.7784424	0.15
323.6584778	0.07
324.9135132	0.63
325.9251709	0.01
353.2152405	0.07
361.0583496	0.06
367.8659668	0.02
381.2589111	0.19
382.0512390	0.16
383.3087463	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	493.2078
Annotation	Glaucarubinone
Peak:m/z	Relative Intensity
143.0129395	0.14
148.8542023	0.05
159.0699310	0.43
161.0737457	0.83
178.8686066	0.04
229.9543915	0.08
236.8636780	0.08
251.2893066	0.41
280.3221741	0.07
287.1953735	11.51
288.3248291	0.03
295.2656860	1.34
315.3488159	0.25
317.2739258	0.21
324.8125916	0.20
331.0877075	0.18
333.2727356	0.07
371.4102478	0.07
403.3333130	0.22
411.1363831	0.20
413.2732849	0.05
415.1479187	0.06
429.0576477	0.06
431.0043335	0.09
446.7097473	0.08
447.4529724	0.23
449.2889709	100.00
450.2367249	0.12
456.5620728	0.20
457.2862244	4.08
463.2920227	0.19
473.3563538	0.15
474.6184998	0.11
475.4707642	0.37
476.3355103	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
137.1349335	0.40
151.1298523	0.27
159.0477448	0.35
169.2255554	0.20
170.7517242	0.98
185.0951233	1.18
199.1140747	0.65
213.1080322	0.55
215.1454468	2.81
229.0957031	0.25
241.1822815	0.40
243.2258301	0.78
247.194458	0.37
267.3435059	0.35
269.0846558	0.93
271.3139954	3.49
273.0032043	0.54
277.243866	0.20
279.2114868	0.51
281.0689697	0.46
283.3039246	2.34
285.2276611	0.74
287.4745789	1.43
289.0058594	0.31
295.3122253	3.55
297.2911072	2.01
299.1304321	3.56
311.1799927	3.86
313.6040344	3.53
315.6644592	0.83
321.4265137	4.87
323.3677673	7.37
325.1548157	1.35
327.2989502	1.58
339.2409058	100.00
340.127533	0.67
341.3063965	13.97
348.7741394	2.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
80.96537018	2.14
84.8848114	0.77
90.92050934	0.31
92.81866455	0.61
94.99928284	5.87
96.94811249	2.66
101.2207184	0.88
102.8452759	1.55
105.1895142	2.18
107.0945587	2.25
107.7628174	0.50
109.0567322	2.86
110.9960022	0.74
112.8763123	0.84
115.021637	0.98
119.1816864	1.11
120.9766388	1.93
123.0178528	3.05
124.9641571	0.57
126.8722382	2.74
128.8632965	7.70
130.9528961	0.66
133.059845	1.65
135.0234833	1.55
137.0103455	5.12
139.0754852	0.87
140.8107452	2.35
141.9326477	0.19
144.8620758	0.34
146.8098755	2.09
149.2636261	0.47
150.9234009	57.38
152.1058807	4.94
152.887558	0.77
154.3495789	1.30
155.3054657	1.04
157.0091095	1.20
158.2377625	0.16
159.2531281	0.90
161.1196747	1.41
165.0810699	0.98
166.9763947	0.96
168.9763336	3.72
171.1774445	1.09
173.2625275	0.10
175.1179352	3.15
177.373642	0.92
179.063736	3.61
182.1568451	0.87
183.0627747	3.84
184.913208	1.41
186.2269745	0.89
189.1285706	1.48
191.1755371	1.60
192.1145782	0.59
193.0384369	3.66
194.2390137	0.94
195.1399689	3.91
197.094223	4.77
197.9976044	0.42
199.0432739	0.81
203.1726532	0.55
204.9442596	0.15
207.2551422	4.57
208.9621735	2.01
210.2032623	0.40
211.1516113	5.07
211.8019562	0.68
217.2363434	8.76
225.1416321	12.90
235.2315216	37.93
235.9788971	0.39
238.1822357	7.10
239.1399384	2.43
243.8243561	2.59
251.244751	0.31
253.0908966	100.00
254.1476288	11.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.22
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
94.70480347	0.62
96.80558777	0.71
98.97252655	0.25
100.9573746	0.09
105.1166992	0.19
106.8733826	0.08
109.1616211	0.31
110.9762268	0.78
112.7017365	0.16
113.8216782	0.11
114.954422	0.18
118.9371796	0.07
121.0254364	1.08
123.0066681	0.38
125.119606	0.10
126.928772	0.30
129.0438538	0.10
133.0002594	0.44
133.8027039	0.37
134.9563904	1.75
135.7585144	0.38
137.1308136	0.44
138.999115	0.32
142.9858093	0.94
144.9406891	1.58
146.9969177	0.29
149.2182312	1.20
151.156601	0.78
152.9352722	0.42
155.0454712	2.01
157.0189667	1.41
161.0645752	1.16
163.1719055	1.42
164.5581665	0.26
165.4579773	0.70
166.8938599	1.05
169.0283813	0.78
171.0988464	0.51
173.1216736	0.24
175.302124	1.23
177.0448914	0.64
178.9190979	0.94
180.3461304	0.79
181.1150208	0.87
181.9216003	0.14
183.0606079	0.62
187.100769	0.93
189.3812714	0.53
191.3217316	0.81
193.270462	0.61
194.0586395	0.12
195.1219788	1.10
196.8070984	2.33
199.0512543	0.77
201.1125183	0.25
202.9795074	0.16
208.9264832	1.11
209.5271912	0.27
210.271637	0.13
211.2169495	1.42
213.5566711	0.07
215.1546631	0.54
219.1391296	0.27
220.9476013	0.94
223.071106	1.19
225.1628113	0.54
227.0762634	0.80
228.5888977	1.03
229.2409363	0.81
231.4297485	0.15
233.4645081	0.10
235.2530823	1.97
237.2814941	0.76
239.1085205	1.27
240.9946289	1.14
247.2123413	1.63
249.0700073	0.44
250.0644531	0.20
251.1264954	1.32
252.5840759	2.16
253.2340393	3.92
254.3293762	0.26
255.2976685	0.48
257.0546265	2.30
259.1279602	0.11
263.390686	0.37
264.1315308	0.47
265.1818848	2.28
266.1651001	0.58
267.1559753	2.26
269.0695496	0.51
270.1013489	0.47
275.2032471	16.60
276.0368042	0.26
280.976532	0.09
282.217865	0.16
283.1939392	1.50
290.6588745	0.99
291.3901978	0.16
293.2044678	100.00
294.3183594	0.94
297.1020203	0.23
302.2940674	0.65
305.1315918	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
94.82233429	0.04
101.0404587	0.06
102.0291138	0.08
104.9192429	0.24
106.8982697	0.89
109.1624451	1.81
111.0264816	0.15
112.8247223	0.19
114.9899292	0.14
116.9744339	0.44
118.7352371	0.29
120.9656601	3.70
122.3538055	0.11
123.1019897	0.92
124.1424179	0.09
124.8187256	0.13
130.7294922	0.12
132.9642944	0.95
135.0822449	3.62
137.1300201	0.32
138.8363342	0.08
140.9992371	0.13
142.997467	0.99
144.9701996	0.19
146.9703369	2.84
148.9844055	1.02
151.0222168	1.38
152.8848877	0.23
154.9784241	0.17
157.0157471	0.81
159.0031128	1.09
160.9703979	1.92
163.0068359	0.73
165.1638489	1.02
166.183609	0.23
167.3709106	0.06
169.0151978	0.74
171.2580414	0.41
172.966156	0.88
175.1102448	1.52
177.0708313	0.79
179.1812592	0.47
181.2658691	0.25
182.3680878	0.18
183.1120758	0.98
185.2765503	0.08
187.1302643	1.05
189.0063782	0.80
191.0936737	0.78
192.0694885	0.05
193.1734467	0.27
195.4251556	0.08
197.1498871	0.90
199.1116943	0.25
201.1004028	0.49
203.0900574	0.96
205.1026306	0.90
207.1923676	0.13
209.0684814	0.12
211.2827759	0.90
213.1238098	0.69
215.0372925	0.46
217.0424805	1.05
219.2400513	0.15
223.1359253	0.75
223.9384155	0.18
225.1208496	0.52
227.2027283	0.57
228.1463318	0.07
228.9522705	0.16
229.8823242	0.08
231.2031555	1.27
233.328949	0.08
236.2673035	0.12
239.2820435	0.18
241.2393799	0.10
243.1906738	0.57
244.9978638	1.16
247.2651672	3.76
247.9367676	0.12
253.1715698	0.26
254.7994995	0.25
255.4008484	0.05
257.2166138	0.32
259.4623413	0.33
263.2784119	0.09
264.4468384	0.05
265.1969604	0.15
267.2758789	0.10
269.1603699	0.17
270.3642578	0.18
271.2818604	0.63
273.2277527	0.23
277.1072998	0.17
279.2852783	0.07
280.1640625	0.10
281.2689819	0.04
283.1759644	0.38
285.2199707	0.33
287.2700806	0.17
293.0158997	0.04
294.0691833	0.11
295.2365723	1.43
296.2587585	0.36
297.1690063	0.13
299.1986084	0.91
300.2149963	0.89
305.1989441	3.59
306.2006836	0.06
310.65448	0.15
313.0228882	0.19
314.2272949	0.08
318.7617188	0.12
321.2823181	0.09
323.2393188	100.00
324.249054	0.10
325.4297791	0.03
341.2254333	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
95.00023651	0.08
96.58621216	0.11
97.21338654	0.12
101.145813	0.34
107.0282974	1.19
109.0657501	1.08
110.7657623	0.23
117.1065369	0.05
119.1699371	0.10
121.0384064	4.31
121.9905701	0.14
122.9876099	0.69
125.1758423	0.23
129.0718994	0.46
130.8504028	0.66
133.063797	0.47
134.963089	1.50
137.0732117	0.63
138.0736847	0.09
138.7573853	0.26
141.2006226	0.09
142.9571991	1.45
145.1947784	0.16
147.0697021	2.69
149.0559387	2.37
150.068512	0.10
151.0112152	0.41
155.1662292	0.11
156.9871826	0.54
159.0979919	1.49
160.0719604	0.10
161.0827026	2.34
163.0630646	1.35
165.087616	0.98
166.9875793	0.37
169.0893555	1.38
171.201828	0.35
172.9959259	0.91
173.7713318	0.09
175.0809021	2.02
177.0342102	0.39
177.8723145	0.12
179.1460266	0.52
181.1500549	0.04
183.1399994	0.11
187.2047272	0.92
189.0684814	0.37
190.2434692	0.05
191.1968384	0.55
191.9917145	0.04
193.2223663	0.27
198.9967957	0.06
201.1421356	0.59
202.7636719	0.34
203.3800964	1.00
205.2025299	1.24
209.302063	0.25
210.8139038	0.34
212.9371948	0.72
213.9793701	0.19
215.074646	0.03
217.2519226	0.77
219.1775208	0.36
221.1094971	0.05
223.1942444	0.53
225.2646179	0.50
227.1791687	0.07
228.4562988	0.14
229.636261	0.07
231.1740417	1.82
232.9750366	0.15
235.186676	0.39
241.1574707	0.94
243.1086121	0.46
244.1147766	0.12
245.2750854	2.13
247.2718811	5.62
251.2555237	0.06
252.4316711	0.21
253.1441956	0.52
254.9909973	0.35
259.2303162	1.03
260.0764771	0.12
266.9486084	0.28
268.8122559	0.12
271.0776367	0.46
272.9013367	0.04
274.2420044	0.13
277.1580505	0.21
280.934082	0.19
283.0276489	0.74
285.2739868	0.89
287.3423462	0.99
289.3815002	0.22
293.2914734	0.18
295.1022644	1.69
295.980896	0.16
296.9788513	0.26
299.2160034	1.51
303.295105	0.12
305.0797119	4.33
309.2914429	0.36
310.0383301	0.05
311.8308716	0.17
313.3244324	1.04
323.2312622	100.00
323.9244385	1.51
332.2496948	0.15
333.8643799	0.09
341.2012634	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
85.04335785	0.06
91.04924011	0.25
92.95803833	0.37
94.91177368	2.39
97.0044632	0.80
99.07865906	0.17
106.8769531	0.13
109.0517654	2.70
110.8401108	0.35
113.0213852	0.77
118.9608002	0.38
120.9179993	1.04
123.0492249	2.40
125.0287399	0.86
125.8871765	0.03
126.8677979	0.64
128.7999878	0.37
131.2328339	0.30
132.9666443	0.28
134.9175415	1.13
137.0038452	0.70
139.0809021	2.45
141.033844	0.55
143.0889587	0.48
145.2408142	0.14
147.026001	0.62
148.2714844	0.04
149.1399841	1.08
151.0036011	0.65
152.9996948	1.86
154.1962891	0.08
155.1129456	1.25
157.0929871	0.30
159.1294861	0.20
161.0986328	0.47
162.8806763	0.29
165.1655273	1.96
167.042923	0.90
169.1021729	0.70
170.9588776	0.87
172.9705811	0.30
175.0315094	0.73
177.2525024	0.05
178.9702606	0.69
179.8286438	0.15
181.0002747	0.64
183.0986023	3.02
185.1714783	1.06
187.2810822	0.23
187.9332123	0.05
189.0752411	0.55
190.9423828	0.48
192.9724731	0.25
195.1368713	0.73
197.111084	4.13
198.0135498	0.21
199.1522522	1.41
201.0281067	0.23
203.1747437	0.92
205.3572388	0.44
207.1859741	0.15
209.0996399	0.45
211.1426086	3.29
213.2908325	1.56
215.028656	0.33
217.1034241	0.06
219.1495667	1.44
221.1976624	3.34
222.0514221	0.09
223.2538147	0.48
225.0944519	1.91
227.2156982	1.71
229.0899658	0.43
233.2409058	3.81
235.20047	0.58
237.1866455	4.21
239.1887207	10.70
241.0612488	0.81
243.1829834	2.84
244.3621216	0.12
248.0058594	0.04
251.0640564	3.69
253.2519531	0.60
255.2294312	2.05
256.9004211	2.09
257.5992432	0.04
261.1501465	5.09
262.2850342	0.20
265.2878418	0.12
269.1329651	0.46
276.9666138	0.22
279.227417	100.00
280.0794373	2.00
281.1608887	0.13
288.3130798	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	351.1975
Annotation	Glutamyl-Gamma-glutamate
Peak:m/z	Relative Intensity
113.0057983	0.33
113.9464264	0.05
115.0542145	0.74
116.2234192	0.04
130.0036621	0.03
133.1065979	0.03
141.0021362	0.21
157.9396362	0.29
158.9768524	17.10
176.0270996	100.00
189.3494263	0.02
230.2546997	0.06
231.3050232	0.03
247.5253906	0.01
250.2207947	0.02
261.1843567	0.03
274.2093201	0.03
333.1011047	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	701.3358
Annotation	Unknow
Peak:m/z	Relative Intensity
227.2313232	0.95
245.2776184	0.10
257.2738953	0.12
282.0836792	0.05
300.2375793	0.29
331.3883667	0.19
332.2662048	0.14
333.4971313	0.24
337.2622070	0.10
340.1863403	0.05
356.2600708	2.61
372.8244629	0.06
381.3724365	0.05
419.4445190	0.30
420.1404419	0.24
423.3701172	0.42
424.8555298	0.05
428.9910278	0.59
429.7932739	0.69
441.5031128	0.10
459.4456177	0.14
466.2368774	0.76
473.5911255	0.11
479.2382202	0.34
487.5204468	0.72
493.5177612	0.04
509.8272705	0.15
510.4335327	2.01
524.3191528	0.09
528.4741821	10.97
529.3478394	0.40
536.5369263	0.08
552.4887085	0.13
554.4780884	2.47
570.5117798	2.87
572.4031372	14.34
580.4997559	0.20
588.4138794	0.16
605.1354980	0.05
609.0984497	0.15
612.5759277	0.39
613.5200806	0.19
615.3760986	0.58
616.8182983	0.08
639.3285522	1.58
641.3479614	0.36
644.4744873	0.11
651.2698364	0.08
657.4083862	100.00
658.5274658	1.48
663.0628662	0.08
665.0011597	0.35
669.2780151	0.05
671.0973511	0.37
678.6420288	0.35
681.0100098	0.18
683.4395142	17.97
684.3488770	0.82
700.9191284	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	508.2003
Annotation	Unknow
Peak:m/z	Relative Intensity
147.7650909	0.28
148.9784546	1.18
162.7085419	0.21
165.9636993	100.00
180.9764099	1.40
181.9204102	0.39
225.0682220	0.08
231.6591644	0.09
258.2930603	0.08
288.8788757	0.30
306.7978516	0.39
309.9261780	0.24
323.5396729	0.39
324.4468689	0.08
327.9427795	1.97
328.9625244	0.15
341.4768066	0.12
342.8633423	1.09
345.7763062	1.75
348.1363220	0.20
359.1806641	0.56
372.0640869	0.28
410.1463928	0.99
416.1141052	0.23
428.1283264	0.11
442.2349854	0.52
464.9209595	0.19
490.1061707	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	795.8802
Annotation	Unknow
Peak:m/z	Relative Intensity
227.1366119	0.05
283.7239685	0.06
302.2659607	0.03
328.5287476	0.08
396.9480591	0.03
398.1630859	0.07
441.2911377	0.54
523.9449463	0.07
524.7038574	0.08
566.4159546	0.39
567.3416138	0.05
573.3272705	0.04
574.2236328	0.13
584.5435181	0.08
591.7019653	0.04
593.6563721	0.21
595.6386108	1.22
599.9017334	0.50
600.8630371	0.08
607.1718140	0.29
609.2471313	1.95
610.0272827	0.22
612.8223877	0.04
615.3749390	0.07
619.9001465	0.18
621.5750122	0.20
622.5172729	0.23
628.9517822	0.08
631.0404053	3.05
631.9299316	0.02
635.5648193	0.20
642.9870605	0.39
644.4799194	0.15
647.9936523	0.06
648.7935181	0.12
649.4321289	0.05
651.0495605	0.32
651.6546631	0.10
656.6605225	0.54
657.3182983	0.05
658.1765747	0.41
658.8858032	0.09
660.5742798	0.58
665.8288574	0.07
667.3391724	0.04
669.5209351	0.11
670.9688110	1.01
674.6383667	0.12
678.3638306	2.76
679.0764771	2.82
679.8609009	5.71
680.5355225	5.01
682.4558105	0.08
686.7395630	1.14
687.5175171	2.46
689.3099976	1.60
691.2092896	0.04
691.8733521	0.55
692.5454102	0.30
693.1495361	0.10
695.1459351	0.19
700.4682617	9.48
701.4528809	1.35
704.2122192	0.06
708.3899536	0.28
709.6035767	11.33
710.5527954	1.28
712.5523071	0.30
714.0724487	0.16
716.5305786	0.33
722.3370361	3.37
723.1450195	2.70
728.2526855	0.27
731.2883301	7.52
731.9324341	6.26
732.5390015	1.11
733.8734131	0.69
734.5896606	0.35
736.1865845	0.18
738.2792969	0.16
741.8966064	0.15
743.2219238	4.73
743.9135132	0.39
745.3502808	0.06
746.3603516	0.18
749.3871460	0.29
750.0541382	0.17
752.0513916	15.76
752.9474487	2.10
756.0601807	1.68
756.9158325	0.20
765.1394653	21.43
766.0687866	3.68
767.1043091	0.17
768.8380737	0.13
774.1188965	100.00
775.0551758	14.10
778.1412354	2.38
779.0344849	0.86
787.0319214	2.94
853.5972290	0.09
925.7960815	0.04
930.4440918	0.03
959.3923340	0.15
975.3474121	0.18
976.6398315	0.10
1020.9379270	0.09
1021.7297360	0.11
1022.4697880	0.47
1045.3839110	0.10
1059.2869870	0.07
1070.3419190	0.08
1072.7001950	0.10
1074.2349850	0.04
1089.2485350	0.10
1090.5354000	0.25
1111.7648930	0.18
1116.4324950	0.17
1117.5388180	0.67
1118.3756100	0.05
1129.5095210	0.15
1130.5129390	0.06
1132.8396000	0.16
1133.6492920	0.04
1134.5288090	0.26
1150.3813480	0.18
1151.4224850	0.41
1173.5520020	0.14
1175.3310550	0.08
1183.3415530	0.09
1201.2875980	0.10
1219.2473140	0.15
1219.9165040	0.13
1220.7175290	0.12
1228.3129880	0.13
1229.8061520	0.05
1245.4796140	0.32
1246.5417480	0.08
1247.5611570	0.09
1259.3066410	0.04
1263.6772460	0.11
1264.6119380	0.34
1272.4429930	0.08
1273.7935790	0.05
1315.3359380	0.11
1325.3186040	0.09
1329.7569580	0.03
1330.5236820	0.27
1339.5520020	0.32
1358.5501710	0.19
1383.6561280	0.37
1384.6195070	0.32
1385.7039790	0.13
1400.4761960	0.07
1401.7089840	0.54
1402.7612300	0.19
1427.3582760	0.50
1428.6729740	0.08
1429.5489500	0.20
1445.5086670	0.57
1446.8602290	0.10
1447.5767820	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	487.24
Annotation	TMC 89A
Peak:m/z	Relative Intensity
158.8774109	0.09
163.0975952	0.20
169.1276245	0.08
171.8869934	0.12
180.0980225	0.11
187.0481720	0.11
195.0830994	4.48
196.2109070	0.06
205.2720947	0.04
220.9072876	0.52
231.0707703	0.22
237.3077545	0.30
241.1632080	0.30
265.0393982	0.46
267.9676514	0.06
273.0968628	0.44
281.8490295	0.89
283.2148438	0.05
310.1254578	0.08
324.9449158	0.43
330.1727295	0.19
341.1681213	0.16
343.0183105	0.13
356.2223206	3.66
357.1792908	1.45
371.4525452	0.14
374.2319336	0.23
375.7200623	0.07
383.0153503	0.07
387.3248596	0.16
391.1185913	0.23
401.5779419	0.03
425.1823120	0.22
427.1533508	0.50
441.1088257	0.14
443.2821350	100.00
444.5867615	1.04
445.3210754	3.46
469.3094788	6.66
470.2367249	0.14
470.9036560	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.8975
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9164429	0.68
174.8437958	0.09
198.8686981	0.12
215.1786346	0.04
229.0305176	0.29
233.1006470	0.10
244.9028778	0.23
273.0428467	7.23
288.9865723	10.42
387.0421753	0.94
401.0151367	0.17
402.8804321	100.00
403.5058594	0.25
471.0344849	0.10
488.9061890	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
92.99768829	0.46
109.0469055	0.18
110.9624023	0.18
175.0622406	0.29
181.2600708	0.13
182.9972382	0.14
187.0473328	0.12
191.2232971	0.10
197.224884	0.09
215.0959778	0.17
217.0930939	0.71
221.9576263	0.08
225.2143097	0.20
227.2626801	0.14
230.7663422	0.06
233.1721039	0.07
243.1449585	100.00
243.9407501	0.09
245.1196899	3.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2783
Annotation	16:0 LYSO-PE
Peak:m/z	Relative Intensity
139.9037933	0.17
153.0015869	0.14
166.1147461	0.01
182.9797821	0.01
189.2150574	0.01
194.2198181	0.01
196.090744	2.19
214.1073608	1.07
237.454895	0.03
255.2292786	100.00
255.8481445	0.19
279.2719116	0.02
325.223053	0.01
367.2888489	0.01
379.1769714	0.02
391.352417	0.46
406.4035339	0.03
434.2249451	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
99.00042725	0.10
106.8964233	1.76
109.0460434	1.46
110.8466034	0.09
113.0498047	0.23
115.220932	0.12
116.9534607	0.83
118.685318	0.21
120.9561996	3.26
123.1674423	1.27
124.7200851	1.13
127.0079651	0.13
128.7568359	0.10
130.9573669	1.27
133.0151062	1.68
135.0828552	4.74
136.9405212	0.64
137.7708435	0.15
140.8327484	0.90
143.0527649	10.45
143.8368988	0.19
144.7856598	0.78
146.9995422	2.34
149.1117859	0.58
149.9079285	0.40
151.0249023	2.17
152.0861359	0.97
153.0655212	0.34
155.1409454	0.43
157.0603333	1.43
158.1188049	0.12
158.9176025	1.48
160.912384	0.51
163.2712708	0.16
165.2121582	1.64
166.8295898	1.44
167.4309845	0.10
168.9355164	5.67
169.9054108	0.60
171.286499	0.43
173.2021027	3.57
175.0617371	1.30
176.9671631	0.48
179.284729	0.36
181.2502441	0.74
182.9682617	1.53
183.8613586	0.17
185.0967102	1.73
187.1179199	1.83
188.841217	0.10
191.1482849	0.12
193.0578308	0.98
195.0625	0.71
197.1542664	1.75
198.2226562	0.85
199.1407471	0.55
201.1419678	0.88
202.9731445	1.03
205.1077576	0.61
207.1401367	0.19
209.1821899	0.80
210.4448547	1.25
211.131897	2.61
215.1389771	2.94
217.3331604	0.68
219.3462524	0.88
223.2176208	1.74
225.2190247	0.13
226.2131348	0.32
227.1733093	0.23
228.166748	4.47
229.1051636	5.11
230.1437988	0.67
231.2449036	0.77
233.2166748	1.88
234.3227844	0.31
235.2565308	0.50
238.2244263	0.33
241.2508545	0.85
243.2255249	1.89
244.4703674	1.40
245.245697	1.33
247.0942993	9.16
247.9464722	0.29
249.0937805	0.29
250.0891113	0.28
251.3866577	0.44
253.0941772	0.92
256.9624634	0.52
261.3239136	0.17
263.2736511	0.11
265.0455627	0.85
267.2598267	0.17
269.421051	0.35
271.2078857	0.33
273.3223877	0.13
275.3479614	0.62
279.1502991	0.16
283.2091675	0.64
287.3689575	1.50
288.3462524	0.09
295.2331543	4.02
299.1570435	2.04
299.9459229	0.92
305.2769165	3.87
306.2121582	1.22
310.3253479	0.11
312.9359741	0.15
314.1793823	0.74
323.230896	100.00
324.2756042	0.97
325.2193604	0.20
327.1762695	0.39
331.7235718	0.64
337.2582703	0.28
341.4224548	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
98.8384323	0.09
100.9867706	7.70
102.7859802	0.15
105.9937897	0.22
106.8551636	0.08
112.9515533	18.23
114.8886414	0.34
118.9957199	16.57
125.0129623	1.28
130.9469299	6.97
143.0810242	18.93
148.9916687	3.93
155.1004333	0.07
158.0748901	0.25
161.0333557	19.89
179.0358582	100.00
220.4932556	0.08
221.3202820	0.76
280.8792725	1.39
281.4949951	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	156.0763
Annotation	L-Histidine
Peak:m/z	Relative Intensity
83.0020447	0.34
84.8540497	0.14
93.1108856	0.03
94.9600372	2.51
109.9258423	100.00
110.7867279	0.11
112.0138092	0.53
137.9793701	0.84
138.8707123	0.12
156.1070099	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	491.162
Annotation	Unknow
Peak:m/z	Relative Intensity
149.0084839	100.00
171.8833923	0.25
208.6598053	0.20
235.2558136	0.08
266.7997742	0.11
281.0403137	0.25
282.8406067	0.18
285.4232788	0.18
310.0220947	0.06
311.5205078	0.13
316.2556458	0.21
328.0733643	0.48
341.3009033	0.07
358.0062256	0.10
369.7843018	0.40
371.2877197	0.24
380.0590820	0.24
385.1997375	0.25
407.2534485	0.13
412.3754578	0.05
425.9781189	0.07
445.0226440	0.20
461.5443420	0.19
473.1205139	0.32
473.9277649	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2255
Annotation	Citbismine C
Peak:m/z	Relative Intensity
263.3804321	0.05
339.2423096	0.16
341.1808167	100.00
385.1459961	0.04
400.8342896	0.09
559.1316528	0.10
561.1629639	0.10
597.1002197	0.05
606.9971924	0.16
609.4669800	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0028
Annotation	SC-58125
Peak:m/z	Relative Intensity
128.9832764	0.51
172.8986511	1.75
191.0312805	100.00
191.7060547	0.06
212.9990997	0.22
228.9146881	0.05
235.1586914	0.05
241.0662842	0.44
255.3058167	0.10
259.0205688	0.17
272.6962891	0.43
298.7561646	0.19
305.1988220	0.07
308.1522217	0.07
316.9353638	1.36
341.1103516	0.26
343.1433105	0.06
359.0727234	0.30
377.1184387	0.06
383.3302917	0.15
384.6241150	0.61
402.9287415	4.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	416.1538
Annotation	Unknow
Peak:m/z	Relative Intensity
122.1243744	0.10
138.0034790	0.58
144.1419067	0.21
151.1690216	0.35
152.0066528	0.51
155.9963684	0.09
162.8517609	0.41
166.3443298	0.12
171.0896301	0.07
172.4031677	0.08
174.8682556	0.06
178.9564514	0.84
180.1284180	0.42
180.9788818	1.99
194.0468750	16.44
201.1767883	0.14
204.9880981	0.39
212.0152588	1.39
215.1844482	0.15
216.2589111	0.13
229.2119751	0.60
235.0954285	0.90
236.3287048	0.49
240.0437927	0.08
246.0068665	0.16
247.0819397	0.21
254.0477905	100.00
256.7037354	0.13
258.2229919	0.15
267.2807922	0.19
268.1950684	0.06
269.7719421	0.19
273.9254150	0.11
280.2191772	0.05
281.1311951	0.07
284.9868164	0.58
286.2500000	0.92
287.0640564	1.97
295.3182373	0.07
297.2870789	0.15
299.3150635	0.22
306.2733765	0.65
310.0250549	1.10
327.2315063	0.63
330.2503357	0.34
332.2666016	0.20
340.8596191	0.35
349.6294556	0.44
352.1935425	0.06
353.0703125	0.10
360.5647278	0.24
362.1694946	0.26
362.8019714	0.38
371.2798767	0.22
372.3316345	0.24
373.1213074	0.49
374.1902161	0.25
384.2651672	0.07
385.5569153	0.16
387.9983215	0.13
390.3434448	0.13
392.8570862	0.42
398.4175110	1.78
399.1899109	0.43
403.8206787	1.05
407.0257263	0.36
408.2040405	0.67
409.6575012	0.72
415.3393555	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
79.01623535	0.82
81.04776001	1.46
82.95855713	1.84
90.97601318	0.41
93.21372986	1.08
95.02046204	4.98
97.07595825	2.30
98.9107666	1.28
101.7701111	1.00
102.8115997	3.39
104.9551697	1.72
105.9690552	0.74
109.0677338	1.75
110.9697723	3.19
112.8199463	1.44
116.4789429	0.99
117.1255798	1.03
119.0088501	3.73
121.105896	2.55
123.04776	10.60
124.3181763	0.69
125.3056335	0.92
127.0430298	3.40
127.8519592	0.68
128.9834137	8.21
130.9130249	0.99
135.0759888	1.49
136.2691956	0.33
137.0764923	4.27
139.1052246	2.16
140.9977875	1.96
142.1412811	0.68
145.2623749	0.47
146.9117432	0.35
149.0031433	3.12
150.9355011	76.04
152.02211	7.61
153.1365509	2.07
155.1274261	3.70
158.9676361	3.72
160.8591461	0.50
161.9238129	0.27
163.1139679	0.42
166.5943146	0.24
168.1441193	0.65
169.1373291	1.63
172.9154968	0.76
175.08461	5.37
177.1055603	4.34
177.8950043	0.33
178.688858	0.94
179.4062958	1.84
182.0901337	0.65
183.1556396	2.74
185.1999512	2.88
186.0065155	0.44
189.033432	2.38
191.4346619	0.19
193.2189484	0.76
194.6481476	1.83
195.2663116	1.44
197.1725311	4.37
199.3309021	1.19
200.1391144	0.33
201.2495575	0.35
207.178421	6.45
208.2042542	0.32
209.3108978	2.70
211.2254791	9.86
217.2188263	21.69
225.1384735	16.91
225.9758301	1.50
232.1861115	0.70
235.132309	57.19
236.2422028	0.24
238.134079	12.16
238.8790283	1.16
244.2590332	6.50
251.201355	0.56
253.0899811	100.00
254.1699371	26.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	364.79
Annotation	Unknow
Peak:m/z	Relative Intensity
178.7526093	0.02
181.0598907	0.04
196.8572235	1.75
212.8724213	24.87
215.9563141	0.15
216.9013367	0.02
237.1556702	0.07
239.2980957	0.09
262.9039917	0.04
265.8861389	0.07
274.0436401	0.70
275.1742859	0.08
280.8069458	100.00
281.7185059	0.06
292.0952148	0.21
293.2519226	0.10
296.7786255	42.71
304.9478760	0.15
317.8739929	0.18
318.9789124	0.36
320.7942200	0.02
337.1152954	0.14
346.1064758	13.80
347.1788635	2.18
348.1387939	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
88.9097214	0.11
98.9769745	0.46
101.0038910	7.35
103.0394135	0.39
106.7885513	0.80
112.8914719	19.42
115.0500336	0.46
119.0068665	16.40
125.0206375	1.31
130.9399414	6.30
141.0527344	0.17
143.0428772	19.71
149.0195007	5.87
160.8812866	22.49
177.2963562	0.18
178.9741211	100.00
182.7799072	0.11
205.3200073	0.37
220.9703369	0.49
277.1860352	0.63
281.0258789	3.39
286.1405945	0.10
291.2056885	0.28
294.7485352	0.43
295.3605042	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.1722
Annotation	Ethotoin
Peak:m/z	Relative Intensity
116.0325699	0.42
127.8722610	0.01
129.0565796	0.03
130.1190033	0.03
142.0378723	0.84
153.0356140	0.03
159.0633240	1.53
172.9837341	0.05
179.1346741	0.02
182.3374329	0.01
183.3326721	0.05
185.9617920	0.22
187.2427063	0.02
201.0007324	0.02
203.0449829	100.00
203.8927612	0.02
226.3783875	0.02
227.1940308	0.11
241.0907288	0.03
244.1968994	0.10
254.2070618	0.03
271.0411682	0.02
289.2628784	0.02
291.1409912	0.10
307.2261353	0.23
319.0854797	0.01
321.3981934	0.08
329.3381042	0.03
332.9367981	0.01
339.1564331	0.07
361.1312866	0.55
361.9768677	0.04
363.2259827	0.01
371.1929932	0.07
376.3692322	0.03
388.9929810	0.21
389.7313538	0.12
397.7003479	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.1407
Annotation	t(6)a
Peak:m/z	Relative Intensity
120.1291504	0.09
121.1598053	0.07
127.6789169	0.04
135.9039154	0.12
147.1395264	0.05
162.0239716	1.60
162.9840851	0.02
164.228653	0.08
166.3381348	0.14
187.2205048	0.08
209.3339539	0.10
213.0596008	0.07
217.0693207	0.06
217.682373	0.03
221.8923187	0.19
230.211731	0.06
231.2445679	0.08
232.1446228	0.20
232.8444214	0.05
249.4416809	0.07
251.0072327	0.22
258.1388855	0.08
267.0956116	2.35
268.192627	3.40
277.2871704	0.04
279.3914185	0.06
281.0976562	100.00
290.6109619	0.03
291.3359375	0.04
293.5308228	0.02
294.1573486	0.73
301.4741211	0.09
308.8187256	1.07
309.5259399	0.02
314.2448425	0.21
315.2533569	0.10
330.1885986	0.10
331.7067871	0.25
333.3302307	0.09
339.366333	0.17
342.4074707	0.24
351.4796753	0.13
353.2128296	0.06
356.5151672	0.05
359.1469116	0.28
361.5619202	0.15
367.0020447	0.06
367.9792786	0.08
369.1424255	0.10
369.993866	0.17
377.1752014	0.75
380.6434631	0.36
385.0809326	1.32
389.2603455	0.13
395.1706848	0.78
395.9530945	0.04
398.3814697	0.18
400.4919739	1.07
401.7341919	0.67
403.5418701	0.15
404.6821594	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	328.14
Annotation	N-(1-Deoxy-1-fructosyl)phenylalanine
Peak:m/z	Relative Intensity
104.0219955	0.07
114.0513153	0.04
120.0337067	0.09
130.1703339	0.05
130.9765625	0.06
133.0241547	0.02
134.4250793	0.05
136.1621094	0.02
137.0739594	0.04
147.9061127	0.01
149.0744934	0.03
163.0438232	0.08
166.0920715	0.75
170.8205261	0.05
175.0636902	0.08
176.1715698	0.04
183.9909515	0.07
185.2591095	0.02
199.3388977	0.05
205.9506073	0.02
207.2239685	0.05
213.9674683	0.03
215.0241089	0.03
215.8942566	0.04
222.1614990	0.02
224.1263733	0.02
228.0835571	0.05
229.2396851	0.08
232.8698120	0.02
234.0501404	0.20
239.1004028	0.06
242.0897522	0.12
244.1078186	0.02
244.9811707	0.02
250.7808228	0.24
252.0568542	0.07
255.5971069	0.04
257.2625122	0.03
258.9234619	0.02
263.7824402	0.06
268.1563721	0.02
269.2564697	0.07
271.6702271	0.06
272.6817017	0.10
274.1239624	0.04
279.2028809	0.10
280.4280396	0.06
282.1934509	0.42
286.1131592	0.05
287.1093750	0.11
291.7685242	0.08
292.3844604	0.45
297.7152710	0.14
299.1864014	0.13
300.2035522	0.02
304.5311279	0.18
306.2971191	0.12
310.1669312	100.00
311.1674805	0.36
313.8902283	0.03
316.1275330	0.07
318.8011169	0.04
319.6943359	0.05
320.8783264	0.12
322.3737793	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.92440033	0.18
100.7133331	0.08
105.1005478	0.26
107.0391846	0.67
108.9403	1.37
110.938858	0.74
116.766716	0.09
118.9752808	0.13
121.0478592	4.45
122.9773102	1.13
124.9514771	0.66
126.7633438	0.13
129.0388794	0.25
130.8832703	0.22
132.9620667	1.12
134.9144745	3.29
137.0779572	0.18
138.6799927	0.12
141.0050354	0.25
142.9827423	1.61
144.8828735	0.19
147.0031281	3.21
149.0113525	2.19
151.1483765	0.60
153.1838074	0.24
154.9217224	0.17
157.0499573	1.02
158.9621124	0.83
161.0930176	1.83
163.09758	0.72
165.0700684	0.22
166.0790405	0.11
166.8442688	0.07
168.9770508	0.88
171.0657959	0.41
173.0917358	1.16
175.0885468	1.12
177.1291199	0.79
181.0646362	0.37
183.0176392	1.22
185.3136139	0.13
187.0935364	1.39
189.1014709	0.73
191.0561371	0.17
196.9759216	0.76
199.070282	0.31
201.0863953	0.84
203.0881958	0.56
205.2620239	0.51
206.0581665	0.06
206.9630127	0.20
209.2881775	0.22
211.1260376	0.91
215.1227722	0.23
217.1985474	0.89
219.4707031	0.10
221.171936	0.09
222.9694214	0.20
224.9157715	0.14
227.2238159	0.69
229.0105896	0.99
230.3343811	0.08
231.1019897	1.30
233.0144043	0.41
235.2445374	0.28
237.2531433	0.12
238.2479248	0.15
239.1914673	0.31
241.2116089	0.33
243.5292358	0.11
245.3079224	0.30
246.3496399	0.17
247.2260132	5.40
251.2068481	0.15
252.354248	0.24
253.0796509	0.59
255.3583374	0.50
259.1907349	0.99
261.2369995	0.14
263.2084351	0.17
265.3679199	0.06
267.1803589	0.41
269.3224487	0.43
271.1764832	0.55
273.402832	0.33
277.3276062	0.50
279.2478638	0.07
281.3264771	0.78
283.196228	0.52
285.2311707	0.23
287.2901001	0.94
295.3440552	1.72
296.2796021	0.09
299.3538513	0.76
300.1258545	0.16
305.3132935	2.54
307.4229431	0.08
308.9310303	0.10
309.9642334	0.25
313.0023193	0.19
314.5776978	0.07
321.1291504	0.09
323.2476196	100.00
324.2703857	0.62
326.2619019	0.18
332.6702271	0.45
341.2409668	1.04
342.7187805	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0806
Annotation	Unknow
Peak:m/z	Relative Intensity
118.9144592	0.01
135.9845886	24.29
139.8580627	0.01
146.8247833	0.07
154.1145477	0.04
164.9394989	100.00
166.0115814	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.8968658	0.16
106.97509	1.55
108.990799	1.88
111.0825577	0.68
116.8962708	0.52
118.9386139	0.09
121.0048065	5.33
122.9332657	1.96
125.0971603	0.23
128.8882141	0.09
130.9387207	0.37
132.9959717	0.84
133.6570435	0.04
135.0799255	6.93
135.9544678	0.06
137.1328125	0.81
139.0876617	0.03
140.919281	0.31
142.975647	1.43
144.8383789	0.26
146.9109955	1.11
148.9933167	3.32
150.9954224	1.32
152.1138611	0.06
152.9642029	0.17
154.8153992	0.12
157.0822754	1.62
158.9972992	0.62
161.0588989	2.36
163.1150665	1.83
165.0514984	1.67
166.973114	0.50
169.0484314	1.25
171.0158844	0.72
173.0110779	1.48
175.0457458	0.95
177.1560974	0.79
179.1883087	0.29
181.1004181	0.11
182.9303589	1.15
184.7740936	0.06
185.3782349	0.05
187.0869751	1.42
189.1622009	0.52
191.1174316	0.62
193.060257	0.34
193.9276123	0.13
195.1610107	0.18
197.0402832	0.39
199.0116882	0.37
200.0209351	0.05
201.1649628	0.83
203.0514832	0.49
205.1489258	0.39
207.302887	0.07
209.213623	0.06
211.0427856	0.82
211.8365784	0.18
213.242218	0.08
215.2079773	0.57
217.087677	4.44
219.1126404	0.25
221.3451538	0.11
223.1931152	0.69
224.0822754	0.05
225.2166748	0.44
226.0717773	0.05
227.1352539	0.15
228.3779297	0.07
229.1386108	0.41
231.1034241	3.71
232.4635925	0.18
233.1122742	0.04
234.422699	0.06
238.9665833	0.17
241.1899719	0.59
243.1290283	0.58
245.1412659	2.10
247.2590332	7.76
249.2648315	0.24
251.2000427	0.36
251.9884033	0.07
252.9899597	0.49
254.9980469	0.13
257.2528687	0.55
259.2911072	0.75
263.2747498	0.12
264.3340149	0.05
267.1681519	0.09
269.3702698	0.13
270.5726013	0.06
271.1891174	0.65
273.2946167	0.02
277.0424194	0.03
279.380188	0.38
280.1511841	0.09
281.1286926	0.37
282.9608765	0.56
285.074646	0.25
286.9715576	0.11
287.8314209	0.09
292.3605652	0.04
293.2088013	0.07
295.25	1.17
297.3776245	0.16
299.2704773	2.19
300.0953674	0.04
305.2276611	2.52
306.0133362	0.07
309.2030334	0.10
311.5500183	0.03
313.4068604	0.63
314.4359436	0.24
323.2458801	100.00
324.1905823	0.39
326.2592163	0.15
340.4107361	0.30
341.2311707	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.95748138	0.10
100.8423996	0.12
105.0912781	0.13
106.9313202	1.33
108.9582291	1.99
110.9431763	0.28
117.0168304	0.24
118.9926605	0.09
120.9957047	2.15
123.0444412	0.76
124.9686279	0.03
128.9772034	0.31
131.0057983	0.42
132.9823608	0.65
135.0353088	2.88
137.1449432	0.59
138.914444	0.09
141.1616974	0.27
143.0008698	0.86
145.0593567	0.03
146.975647	1.38
148.9704285	1.81
150.9250183	0.73
153.2957458	0.07
155.134552	0.02
157.035553	0.70
157.9147644	0.06
159.0171204	0.60
161.0116119	2.22
163.0300598	0.99
165.0033264	0.21
166.3523102	0.08
167.1097107	0.25
169.1187744	0.43
171.0575867	0.17
173.1007385	0.75
174.2440948	0.21
175.077179	1.11
177.0999756	0.54
178.9713135	0.26
181.2828217	0.21
183.096283	0.55
185.1022644	0.29
187.086792	0.85
189.0084381	0.96
191.2242126	0.51
192.1358795	0.03
192.8941956	0.18
195.2867126	0.13
196.2253418	0.03
197.1783295	0.28
199.1181641	0.15
201.0926666	0.15
203.0892944	1.00
205.2937622	0.68
207.2900085	0.04
209.1956177	0.26
211.0828552	0.44
213.148407	0.11
215.186676	0.40
217.1412048	1.08
218.0583801	0.03
219.0563049	0.13
221.0275269	0.11
223.1314392	0.18
225.1424561	0.24
227.0089417	0.42
229.0057678	0.26
230.0048218	0.07
231.1890564	1.25
233.1557922	0.21
239.0696716	0.14
241.0091858	0.25
243.1924438	0.39
245.1939697	1.30
245.7941284	0.09
247.330719	4.71
248.3590088	0.08
251.0363159	0.15
253.062439	0.30
255.2698364	0.26
256.2122192	0.06
257.2879639	0.49
259.1769409	0.64
264.3478394	0.02
265.3383789	0.14
267.3981018	0.08
269.2477417	0.17
271.2198792	0.32
277.2837524	0.12
279.3019104	0.16
281.270813	0.60
283.1323853	0.33
285.3210449	0.21
287.2177429	0.43
293.8879395	0.05
295.3652344	0.49
297.3154297	0.12
299.1528015	0.97
300.0614319	0.46
301.3052673	0.07
303.3346558	0.13
305.2717896	2.66
310.2084045	0.09
313.2840881	0.35
317.9917297	0.07
319.6290894	0.32
323.2460938	100.00
324.2506104	0.19
326.2537231	0.14
331.9025269	0.05
338.9476318	0.03
341.2884216	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2783
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
196.1884155	0.42
214.1443481	1.84
235.7569885	0.03
279.2675171	100.00
325.2691040	0.05
333.8639221	0.12
341.2122803	0.07
371.9956360	0.06
380.1798706	0.14
386.2216492	0.06
387.9172668	0.07
390.2922058	0.04
392.9467468	0.05
402.9951172	0.05
430.2095032	0.30
432.0000610	0.09
432.9915771	0.08
440.3473206	0.31
444.5305176	0.10
447.0969849	0.09
448.0275879	0.12
456.3208618	0.22
457.7747803	0.42
458.6716614	0.37
459.3699646	0.12
475.5572205	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.1689
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
93.00949097	0.18
111.0341492	0.32
112.923645	0.23
119.083374	0.18
120.1620941	0.19
153.2673645	0.15
169.9915466	5.44
171.1634979	0.75
177.206665	0.14
180.9606323	0.33
183.0100098	100.00
184.0608826	12.93
185.1419067	0.54
186.9213257	1.22
197.0410767	2.55
197.9953308	7.42
199.0936279	1.03
206.9588318	0.16
208.1387939	0.59
211.3327332	0.52
212.117218	2.03
212.9518738	0.52
223.2052917	0.33
225.1387329	2.90
226.1584473	2.52
227.1207275	0.50
231.381897	0.49
237.2158203	1.45
239.2153931	7.70
240.1846313	0.60
241.9768372	0.87
243.3406067	1.30
247.2834473	4.01
248.3580322	0.14
249.3482361	5.93
253.2806396	0.52
254.171051	0.37
255.5915527	0.90
261.0988464	0.22
263.0271606	0.43
267.3478699	4.26
270.2391052	0.14
270.9053955	0.15
275.0853271	0.22
283.1650696	1.17
293.1755981	11.84
294.164978	0.54
311.2915649	14.83
312.3948059	3.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	Lactulose
Peak:m/z	Relative Intensity
97.0101852	0.14
99.1027985	0.19
100.9964447	5.39
106.9294968	0.19
113.0206299	19.04
115.2124023	0.32
118.9326019	12.69
124.9592896	1.94
130.9859009	6.82
142.9789886	18.05
148.9616394	4.03
158.8356018	0.16
160.9956055	20.24
178.9762726	100.00
209.2448425	0.08
221.2330933	0.65
280.7752686	1.59
295.2129211	0.99
297.0377808	0.11
323.2566528	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	762.67
Annotation	Unknow
Peak:m/z	Relative Intensity
231.7579651	0.08
251.1054535	0.07
258.9667969	0.06
274.9441528	0.76
290.8096924	1.82
292.7055969	0.13
343.1067505	0.42
358.7672119	1.48
374.7027588	0.68
405.1182861	0.04
426.1647339	0.44
426.8424683	3.91
442.5892944	9.65
443.3456421	0.05
445.0656128	0.16
458.4858398	2.96
510.6005859	24.06
511.2567749	0.06
526.6321411	42.49
542.4718628	4.94
549.6070557	0.14
554.8813477	0.03
568.0858765	0.07
572.5891113	0.06
582.7620239	0.21
590.5646973	0.03
591.6588745	0.06
594.5045776	40.43
595.3413086	0.07
596.6282349	0.68
600.2251587	0.04
608.6399536	0.13
610.0098267	3.70
610.6138306	21.60
625.8344727	0.13
626.7310181	1.43
629.5256958	0.25
631.7686768	0.13
632.8869629	0.91
656.3185425	3.42
656.9432983	0.14
661.0759888	0.13
675.9866943	0.11
678.4160156	100.00
679.4767456	0.22
693.6497803	0.08
694.4592896	2.20
702.3641968	0.05
714.8655396	0.03
716.0947876	2.55
716.8375854	5.40
731.3772583	0.12
739.6760864	0.10
745.4450073	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	631.5721
Annotation	Unknow
Peak:m/z	Relative Intensity
190.3110352	0.17
201.3265228	0.19
208.4170074	0.15
226.3193054	0.08
227.8210907	0.14
235.0615845	1.68
263.1523743	1.00
263.9270630	0.17
279.1401978	0.81
280.3294678	0.09
289.1943970	0.25
293.9664307	0.22
297.2719727	0.09
325.3645020	0.11
338.4677734	0.12
340.8308105	0.07
375.8460693	0.46
376.4827881	0.29
394.2205811	1.05
410.1058960	0.50
412.7993774	0.24
415.4493408	0.17
431.7745972	0.15
432.4851074	0.18
433.4183350	0.12
446.5509644	0.20
451.3701172	0.18
460.5299683	0.05
473.7258301	0.15
474.4133911	0.27
478.2202148	0.12
485.5357056	0.45
486.6895752	0.47
489.2135010	0.27
500.3867798	0.06
501.2962646	0.19
506.0642700	0.28
514.5466919	1.96
523.3092041	3.45
524.2413330	0.80
527.2805176	0.07
533.3908081	0.34
535.9971313	0.20
541.1303101	3.48
541.7709961	0.03
542.6754761	0.27
543.3607178	0.21
544.2336426	0.17
546.2481079	0.22
552.1078491	0.16
557.6105957	0.45
561.9732056	0.13
563.1616821	0.40
566.3493652	0.25
569.7684937	0.15
572.1387329	0.13
573.1243286	0.25
574.3004761	0.85
580.5154419	0.11
583.1727905	0.73
587.6096802	1.46
588.2642822	0.61
592.4749756	1.90
595.5491943	0.55
599.3309937	4.99
600.2517090	1.01
601.1895142	0.31
603.6449585	0.38
605.2989502	3.47
606.1166382	0.30
607.3103027	0.25
610.8260498	0.92
613.7189331	0.97
614.3579102	0.41
617.7876587	0.15
618.8187866	2.66
619.6419678	1.66
622.2460327	0.99
623.0155640	1.87
624.2562866	0.80
625.2902222	0.09
636.4066772	0.69
640.7697144	0.11
652.7345581	4.91
653.6459961	0.31
654.2728882	0.46
656.0692139	1.98
656.6736450	0.03
660.0488281	0.23
661.9244995	26.48
662.7637939	2.98
663.7230835	0.58
666.4624634	0.04
674.4661255	0.19
679.6176758	0.08
686.2417603	0.69
693.4017944	0.19
701.8607178	1.20
702.5427856	0.22
705.7868042	0.77
710.9735718	35.24
712.1361084	1.36
712.9635010	0.50
715.4826050	0.26
721.2118530	0.34
722.7431030	0.07
728.0417480	0.70
729.6773071	0.15
737.6494751	0.23
739.8961792	0.78
743.1717529	2.37
744.7489014	0.94
749.3875122	51.62
750.3703003	1.01
751.1528931	1.04
751.8236694	0.14
752.5881348	0.21
753.5800171	0.31
760.1506958	0.57
767.6880493	0.11
770.4709473	1.12
771.5305176	0.16
778.8814087	0.12
783.4483032	0.19
788.8817749	7.97
789.5691528	3.72
792.4584351	5.94
793.3684692	1.12
796.0851440	0.28
798.4028931	100.00
799.3706055	1.12
800.5863647	1.05
802.3866577	0.15
803.5988159	0.34
804.2130127	0.18
805.1170654	0.28
806.7380981	0.07
812.1948853	0.04
814.6845703	0.22
815.3583374	0.11
823.5800171	0.09
825.6240845	0.09
831.5593872	0.92
846.3945312	0.18
848.3833008	0.48
850.3254395	0.23
865.6494141	0.24
877.6213989	0.38
878.3777466	0.11
879.1768188	0.38
888.4682007	0.14
896.0999146	0.12
898.8010254	0.50
899.4780884	0.28
900.5488281	0.28
907.6720581	0.15
912.3417969	0.06
915.1110229	0.56
916.5151978	0.27
926.9907837	0.59
928.6237183	0.06
935.5795898	3.22
936.7931519	0.35
954.7350464	0.23
956.5449219	0.73
985.4064941	0.17
988.1846313	0.07
992.3348999	2.53
993.2038574	0.61
997.7002563	0.15
1005.6548460	0.22
1021.7078250	0.33
1065.7683110	0.64
1074.5898440	0.30
1083.3529050	0.14
1089.3100590	0.44
1094.0423580	0.13
1104.7697750	0.05
1111.6436770	0.26
1114.7568360	0.38
1119.4232180	0.33
1123.5085450	3.32
1124.1964110	0.29
1134.5158690	0.16
1142.9213870	0.33
1163.9515380	0.04
1214.7521970	0.05
1219.7708740	0.28
1347.9340820	0.45
1440.5843510	0.11
1458.8898930	0.12
1569.9333500	0.19
1574.7760010	0.09
1732.8396000	1.04
1760.7718510	0.08
1842.8405760	0.06
1889.4127200	0.07
1972.4646000	5.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0766
Annotation	Glutathione
Peak:m/z	Relative Intensity
99.0089340	0.55
110.9551086	0.46
116.1213379	0.31
119.7927780	0.13
125.0375748	0.03
125.9168167	0.09
128.0299988	9.63
130.0014648	0.15
135.1511536	0.04
142.9566803	10.32
143.9806213	0.14
145.0172729	0.33
146.0179443	1.36
153.0915222	0.22
154.9462585	0.07
160.0701599	11.08
164.6431732	0.06
166.1911469	0.08
167.1159973	0.97
169.1183624	0.06
170.1894226	0.06
171.1871033	1.09
174.9219818	0.07
177.0103455	9.01
179.0201569	9.60
185.0437775	1.14
192.1461029	0.16
197.1850586	1.86
203.0034180	0.03
210.0663147	4.02
213.0295105	2.68
225.8942261	0.04
228.1347961	0.65
231.1864319	1.52
236.0840454	0.54
242.1654663	1.43
244.1551819	0.07
254.0887146	97.11
260.1652832	0.25
261.7561035	0.28
272.0560303	100.00
284.5337524	0.05
288.1492920	64.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2782
Annotation	LysoPE(18:2w6/0:0)
Peak:m/z	Relative Intensity
153.1565247	0.10
166.9541016	0.06
195.9258881	0.09
214.1233826	1.16
226.13414	0.06
251.2863464	0.14
260.6334839	0.10
279.2372742	100.00
279.8551941	0.43
282.0508728	0.05
296.1743774	0.10
310.9941406	0.12
319.1958618	0.15
328.0081177	0.09
361.0949707	0.05
369.9059753	0.09
378.0377808	0.15
387.0182495	0.13
390.4781799	0.15
402.5713196	0.26
408.9736633	0.08
429.7183228	0.08
430.3222351	0.55
432.4292297	0.28
433.2406921	0.42
438.2057495	0.12
440.1872864	0.09
449.8675842	0.42
456.3782654	0.11
457.9938354	0.32
458.7541199	0.40
461.790802	0.06
466.9762268	0.04
475.9100952	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	274.96
Annotation	Unknow
Peak:m/z	Relative Intensity
115.0515747	4.87
116.1086578	1.09
117.0046844	3.93
125.2059784	0.03
131.0818176	0.23
131.8291016	0.09
132.8269043	0.27
158.9379883	100.00
159.9813385	17.27
160.9296265	93.92
184.8042450	0.08
187.1630554	0.02
199.0942078	0.18
199.8988647	0.23
201.0098267	4.63
216.8219604	0.08
218.9055786	1.12
229.0737000	0.52
230.9631958	57.55
247.0080566	1.36
249.1662598	0.07
257.1647644	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.2629
Annotation	linoleamide
Peak:m/z	Relative Intensity
81.06401825	0.21
82.9730835	0.15
83.90223694	0.16
85.8581543	0.06
92.94898987	0.32
95.02266693	1.71
97.08237457	1.00
98.10375977	0.09
99.0249176	0.07
99.99488831	0.64
104.9269791	0.36
107.105896	0.29
107.8350983	0.03
109.0411224	1.78
110.9377823	0.79
112.8061142	0.21
114.0184631	1.30
119.1444855	0.40
121.0475922	2.03
123.0149536	1.72
124.9694138	0.80
126.0862808	0.03
127.0333939	0.39
128.0948792	2.28
133.0391235	0.70
135.0364075	2.20
137.0807037	1.79
139.0393982	0.80
140.2798157	0.35
141.2149353	0.64
142.1211548	2.25
143.0571289	0.19
147.0966492	1.23
149.1010742	3.25
151.0233307	2.27
152.2730103	0.14
153.0872803	1.10
154.1018982	0.79
156.1623993	2.32
161.0647125	2.05
163.0785675	3.41
165.0471497	3.65
165.823822	0.10
166.9812317	0.50
168.0503845	0.68
170.1715851	3.71
173.1277771	0.20
175.2284851	1.80
177.138916	1.04
179.1336823	3.92
181.1108704	0.47
182.1955872	0.95
184.1513367	4.33
185.1746826	0.04
189.12677	2.72
191.2532959	0.36
193.1925964	0.59
196.0976868	1.32
198.1531067	2.81
203.0372009	1.37
204.4389038	0.13
205.3171997	1.25
207.1044617	0.87
208.4717407	0.12
210.1515198	1.84
212.0571594	0.20
217.0115967	0.41
219.2389526	0.60
220.0873108	0.05
221.3088074	2.26
222.2628174	0.08
224.0873413	1.92
230.781189	0.06
234.1842651	0.10
236.2545776	0.11
238.3268127	0.42
239.2387085	0.20
245.1547241	50.14
245.7592773	0.14
249.1251221	6.59
252.3997803	0.06
263.2460327	100.00
264.9858704	0.11
280.4761963	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2253
Annotation	Lactulose
Peak:m/z	Relative Intensity
208.1425171	0.01
281.1650696	0.03
323.0836182	0.03
341.1621704	100.00
341.8790283	0.11
471.2736816	0.03
502.3056030	0.02
664.8804932	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2872
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
120.9036255	3.82
128.0799561	5.46
128.7900543	1.95
130.9799957	5.68
132.9545898	4.43
149.0080261	3.90
158.2409668	1.61
161.1101685	6.27
163.1615143	1.09
177.0798645	9.22
178.1181335	3.26
178.8494568	3.83
181.846405	2.48
183.0883484	6.17
186.9664307	4.66
197.0861969	10.84
207.1616364	1.77
211.0962677	1.95
219.2867889	3.08
225.0534668	4.30
231.2472992	19.91
242.3945312	3.19
243.0914001	7.23
247.2952576	1.94
254.0700073	8.99
257.9223328	4.18
267.2023926	1.94
269.0794678	10.59
280.0012207	2.13
286.2172241	2.48
287.309082	4.60
288.2202148	3.95
291.0622559	3.09
296.0638428	6.11
304.2183228	2.89
308.2816162	2.66
311.3661804	4.00
327.4793396	14.66
332.1506958	3.67
333.7946472	5.20
335.250885	2.66
336.5228577	14.78
338.4003601	6.74
339.0074158	1.96
339.6571655	6.75
342.1362915	12.48
343.2110596	5.21
348.2508545	1.66
352.2171021	3.25
354.1223145	1.95
366.0306091	8.11
368.5082092	4.31
380.1078186	4.52
380.9844666	19.49
381.6529236	11.97
382.3418884	2.48
384.4273376	6.47
388.2007751	5.22
391.3589172	7.13
395.0240479	10.68
407.2636414	5.16
408.2799377	100.00
409.1871643	17.66
409.8657227	8.62
427.1528931	6.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1225.2126
Annotation	Unknow
Peak:m/z	Relative Intensity
382.3927002	0.25
384.2452698	0.06
393.2354126	0.38
395.3027344	0.30
399.5777893	0.18
412.2787781	0.21
421.2173767	0.46
422.3825989	0.14
431.0895996	0.14
435.3558960	0.09
439.4227600	1.96
440.3311157	0.30
454.3023071	0.14
459.2481689	0.19
472.9312134	0.22
474.3497925	0.12
478.4707642	0.35
479.3451538	0.04
483.4537964	0.11
484.1375732	0.09
493.9547119	0.06
494.9802856	0.21
504.0829163	0.16
505.9420471	0.09
507.5079346	0.09
517.5076904	0.07
521.3202515	0.27
523.4046631	0.43
524.2797852	0.33
527.3834229	0.28
528.1104126	0.13
534.3906250	0.49
538.2388916	0.22
539.6119385	0.32
552.3677368	0.62
554.6934814	0.26
556.4711304	0.30
561.2847290	0.11
562.2489014	0.17
563.4988403	0.10
581.2047119	0.16
596.5664062	0.15
597.2922363	0.16
607.7237549	0.04
609.5440674	0.38
610.3997803	0.09
615.4211426	0.15
617.3139648	0.09
625.3444824	0.06
636.5285645	0.09
637.1995239	0.13
644.1281738	0.09
646.7580566	0.14
648.6951904	0.10
653.5668945	0.33
669.5366211	0.15
673.6928711	0.08
675.1384888	0.14
697.3007812	0.47
699.5186768	0.22
718.6679688	0.55
723.8339844	0.25
725.1407471	0.25
726.1794434	0.17
735.7166748	0.19
736.8482666	0.11
740.3231201	0.38
741.1218872	0.14
748.2318726	0.30
755.4199219	0.63
757.5391846	0.13
763.3771973	0.24
772.4398193	1.02
773.5278320	0.45
774.4868774	0.56
775.5061035	0.19
778.5255737	0.08
783.3125610	0.24
785.1914673	0.25
788.2666016	0.69
791.5573120	0.20
804.6569824	0.12
808.4672852	0.80
813.7064819	0.49
815.6885986	0.24
818.4537354	0.43
834.5270386	0.13
836.2028809	0.15
839.3640137	0.19
841.5592041	0.27
858.5628662	0.25
867.1850586	0.27
869.7243652	0.11
872.5599365	0.42
880.0830078	0.09
881.8070068	0.34
882.4169922	0.17
905.4885254	0.12
920.1820068	0.62
921.8046875	1.25
932.0184326	0.29
934.4033203	0.11
937.5590820	0.20
943.1778564	0.29
945.5998535	0.08
946.3591309	0.23
947.5645752	0.19
949.3476562	0.30
955.0065918	0.18
956.9000244	0.32
959.5220947	0.66
960.2562256	0.32
961.2886963	0.61
963.9011230	0.23
965.8956299	1.40
968.3702393	0.16
970.2159424	0.90
973.2006836	0.62
980.9001465	0.32
986.6737061	0.50
987.5646973	0.24
988.4335938	0.24
989.6539307	0.71
994.8791504	0.63
996.7446289	0.20
997.4801025	0.32
998.1064453	0.60
999.6766357	0.80
1000.7396240	0.36
1001.3867190	0.36
1009.3348390	0.39
1009.9946290	0.14
1012.2817380	0.66
1013.9660640	1.32
1014.9007570	0.16
1015.5352780	0.35
1016.3489990	0.08
1018.2709960	1.59
1019.4682620	0.16
1020.8161620	0.54
1022.2888180	0.34
1023.1115720	0.27
1025.4279790	0.88
1026.7141110	1.66
1027.9777830	0.61
1028.8081050	0.18
1030.1635740	1.07
1031.3868410	1.22
1032.3229980	0.83
1033.4218750	1.23
1034.2824710	0.58
1035.1966550	0.34
1037.3273930	1.03
1038.9685060	0.52
1041.4433590	1.66
1044.3535160	1.09
1045.8852540	0.80
1049.6109620	0.21
1050.3408200	1.24
1051.7275390	1.48
1052.5140380	0.33
1053.5087890	0.07
1054.2937010	0.62
1055.7099610	0.22
1056.5932620	0.71
1057.8210450	1.19
1058.5954590	0.90
1060.0693360	2.40
1061.9207760	1.02
1063.6579590	0.31
1064.2935790	0.92
1065.3400880	1.10
1066.0205080	1.91
1067.7954100	1.65
1068.8181150	2.25
1069.7553710	0.37
1071.1308590	1.05
1071.9696040	0.90
1072.7822270	0.25
1074.1278080	0.91
1076.7089840	0.88
1077.6022950	2.49
1079.0859380	2.75
1080.6053470	0.09
1081.9560550	2.62
1082.6898190	0.28
1083.5310060	0.79
1084.4957280	1.46
1085.1845700	1.56
1086.9082030	0.54
1088.5531010	2.54
1089.4769290	1.41
1090.5407710	0.79
1091.4260250	2.10
1092.3059080	0.77
1093.2443850	0.86
1095.1096190	2.22
1095.9536130	1.21
1096.8974610	0.68
1097.8333740	0.53
1099.3516850	1.19
1100.5373540	3.01
1101.2509770	0.85
1102.8920900	1.11
1103.5522460	1.73
1105.3507080	1.47
1106.2265620	5.30
1107.4086910	2.64
1108.5043950	2.04
1109.4296880	2.62
1110.1989750	0.17
1111.8074950	5.03
1112.8127440	1.38
1114.3088380	0.42
1114.9852290	10.25
1115.8580320	0.77
1116.6339110	3.23
1117.4074710	5.17
1118.5452880	1.18
1119.3129880	2.66
1120.8493650	2.03
1121.6435550	1.52
1122.2446290	0.49
1123.0341800	0.56
1124.5418700	3.82
1125.6420900	2.42
1126.9833980	2.69
1127.9896240	4.21
1128.5932620	0.08
1129.6862790	0.47
1130.9764400	2.32
1131.8470460	0.47
1132.8134770	0.53
1133.8962400	20.81
1134.9080810	4.03
1135.9517820	5.05
1136.7922360	0.42
1137.7570800	2.01
1138.7255860	2.40
1139.9851070	2.71
1141.0791020	2.79
1142.2392580	1.14
1142.9622800	0.75
1144.1556400	7.05
1145.2373050	10.15
1146.5482180	1.93
1147.2886960	0.68
1148.5173340	5.17
1149.7181400	9.55
1150.4487300	6.98
1151.3566890	3.52
1152.2468260	1.59
1153.3481450	1.89
1154.1108400	0.35
1155.4082030	4.00
1156.4887700	3.09
1157.4971920	0.73
1158.6193850	4.34
1159.6988530	1.60
1160.8636470	2.98
1161.6896970	0.80
1162.5424800	1.09
1163.9217530	1.56
1164.6516110	13.49
1166.0809330	2.82
1166.9177250	1.54
1167.7895510	13.69
1168.8674320	0.89
1170.8508300	4.93
1173.1395260	44.53
1173.8176270	52.43
1174.6411130	1.18
1176.0103760	3.34
1176.8399660	17.58
1177.9877930	2.69
1178.8125000	2.23
1179.6945800	0.22
1180.4945070	0.40
1182.7714840	100.00
1183.5983890	12.77
1184.7972410	1.06
1185.5771480	0.58
1187.0419920	2.13
1187.8341060	4.72
1188.5450440	7.94
1189.1896970	15.10
1189.9552000	0.74
1190.8597410	0.13
1192.0709230	1.19
1193.3242190	6.66
1194.1462400	2.23
1194.9671630	0.56
1196.5863040	2.76
1197.5664060	0.68
1198.6951900	0.48
1199.8134770	1.78
1201.0654300	1.09
1201.6975100	0.55
1202.7218020	2.34
1203.5926510	0.58
1204.8698730	1.85
1205.6229250	1.27
1206.7730710	1.14
1208.6157230	7.52
1209.4946290	0.80
1211.1610110	13.78
1212.2398680	1.44
1214.5471190	1.23
1215.6683350	0.64
1217.4055180	0.07
1236.6857910	0.21
1242.5025630	0.41
1243.7788090	0.27
1244.3968510	0.10
1246.0007320	0.26
1248.9934080	0.14
1250.9470210	0.69
1251.8381350	0.33
1252.9060060	0.71
1256.8524170	1.03
1260.1752930	0.24
1271.9721680	0.47
1274.6531980	0.25
1276.2923580	0.25
1277.7906490	0.15
1278.7593990	0.16
1280.8649900	0.68
1281.5235600	0.95
1282.2153320	0.26
1282.9832760	0.47
1286.1149900	0.14
1288.5161130	0.24
1289.3874510	0.47
1291.8287350	0.36
1295.4494630	0.29
1298.3050540	0.27
1299.6645510	1.10
1300.4154050	0.28
1301.9730220	0.13
1303.0415040	0.47
1304.5551760	0.11
1308.2197270	0.47
1309.9609380	0.40
1310.6397710	0.20
1311.7575680	0.74
1313.6899410	0.83
1314.6175540	0.34
1317.4580080	0.48
1319.4069820	0.12
1321.5052490	0.22
1322.5783690	0.77
1323.2230220	0.46
1324.7410890	0.50
1330.4238280	0.20
1331.3958740	0.52
1333.5175780	0.44
1334.9227290	0.83
1340.7373050	0.26
1343.4595950	0.07
1344.7802730	0.13
1345.7426760	0.09
1348.7651370	0.37
1349.4940190	0.22
1350.2368160	0.38
1351.9266360	0.08
1353.8557130	0.92
1355.1861570	1.74
1356.3325200	0.32
1359.4429930	0.30
1361.7818600	0.15
1363.9948730	0.08
1365.0513920	0.26
1365.7899170	0.54
1367.0532230	1.25
1367.9248050	0.45
1370.0490720	0.44
1371.3095700	0.85
1372.8535160	1.01
1373.6949460	0.38
1375.2268070	0.29
1376.3767090	0.35
1377.2758790	0.43
1378.5422360	0.74
1379.3818360	0.11
1380.5550540	0.18
1381.6732180	0.56
1383.0516360	0.37
1385.8142090	1.03
1387.3107910	2.16
1388.2457280	1.04
1388.9454350	0.70
1392.6979980	1.30
1393.5172120	0.13
1395.4742430	2.10
1396.2132570	1.61
1397.5223390	0.18
1398.5661620	0.34
1399.2126460	0.65
1400.3912350	0.89
1402.4875490	0.39
1403.8281250	1.31
1404.7296140	0.65
1405.5485840	0.35
1406.3009030	0.23
1408.6710210	0.61
1409.7531740	0.46
1410.5457760	0.16
1411.2423100	0.09
1412.0362550	0.79
1413.5375980	1.18
1417.0972900	0.17
1417.8336180	1.10
1420.1628420	0.89
1422.6829830	0.65
1423.3465580	0.93
1424.0870360	0.16
1425.0197750	0.97
1425.7354740	0.26
1426.6345210	1.30
1427.7291260	0.35
1428.9862060	0.23
1430.9202880	0.86
1433.7329100	0.61
1436.1846920	2.56
1436.8696290	0.60
1437.8308110	0.40
1439.9986570	0.53
1442.0499270	0.25
1443.0788570	1.76
1443.9449460	0.82
1446.0330810	0.33
1447.2845460	0.49
1448.4757080	0.94
1449.5599370	0.65
1451.1674800	1.54
1452.8099370	2.33
1453.8688960	1.93
1455.0157470	0.14
1455.8065190	0.45
1456.8120120	1.01
1457.7376710	0.44
1458.9342040	0.34
1461.1868900	1.06
1462.0211180	0.16
1462.9630130	0.54
1463.9471440	0.67
1464.9926760	0.62
1465.6187740	0.08
1467.3377690	1.25
1468.6711430	1.13
1469.7733150	1.78
1470.5886230	1.62
1471.2647710	0.08
1472.2525630	0.24
1473.7747800	0.69
1474.9857180	0.34
1475.6710210	0.75
1476.3403320	0.40
1477.1658940	1.13
1478.5435790	0.25
1479.7406010	1.19
1481.4310300	2.56
1483.6579590	3.24
1484.4687500	0.27
1485.2628170	0.15
1486.8887940	0.55
1488.7194820	1.57
1489.4403080	0.07
1490.2716060	0.37
1491.4409180	1.19
1493.5019530	1.86
1494.5878910	0.96
1495.6456300	1.33
1497.0208740	1.24
1497.9134520	3.31
1499.2000730	3.34
1499.9698490	1.65
1500.7924800	0.22
1502.0076900	0.91
1504.5449220	1.87
1506.0035400	1.67
1506.6729740	0.68
1507.4139400	0.56
1509.3664550	0.83
1510.3614500	0.72
1511.3265380	1.59
1512.3533940	2.67
1513.5588380	1.35
1514.7435300	0.54
1515.6195070	0.92
1516.6649170	0.27
1517.5147710	0.41
1518.1680910	0.14
1518.8792720	0.86
1519.7384030	0.27
1520.6657710	0.79
1521.9442140	2.02
1523.1177980	0.76
1524.6099850	1.08
1525.2968750	0.78
1526.0424800	0.51
1527.1125490	4.63
1528.3590090	0.32
1529.6514890	0.50
1530.8535160	0.44
1531.7756350	0.25
1533.4317630	0.92
1534.7469480	5.78
1535.6832280	1.91
1536.5673830	0.16
1537.7982180	0.29
1539.6323240	1.35
1540.7603760	1.70
1542.2314450	1.48
1544.9287110	1.70
1545.6525880	1.14
1546.7486570	0.34
1548.5190430	0.46
1549.5222170	2.64
1550.3344730	0.56
1551.5524900	1.19
1554.0448000	6.57
1555.2445070	2.03
1556.5881350	2.43
1557.4375000	0.29
1558.7006840	3.12
1559.9451900	0.60
1561.0015870	0.45
1562.8660890	9.07
1563.6416020	7.24
1564.5262450	5.09
1565.8986820	0.81
1566.5135500	0.08
1567.2548830	0.48
1568.6282960	0.59
1569.9079590	1.31
1570.8778080	1.03
1572.2270510	0.86
1574.2583010	2.24
1575.6641850	1.75
1576.5974120	0.59
1577.5836180	0.84
1579.0720210	2.58
1580.0079350	0.72
1580.6361080	0.65
1581.5478520	0.90
1582.1965330	0.39
1583.5018310	3.46
1584.4107670	1.28
1585.2677000	0.93
1586.2457280	0.87
1587.1567380	0.93
1589.2650150	0.51
1590.2406010	1.32
1591.9224850	1.14
1592.9891360	1.64
1593.9252930	1.34
1595.7625730	0.93
1596.3731690	1.13
1597.6063230	1.82
1598.4061280	1.59
1599.5286870	0.66
1600.1542970	0.18
1602.0654300	0.97
1603.2108150	1.63
1603.9006350	1.10
1604.9000240	0.49
1606.6361080	4.96
1607.6628420	1.46
1608.4334720	2.33
1609.6223140	0.68
1610.8565670	5.50
1611.5025630	0.03
1612.7362060	0.68
1613.8658450	1.74
1614.8850100	1.99
1615.7872310	2.22
1616.8056640	0.05
1618.4916990	1.98
1619.5855710	5.63
1620.4167480	3.71
1621.0456540	2.22
1621.7795410	2.31
1622.4832760	1.84
1623.3756100	2.39
1624.4261470	1.39
1625.2290040	0.91
1625.9205320	0.18
1626.9132080	0.93
1628.5067140	0.30
1631.1998290	5.06
1632.4180910	3.26
1633.5632320	0.76
1637.0086670	1.37
1639.3814700	1.31
1640.0916750	1.23
1640.9298100	0.74
1641.7690430	0.86
1642.4267580	0.15
1643.4166260	0.59
1644.7493900	1.76
1645.6517330	0.86
1646.4958500	1.14
1647.2149660	0.39
1648.2198490	1.91
1649.2335210	0.75
1650.0710450	1.00
1650.7980960	0.22
1651.6749270	0.59
1653.0740970	1.90
1653.8804930	0.91
1654.6214600	0.45
1655.5914310	0.42
1656.6834720	0.58
1658.2237550	2.27
1659.0316160	2.24
1659.7882080	1.28
1660.9658200	1.89
1662.4406740	3.31
1663.5723880	1.82
1666.4378660	1.68
1667.6267090	2.77
1668.4727780	5.33
1669.1784670	3.08
1671.2370610	13.49
1672.2608640	7.01
1673.2479250	0.44
1674.2386470	0.93
1675.7369380	0.93
1676.9724120	2.28
1678.1331790	5.63
1678.8220210	0.74
1680.0249020	2.14
1680.8541260	8.34
1681.6489260	3.85
1682.3677980	1.06
1683.0943600	0.79
1683.9669190	0.43
1684.6066890	0.05
1685.7183840	0.83
1686.8647460	2.08
1687.6392820	1.04
1688.8489990	1.34
1690.2950440	1.77
1691.0451660	4.26
1692.0545650	1.17
1692.7967530	0.46
1694.1247560	1.25
1696.0999760	2.91
1696.9222410	6.17
1697.8636470	3.65
1698.5006100	3.18
1699.7478030	14.61
1700.8677980	5.63
1702.0183110	1.32
1703.0687260	0.39
1706.3931880	0.93
1708.0661620	1.17
1709.6511230	2.07
1710.2668460	0.49
1712.5534670	0.21
1713.2233890	0.46
1716.4377440	3.98
1717.5452880	3.20
1718.4211430	0.48
1720.2149660	0.63
1723.7274170	2.58
1724.8931880	5.67
1725.7381590	2.86
1727.3629150	0.08
1729.0246580	0.64
1730.1641850	0.36
1731.5921630	0.70
1732.5545650	2.97
1733.7449950	1.97
1734.4040530	1.48
1735.2398680	0.77
1737.1876220	1.80
1738.1384280	5.31
1738.9312740	0.49
1739.7034910	0.72
1740.7912600	0.83
1741.6032710	0.76
1744.6574710	0.17
1746.0938720	14.98
1746.9454350	12.03
1747.8009030	2.51
1748.7731930	0.65
1750.1029050	0.63
1753.3477780	0.68
1756.6105960	0.11
1757.8531490	0.78
1760.8546140	0.09
1764.2297360	0.58
1764.9240720	0.40
1765.8190920	3.18
1766.4396970	0.46
1767.5787350	0.70
1771.7408450	0.17
1773.4313960	9.42
1774.5015870	8.90
1775.3414310	6.42
1776.0422360	2.25
1780.9490970	0.47
1782.8975830	3.10
1783.6829830	1.07
1786.8443600	0.78
1789.5306400	2.61
1790.2176510	0.22
1791.1314700	0.28
1792.6246340	0.14
1795.7956540	0.55
1798.9207760	0.11
1801.1945800	0.32
1803.8345950	2.25
1804.7048340	0.15
1855.4932860	0.08
1884.3677980	0.32
1908.2203370	0.18
1918.5220950	0.18
1921.9180910	0.12
1934.9421390	0.37
1937.7888180	0.22
1939.3577880	0.10
1953.9420170	0.25
1960.1975100	0.20
1977.9698490	0.18
1988.1143800	0.16
1994.8968510	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2496
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.56106567	0.22
100.9839783	0.25
105.0287247	0.30
106.9446487	1.53
107.8888855	0.09
108.9086838	2.02
110.9947968	0.52
112.8354645	0.27
117.20961	0.15
118.992218	0.15
121.0476379	3.55
123.0727539	1.39
124.8194733	0.30
130.9651489	0.75
133.0042725	0.52
135.0853271	2.55
136.0297699	0.48
137.1258087	0.69
138.9229279	0.36
143.0434113	1.73
144.9966431	0.25
146.9904175	2.59
149.0520935	2.71
149.8651428	0.28
151.1409454	1.09
153.1149139	0.69
156.8812561	0.82
159.0967407	0.59
161.0065002	2.49
163.0702667	1.60
165.0874329	1.11
167.0433655	0.83
167.9963684	0.18
168.9537354	1.25
171.0669861	0.48
172.915329	1.35
175.0518188	0.82
177.0441742	1.05
179.0734711	0.66
180.9736633	0.12
182.1811981	0.34
183.1098328	0.63
184.9145203	0.49
186.9107819	1.90
189.2150421	0.79
191.1401367	0.84
192.1043396	0.19
193.2757263	0.07
194.9868927	0.43
197.1134491	1.13
199.1055298	0.58
200.037384	0.33
201.1092682	0.86
203.1513519	0.55
204.8718262	0.49
206.0387878	0.55
207.1408997	0.23
209.1923828	0.58
210.9651489	0.56
211.601532	0.32
213.085968	0.54
214.7847595	0.19
216.0501709	0.10
217.1637573	1.41
219.2627563	0.14
221.1292419	0.66
223.1285706	0.70
225.1939697	0.30
226.8885803	0.85
228.0080566	0.20
228.9750366	0.08
231.0214844	1.39
233.1907654	0.33
235.1650085	0.40
237.011322	0.22
237.9756775	0.10
239.1439209	0.25
241.2053528	0.32
242.2033386	0.15
243.0748901	0.31
245.3770447	1.71
247.240448	6.71
251.1290588	0.88
253.1156311	1.06
253.8625793	0.22
255.1218262	0.81
257.3834229	0.27
259.0322876	0.44
263.1305237	0.17
265.359436	0.44
266.0751648	0.10
267.2306213	0.17
268.9486084	0.28
271.1609802	0.61
273.1219482	0.15
273.8273621	0.20
275.3318481	0.42
277.0527954	0.39
279.2006226	0.64
281.565094	0.16
282.5105591	0.47
283.360199	0.17
285.243042	0.42
286.4729614	0.12
287.4779053	0.07
291.0864258	0.07
293.1150513	0.05
295.1273804	1.48
295.7765808	0.55
296.840271	0.48
297.5343018	0.19
299.3016357	2.17
300.1602173	0.59
305.324707	2.94
306.1776733	0.44
309.1951294	0.10
310.3653564	0.66
311.1999207	0.32
313.5453186	1.06
323.2362061	100.00
324.0761108	1.04
325.2151184	0.18
326.1779175	0.08
328.8820801	0.17
332.1959839	0.41
333.255188	0.39
341.182373	1.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	508.2007
Annotation	Unknow
Peak:m/z	Relative Intensity
149.0826874	0.26
166.0593109	100.00
171.1076965	0.09
209.0592957	0.13
227.2978363	0.22
255.2290649	0.08
265.0557556	0.10
288.9850159	0.58
298.0462341	0.09
319.3127441	0.11
324.8727112	0.49
327.9171753	1.72
342.3816833	0.26
343.2465515	0.35
345.7041321	3.43
368.3551636	0.08
377.8947144	0.32
410.1398926	0.79
421.9307556	0.42
464.7432556	0.21
490.0201721	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.2552
Annotation	Unknow
Peak:m/z	Relative Intensity
173.1081390	0.01
179.0793762	0.02
184.9567871	0.01
239.6267853	0.02
293.1589355	100.00
293.9516602	0.01
425.3092651	0.01
433.3580322	0.01
442.0639648	0.01
531.4873047	0.00
543.4790039	0.01
549.4017334	0.00
550.8283691	0.01
568.2874146	0.01
569.2897339	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0197
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
84.9298859	0.62
86.9574738	0.81
110.9013367	100.00
116.7842407	0.03
128.9724731	2.05
130.8522034	0.79
146.9626617	0.10
155.0565796	0.30
172.9916840	20.63
173.6197357	0.03
190.7038574	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	259.0917
Annotation	Ribothymidine
Peak:m/z	Relative Intensity
83.9321518	1.65
101.9371033	0.04
113.0320435	0.01
126.0039215	0.03
129.9222870	100.00
130.7749023	0.00
147.4558716	0.02
175.1142120	0.01
224.1230011	0.03
241.5201569	0.02
242.2010956	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.1665573	0.23
104.9358673	0.18
106.9627151	1.20
108.9763718	2.18
117.1307678	0.07
120.8877716	2.22
123.0440063	0.71
126.9650269	0.49
132.9977722	0.68
135.0440063	1.92
137.2656708	0.40
138.749176	0.25
140.792572	0.43
142.959259	0.60
144.0142059	0.23
146.0595398	0.22
146.9943085	1.95
149.0727234	1.07
151.0483093	0.98
154.706665	0.17
156.9573975	1.01
157.6369934	0.08
158.9919128	0.82
161.06427	0.43
163.0687866	0.53
165.3859711	0.67
167.1926727	0.38
168.9707642	0.26
171.0259247	0.15
173.2565155	0.10
175.0385284	0.72
176.9057312	0.22
179.11203	1.60
181.1860046	0.38
182.0880737	0.23
183.0057526	0.35
184.9331207	0.85
186.9954224	1.24
189.0643616	0.41
191.165802	0.74
192.23703	0.29
193.0423584	1.20
194.8408813	0.34
196.0706482	0.38
197.0306702	0.83
199.0081482	0.34
201.0631714	0.21
203.2651978	0.48
204.0877533	0.26
205.1795044	0.86
207.2719116	0.13
209.1391602	0.90
210.2373962	0.10
211.163208	1.29
213.0240479	0.21
215.0595703	0.55
217.1359863	1.01
219.2189636	0.45
221.0437622	0.24
223.1663208	0.37
225.0387268	0.62
227.1668396	1.58
227.8883362	0.36
229.1837769	0.55
230.8981934	0.69
235.0988159	0.10
237.1514587	0.37
239.1427307	0.90
241.1722717	0.23
242.9863281	0.44
245.0748596	1.38
247.2124023	5.28
249.0924072	0.42
251.2185364	0.31
252.1359863	0.27
253.2077637	1.17
255.0841064	0.44
257.1350098	0.16
259.3117065	0.28
264.9281311	0.27
266.0250244	0.42
267.2977905	2.01
269.1231689	0.35
271.1021118	0.77
277.0646057	0.47
279.2199097	1.08
280.1003113	0.58
281.031311	1.47
282.0318298	0.29
283.3404541	0.44
285.3223572	0.33
286.9229126	0.52
291.2686768	0.54
293.235199	0.12
295.0962524	1.19
297.2509155	0.32
299.2682495	2.56
299.9801636	0.25
305.1873779	3.15
305.9969177	0.07
307.335083	0.08
309.2667847	0.18
313.1524963	0.57
323.2293701	100.00
324.1026306	0.84
341.0775452	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	556.2034
Annotation	Unknow
Peak:m/z	Relative Intensity
202.0854492	0.53
204.0610962	5.12
205.0565033	0.10
230.1554718	0.14
248.0754242	100.00
249.1877441	0.65
290.1396790	0.50
296.0606689	0.13
320.1315918	0.10
332.1877441	0.08
334.1114502	0.16
356.2926025	0.17
376.4559937	0.14
394.4669189	0.06
410.3954468	0.18
425.3641357	0.05
427.3629761	0.53
432.2492065	0.12
445.2629395	0.09
493.2122192	0.08
495.1203003	0.05
510.2941284	0.17
512.4029541	0.23
517.2543335	0.05
537.5135498	0.38
538.2834473	0.78
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	664.96
Annotation	Unknow
Peak:m/z	Relative Intensity
196.8277435	0.34
208.1592102	0.08
213.1428528	0.67
223.0597382	0.09
231.9103699	0.14
239.1308594	0.05
254.9066925	0.29
258.8576355	0.14
268.9681396	0.06
272.9846191	1.25
274.9140625	0.53
276.9372253	0.69
281.1926270	0.20
285.1383667	0.69
289.0109253	0.94
292.4926453	0.18
301.0637207	0.67
303.0138855	7.03
304.8972168	0.04
308.1228027	0.17
316.8446045	0.34
319.0739746	11.42
335.2202759	0.17
355.1158447	0.83
358.5352173	0.06
360.8479004	0.15
367.0399170	3.04
368.7150879	0.09
371.0174561	0.47
373.1486206	0.14
380.0911255	0.83
383.0208740	5.79
385.1168213	16.92
390.9970093	12.30
401.0227051	14.52
402.9337769	1.77
405.0463867	3.09
406.9882812	0.69
410.9052124	0.15
421.0275269	39.32
423.0601807	11.82
426.4668579	0.19
428.5492554	0.50
433.1773682	0.45
438.9574585	4.07
444.7279663	0.42
456.6267090	0.50
460.1254883	0.24
466.3208008	0.15
484.9733276	9.27
486.0816650	0.15
486.9904785	0.19
490.8630371	28.45
494.5789795	0.74
496.7054443	1.89
501.0247192	0.14
502.9647827	100.00
503.9041748	0.66
508.8572388	0.43
509.8788452	2.18
510.6865234	1.26
512.6040649	7.89
514.9644775	0.53
519.0249634	37.15
528.7114258	11.44
529.5850830	0.18
531.1600342	0.52
532.0004272	0.27
533.0774536	0.06
534.8344116	0.84
545.0847778	3.06
552.9406128	26.03
554.1850586	0.20
560.9616089	0.09
569.1727905	0.32
578.4535522	1.92
579.0946655	0.06
580.7698364	35.39
581.8079224	0.85
587.0053711	0.11
590.6328735	0.22
591.3638306	0.17
592.1841431	0.26
596.7058716	23.26
597.8115845	0.48
599.5685425	0.83
600.8765259	0.29
602.7243042	0.27
618.1938477	1.20
618.9804077	1.57
622.1627197	12.06
623.5584106	0.62
624.2559204	0.34
633.4187622	0.17
641.3110962	2.50
642.1828003	2.00
647.0509644	4.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	683.3395
Annotation	Unknow
Peak:m/z	Relative Intensity
200.9745331	0.57
225.3634644	0.17
227.0733643	0.24
230.9904480	0.29
249.1434021	0.26
251.1367645	0.06
268.1369934	0.42
285.2815857	0.59
296.0867615	2.05
297.1602783	0.72
300.9249878	0.27
314.0228271	2.54
315.2162781	0.51
316.0387878	0.17
326.2207031	0.29
336.8374023	0.17
340.8715820	0.40
342.3066406	0.23
346.2728882	0.12
356.5772705	0.13
360.5002441	0.27
374.5619507	0.14
381.3375854	0.64
398.8447266	0.24
409.0194702	0.54
409.9185181	0.12
427.1441650	0.85
428.2698364	0.30
429.2330322	0.40
434.3671265	0.19
437.2075806	0.13
440.5714111	0.07
441.2470703	0.09
443.1578369	0.29
450.4368896	0.26
455.2896118	0.33
458.1436768	0.15
464.4822998	0.36
473.5366211	0.17
481.0489502	0.07
484.3488770	0.09
485.9373169	0.45
486.8452148	0.40
496.4414062	0.07
502.7796021	0.40
503.4181519	0.15
514.0847778	0.49
516.5112915	0.07
520.8322754	0.91
521.9887085	0.14
522.6431274	0.49
524.2723999	0.32
532.2404175	0.26
535.3455200	1.29
536.5067749	1.00
539.7516479	0.16
561.0597534	0.38
562.1015015	0.75
570.3317871	0.24
571.9812622	0.38
574.0350952	0.20
576.2471313	1.40
576.8623047	0.38
577.9950562	0.12
580.4891357	0.25
581.7308350	1.03
594.0902100	0.22
596.1912231	0.36
603.9348145	0.20
607.1604614	0.68
608.1410522	0.70
610.3737183	1.06
612.5617676	0.10
618.4205933	1.30
619.3324585	0.30
620.1690674	0.27
624.0760498	0.39
627.3442993	0.16
634.0133057	0.62
638.7437134	0.39
645.8616333	0.77
648.3929443	0.93
649.2047729	0.53
650.2684937	2.90
651.2520142	1.92
652.4796753	0.11
653.8256226	0.49
655.0647583	0.43
657.4254150	0.33
658.3942261	0.37
659.8295898	1.23
661.8375854	1.19
662.7049561	0.39
664.7367554	6.20
665.7974243	3.58
667.0851440	0.81
668.1935425	0.76
669.4904785	1.43
670.1806641	0.57
670.8501587	1.14
672.3372803	0.50
673.8926392	2.78
675.1892700	1.02
675.9274292	0.29
692.1435547	0.52
694.3534546	2.02
700.6356201	1.31
701.7012329	0.72
713.7435303	1.06
717.5123291	9.15
718.7072144	0.37
720.2627563	0.32
723.6985474	0.42
727.8079834	0.79
728.6342163	0.07
729.5317993	0.51
731.4784546	8.27
732.5125122	0.32
734.8660278	100.00
736.6853027	1.38
737.5377808	0.49
738.2156372	0.14
740.0032349	0.34
740.6658936	0.47
742.5950317	0.22
750.6433716	1.49
753.9497681	8.45
755.1104736	1.43
757.4198608	86.31
758.3806152	10.50
759.2405396	2.33
760.3194580	0.87
761.3565674	0.40
768.0996704	0.84
772.7593994	0.30
773.6323853	0.79
774.9116821	0.10
777.1610718	0.61
779.9922485	9.49
780.6753540	3.67
781.6275635	0.26
782.7036743	0.07
784.0451050	0.27
785.1250000	2.21
785.9755249	0.22
787.5847778	0.27
788.6323853	0.94
790.4533081	0.25
792.9387817	0.27
794.0834351	0.86
795.7338257	0.66
797.2993164	6.10
798.1381836	1.37
799.2830811	1.03
799.9989014	0.58
801.3346558	0.27
802.3573608	0.75
803.1237183	0.38
804.0404053	0.87
809.2268677	0.59
811.6091919	0.10
823.3303833	0.98
827.5004883	0.29
829.4717407	0.26
830.7952881	1.19
836.6332397	0.93
839.7863159	0.19
844.0144653	1.46
847.4788208	0.37
848.4058228	0.41
854.2435303	0.17
857.0114746	0.15
861.1058960	0.50
865.2907715	0.17
867.0346069	1.72
868.0739136	0.11
870.9859009	0.43
872.7490234	0.46
873.6201782	0.14
884.4089355	0.40
886.7566528	0.41
891.5691528	0.23
899.8376465	0.29
906.5342407	0.29
910.5526733	0.11
912.5092163	0.28
913.4052124	0.53
916.8222046	0.33
924.3544922	0.41
926.3857422	1.07
931.3200073	0.32
935.4697876	0.15
944.8605347	0.06
947.2064819	0.13
955.4682617	0.37
963.6035767	0.44
967.5841675	0.09
972.3352661	0.97
973.0802612	0.65
979.6510620	0.33
982.4661255	0.33
992.5737915	0.32
1012.7881470	0.81
1021.1347660	0.19
1030.0649410	0.30
1033.6616210	0.82
1034.5875240	0.22
1037.6562500	0.43
1050.7292480	0.19
1055.5825200	0.31
1088.5195310	0.21
1099.0518800	0.15
1107.4096680	0.36
1147.2995610	0.07
1161.5892330	0.19
1211.7990720	0.53
1228.7889400	0.09
1246.8465580	0.32
1247.4874270	0.26
1272.6756590	0.18
1276.9351810	0.23
1311.8514400	0.34
1324.1217040	0.19
1329.3488770	0.11
1387.5635990	0.08
1390.6500240	0.12
1407.9863280	0.18
1417.4400630	0.25
1452.1551510	0.08
1596.5408940	0.11
1613.7707520	0.17
1650.6058350	0.06
1671.3294680	0.14
1769.8851320	0.13
1852.2237550	0.10
1864.0023190	16.96
1874.9261470	0.11
1888.3404540	0.27
1960.0238040	0.23
1982.9577640	1.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	502.92
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9367676	3.74
160.0529480	0.16
161.0365906	0.43
173.2291412	0.22
199.2520142	0.23
200.9895325	0.59
216.8045807	0.13
219.1834106	0.12
228.8366699	0.39
230.9860077	0.26
258.8800049	0.09
273.0095825	31.22
273.9611206	6.01
275.0756531	34.97
358.9853210	0.09
373.3621216	0.15
386.9584045	30.75
388.1422119	22.26
388.9380188	100.00
404.8573608	0.13
410.9876404	0.21
427.1216125	0.13
429.0826111	0.35
429.7851257	0.34
447.6226196	0.16
455.4958191	0.09
456.9976196	0.40
458.4161072	0.48
459.0173035	0.03
474.9855042	0.10
475.9049377	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	370.83
Annotation	Unknow
Peak:m/z	Relative Intensity
131.1946716	0.02
187.1960602	0.03
194.9005127	0.07
196.9721832	0.23
198.7281647	0.02
202.9452972	0.28
232.9064941	1.08
234.9585571	2.07
241.0824585	0.09
248.2474060	0.08
286.8704224	100.00
302.8598633	0.90
324.9649963	0.04
326.8515320	0.02
344.0233765	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	193.03
Annotation	Citric acid
Peak:m/z	Relative Intensity
69.68148041	1.01
83.15255737	0.53
89.05269623	1.58
121.1004639	1.48
131.6260223	0.53
136.1548309	2.34
137.0704651	2.12
146.9352264	6.57
148.2180481	1.15
149.1472321	2.96
151.2350006	0.81
156.9095001	3.51
164.1884613	3.07
165.0926819	0.49
170.1763763	38.44
175.0192108	100.00
175.9241486	9.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.0803833	0.11
97.78390503	0.13
104.9719162	0.07
106.9138794	1.73
109.0319824	1.96
110.8019409	0.40
117.0131073	0.21
118.8138504	0.04
120.9200897	3.70
121.8470306	0.08
123.0123291	1.06
127.1308441	0.13
129.0776978	0.20
131.0797424	0.41
131.9461212	0.06
133.0357056	0.64
135.0649719	3.90
137.0664978	0.69
137.9312744	0.02
141.1312714	0.12
142.9251862	0.52
144.9193573	0.18
146.9926453	2.53
149.0452118	1.51
150.2469025	0.03
151.1860199	0.64
153.1378479	0.22
155.131012	0.13
156.9187622	1.04
159.0935364	0.40
160.9126282	1.48
163.1747131	0.82
165.163269	0.56
165.9965668	0.06
166.9899902	0.11
168.4977722	0.13
169.107666	1.52
170.9442749	0.70
173.0331421	1.05
175.0542908	1.80
177.0920715	0.96
179.0867462	0.04
181.1469421	0.12
182.8726196	0.44
183.5129089	0.03
184.9621277	0.47
187.1372833	0.66
189.0511017	1.29
191.256958	0.31
193.1010437	0.04
195.0186615	0.09
197.2314148	0.24
199.0798645	0.29
201.1949921	0.42
203.0297852	1.48
205.0405579	0.80
207.165741	0.18
211.1428833	0.62
213.1451111	0.14
215.1252747	0.28
217.1538696	1.38
218.3984375	0.04
219.2793579	0.14
221.0813293	0.09
222.7166138	0.04
223.3562012	0.15
225.2221069	0.10
226.8918762	0.04
227.8666992	0.29
229.1784363	0.68
231.2177734	1.17
233.0587158	0.46
235.2838745	0.09
237.307251	0.07
238.1367798	0.23
239.4040222	0.22
241.3334656	0.06
242.2154541	0.09
243.3040771	0.13
245.1912842	1.04
247.2236938	5.80
248.0317383	0.12
249.1809692	0.17
251.1051636	0.37
252.0657959	0.03
253.6248779	0.11
255.2029724	0.12
257.1542969	0.48
259.0548706	0.65
259.680481	0.11
263.5174866	0.06
265.3783264	0.09
267.2384644	0.29
269.3967896	0.21
271.4677734	0.14
275.2848511	0.12
277.1568604	0.14
279.1954041	0.19
280.2731323	0.03
281.2189941	0.24
283.1975708	0.59
285.1374207	0.56
287.2722168	0.81
293.3271484	0.06
295.2326355	0.37
296.2051086	0.14
297.4760132	0.44
299.2413635	1.23
300.1891785	0.19
303.5117798	0.04
305.2901611	2.45
313.362854	0.88
323.2406006	100.00
324.174408	0.79
325.0206299	0.07
331.7367554	0.28
332.3855591	0.12
341.2645874	1.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.03240204	0.20
99.0061264	0.13
102.8707733	0.11
103.7709045	0.10
105.0400238	0.30
107.0277481	2.30
109.0305481	2.13
111.035202	0.71
113.0738525	0.06
114.980835	0.05
116.9211044	1.39
119.1092834	0.41
120.9618454	3.26
122.1282425	0.09
123.0971756	0.62
125.0031738	0.54
125.866478	0.04
128.9497528	0.44
131.0121155	0.57
133.0196533	0.76
135.0601349	3.55
137.064209	0.61
139.9586182	0.14
141.104248	0.73
142.0807037	0.05
143.0700073	3.97
144.0509644	0.28
144.9677124	0.80
146.8982239	1.11
149.0223083	1.81
151.0050964	1.04
151.9996338	0.45
152.8308411	0.08
154.9530792	0.82
156.9901123	1.19
159.0637207	3.30
160.9178772	1.57
163.0728455	1.20
164.9999695	1.45
166.1057739	0.20
167.0394592	2.15
168.8352966	4.85
169.5166168	0.59
170.1950989	0.23
171.0137024	0.17
172.98172	5.58
174.0618286	0.20
174.9185944	0.97
176.9317017	0.12
179.2061462	0.39
181.0428467	0.23
182.1171417	0.19
183.0583496	1.92
184.1418152	0.23
185.1098633	0.78
187.0809479	3.63
188.9316711	0.24
191.1546936	0.17
193.1643219	0.85
197.1710815	1.28
199.1113281	0.54
200.4999695	0.15
201.2616577	0.84
202.980835	0.13
204.77005	0.35
205.4191895	0.51
207.2783508	0.52
208.2298889	0.06
208.9646606	0.19
211.1198425	3.60
213.1504211	0.16
215.0469971	1.81
217.0874023	0.68
219.0147095	1.10
221.0782166	0.52
223.1725464	0.82
223.9268494	0.22
225.1473389	0.71
227.3282776	1.54
228.3136292	3.17
229.0853882	7.06
230.0940552	0.94
231.1540833	0.23
233.0697021	1.68
234.0253906	0.29
235.1346741	0.31
236.3968201	0.08
237.390625	0.09
239.1764832	0.16
241.2062378	0.33
243.1335449	1.34
245.2810669	2.14
247.230835	9.85
247.977478	0.38
249.0176697	0.18
251.1595459	0.49
253.1400146	0.08
255.2862549	0.18
257.3508606	0.08
259.2276611	0.86
261.0397644	0.06
263.4404907	0.07
265.0111694	0.35
266.0026245	0.24
267.3187866	0.19
269.2762451	0.50
271.3109131	0.26
273.3756104	0.26
277.2554321	0.44
278.8652649	0.21
279.4765625	0.27
281.2867126	0.08
282.2721252	0.11
283.0983887	0.78
285.1437988	0.55
287.3491821	1.91
290.937561	0.15
295.3248901	3.57
296.443634	0.19
297.2865601	0.10
299.2604675	2.70
301.0397644	0.30
303.1707153	0.15
305.3034973	3.57
306.4152832	0.47
309.7404785	0.39
313.227478	2.03
313.9179382	0.49
323.2477417	100.00
324.2488403	0.68
325.1737061	0.39
326.4621582	0.08
341.1643372	0.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	368.0963
Annotation	Zeanoside B
Peak:m/z	Relative Intensity
113.0128479	0.04
120.0394363	0.02
132.0937500	0.02
145.0148621	0.03
159.8856506	0.36
163.0344238	0.02
185.9362488	0.06
188.0170898	1.33
191.0727844	0.02
199.0987244	0.03
200.1007996	0.09
203.2135620	0.07
205.9970398	100.00
206.7716675	0.01
212.0554199	0.03
219.0734863	0.05
232.9935913	0.09
236.3686523	0.28
237.0364075	0.04
238.9403076	0.05
252.0769958	0.45
255.5413818	0.10
257.3551941	0.02
263.0288086	0.57
265.2677917	0.02
277.9664917	0.05
278.9363098	0.02
280.0217896	0.03
280.9180603	0.03
287.2488708	0.03
288.1764526	0.13
292.3257751	0.08
293.0747681	0.07
294.9588013	0.10
295.8037109	0.03
300.4586792	0.03
308.2086487	0.04
310.3454285	0.03
314.8199158	0.01
320.2476807	0.07
320.8829346	0.03
322.1484985	0.08
323.3739014	0.03
324.1814575	0.05
325.0405579	0.20
327.3081970	0.76
329.3423462	0.12
331.5667725	0.13
332.3030701	0.04
333.2129517	0.04
334.8190308	0.19
344.8411255	0.18
345.5448608	0.05
350.2025452	0.88
351.1119690	0.10
354.0138245	0.21
356.3001404	0.25
359.0776672	0.25
359.8601074	0.02
361.5411987	0.08
378.0293884	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1145
Annotation	Lactulose
Peak:m/z	Relative Intensity
207.2753296	0.01
341.2085571	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	321.09
Annotation	Unknow
Peak:m/z	Relative Intensity
98.8096848	0.05
130.1011963	0.54
147.0337219	1.80
148.9913330	0.04
149.9752808	0.03
159.1559753	0.13
174.0801697	0.15
176.1827545	0.05
190.9801178	0.03
192.0886230	3.87
195.3560791	0.05
217.9785156	0.05
225.3015137	0.02
232.0386047	0.10
244.0788574	0.02
248.9752808	0.55
249.5942688	0.01
258.0490112	1.21
258.9842224	0.02
265.1699524	0.04
266.0521240	0.03
267.0193481	0.90
268.0661316	0.03
275.0404053	3.97
276.1542664	2.44
285.0342712	12.21
285.9953613	17.43
286.6446533	0.08
303.0629883	100.00
303.9639893	19.40
304.6069336	0.05
312.2252197	0.05
329.7178650	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Unknow
Peak:m/z	Relative Intensity
101.0164490	0.02
112.9529266	0.09
119.1320953	0.07
143.0171509	0.06
160.9878540	0.06
179.0707245	0.78
197.0488586	0.77
215.0048523	7.02
247.1444397	0.03
281.2096558	0.02
288.0693054	0.05
290.0277710	0.02
308.6601257	0.03
332.2814331	0.02
341.1215210	100.00
343.3872681	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.73575592	0.09
104.971405	0.28
107.0272522	1.81
109.0441437	2.36
109.9123306	0.13
110.9505386	0.15
116.8474884	0.06
117.7751312	0.03
119.0536957	0.05
121.0111542	4.24
123.0329056	1.65
124.9346161	0.33
129.0661621	0.10
131.0838623	0.51
133.0137634	0.89
135.0509186	3.42
136.9393311	0.55
138.9523926	0.03
143.0333862	1.14
144.9473877	0.19
147.0404358	2.85
149.0936584	2.08
151.1526489	0.79
153.0415955	0.11
155.0714569	0.10
157.0408325	1.11
158.9533081	0.96
160.1801147	0.03
161.1112823	2.38
163.0946045	1.15
165.093811	0.57
167.0618134	0.13
167.8791199	0.09
168.9131622	1.01
170.9912109	0.18
173.0162048	0.82
175.068634	1.24
176.1474915	0.16
177.1011505	0.67
179.2009888	0.28
180.7116699	0.14
182.004303	0.07
183.0366211	0.42
184.9028015	0.17
187.0211639	1.23
188.9940186	0.73
191.2008667	0.73
191.9045258	0.03
193.2158813	0.30
193.936676	0.06
194.9451904	0.15
197.0890045	0.26
199.1497192	0.03
201.1577148	0.46
203.1148376	0.58
204.544632	0.31
205.2107391	0.47
206.0803986	0.14
207.0067596	0.04
209.1631775	0.19
209.7713013	0.01
211.0433044	1.10
213.1255798	0.24
215.2413025	0.21
216.0528564	0.08
217.1220093	2.15
219.118866	0.11
221.3163147	0.14
223.197876	0.59
225.2901001	0.06
227.1627808	0.16
229.1487732	0.70
231.1563416	2.03
235.0996094	0.11
237.3670349	0.13
241.1749268	0.63
243.2937317	0.18
245.1941528	1.34
247.3005676	4.72
250.9120483	0.12
252.3104858	0.04
253.1142578	0.53
255.3763123	0.06
257.1314392	0.53
259.0297241	0.44
261.1471558	0.13
263.1893311	0.11
265.3643799	0.34
266.0551453	0.06
267.2478638	0.58
269.1035767	0.11
271.1801758	0.19
273.1724243	0.18
276.1140137	0.02
279.1087341	0.17
280.4576416	0.04
281.2601624	0.23
281.9281311	0.08
283.1821289	0.37
285.1775208	0.51
285.9443665	0.15
287.4277954	0.24
290.0416565	0.10
294.0939941	0.06
295.2686157	0.81
296.1002502	0.11
297.2710571	0.16
299.2285156	1.89
303.4138489	0.11
305.2030029	3.37
306.0109863	0.02
309.536499	0.18
310.2745361	0.07
310.9445496	0.08
313.2540283	0.56
321.7631836	0.18
323.2372437	100.00
323.8397217	0.20
324.6046143	0.06
332.7518921	0.20
339.6377258	0.08
341.1333008	1.30
348.784729	0.04
352.4706116	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	409.1856
Annotation	Vernoflexuoside
Peak:m/z	Relative Intensity
117.9334106	0.17
129.0624084	0.02
132.1013031	0.06
142.1397858	0.03
142.7966614	0.04
144.0076904	0.34
146.0546265	2.90
159.0892487	0.07
160.0497131	0.04
169.8978577	0.17
188.0631409	35.09
205.0572815	100.00
206.3055267	0.03
262.0408020	0.05
268.4363098	0.03
269.9352722	0.02
279.1882935	0.03
294.3482666	0.03
297.4327698	0.06
320.3051147	0.03
322.1654968	0.05
328.6548157	0.11
336.0489502	0.22
348.0222778	0.04
355.0706787	0.02
360.0438232	0.02
361.2422180	0.07
362.9512024	0.03
365.2923889	0.08
367.0150757	0.02
373.2202454	0.08
374.2834167	0.05
382.0416565	0.05
385.1239929	0.03
391.2184753	0.41
392.2211304	0.54
395.4045715	0.01
399.9544983	0.07
407.9895630	0.06
409.7734070	0.05
410.4722595	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	290.85
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.7908936	2.51
157.9775848	0.04
159.0068970	0.04
206.7807007	100.00
272.9754639	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
107.0196838	0.75
109.0473175	1.92
110.9429855	0.99
113.1312485	0.17
115.0752335	0.09
116.8927994	0.51
119.192749	0.19
121.0777435	2.44
121.9577866	0.19
123.0373993	0.41
124.9382477	0.44
128.7454987	0.68
130.9870605	1.30
133.1141968	0.76
135.1069946	3.39
135.9367523	0.30
137.030304	0.26
138.8456573	0.27
141.0155029	0.89
142.8971252	3.86
145.0128479	0.28
147.0955963	0.66
149.1704102	2.44
150.9703522	0.97
152.0675049	0.43
152.9307556	0.20
153.7432251	0.06
154.9684753	0.49
157.0541992	4.12
159.091095	3.20
160.9382019	0.34
163.0802612	0.26
165.0398865	2.00
166.1445007	0.42
167.0485535	0.83
168.2492981	0.29
169.1490479	2.04
171.0416718	0.21
173.0375366	5.42
174.7653503	0.83
175.7311859	0.47
178.4819794	0.56
179.1900482	0.10
180.881485	0.35
183.0656891	1.62
184.0609283	0.21
185.1916046	0.90
185.9552307	0.23
187.1624451	2.35
189.1815186	0.99
192.8575439	0.26
193.4600372	0.05
194.9894104	0.18
197.1355286	1.18
201.3493195	0.20
202.1737061	0.20
203.1567078	0.61
205.2654266	0.65
207.0609741	0.38
210.9878845	0.87
213.2906799	0.53
215.1316528	2.06
217.2492065	1.01
218.416687	0.27
221.158844	0.27
223.1251221	2.68
224.9036865	0.22
227.4533997	1.14
228.2420044	2.63
229.1145935	5.85
229.9687805	0.30
230.9587097	0.16
233.0939026	1.56
234.2723999	0.47
235.3465576	0.18
239.0830688	0.10
239.8802795	0.08
241.0790405	0.32
242.5921631	0.58
243.311676	0.90
243.9843445	0.15
245.2909241	2.64
247.1454163	12.24
247.9760742	0.24
249.3102722	0.38
251.213501	0.96
253.4609375	0.10
254.2331543	0.08
255.2500916	0.25
258.0582275	0.14
259.025116	0.08
260.2166748	0.11
263.4156494	0.05
265.232666	0.92
267.468811	0.09
269.4064331	0.14
270.9193115	0.42
275.2489319	0.52
277.2110901	0.75
279.4621277	0.12
281.236145	1.02
283.2670898	0.34
285.1794739	0.22
287.2157593	1.46
292.2190552	0.07
295.2844238	3.22
296.1029663	0.40
296.8128357	0.25
297.4783325	0.27
299.290802	2.72
300.0577087	1.60
304.7233582	0.59
305.3333435	5.07
306.4382324	0.16
307.6330566	0.34
310.1882629	1.94
311.0158386	0.32
313.3096619	0.88
318.666626	0.18
323.2477417	100.00
324.2489624	0.73
341.3603821	0.70
342.1618958	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	895.3915
Annotation	Unknow
Peak:m/z	Relative Intensity
258.0747375	0.23
269.0832214	0.20
281.3425598	0.28
282.2499084	0.08
285.4314270	0.07
307.0947876	0.05
308.4346008	0.06
311.5150757	0.07
313.9797668	0.38
314.5940552	0.23
319.5166626	0.24
335.8100281	0.17
337.1115417	0.10
341.4199219	0.49
347.2600708	0.12
355.4558105	0.10
360.9284363	0.07
362.1889038	0.05
381.3085327	0.09
382.1181335	0.05
399.0874023	0.89
400.2057190	0.15
403.4337158	0.10
415.2598267	0.14
422.4154663	0.13
423.4788818	0.11
428.0485229	0.06
431.2094116	0.12
440.4508667	0.36
444.7723389	0.45
449.3826294	0.51
450.2130737	0.13
456.2752075	0.17
468.9021606	0.10
471.1936035	0.12
477.5160522	0.38
486.1271973	0.09
488.2555542	0.36
489.2186279	0.22
501.0930176	0.20
516.8848267	0.28
517.9614868	0.28
528.2913208	0.07
532.3275757	0.22
534.1892090	1.07
535.5634155	0.16
537.5746460	0.18
544.0495605	0.22
545.4715576	0.06
561.6155396	0.41
562.2742310	1.10
563.2566528	0.35
566.4570923	0.28
595.3106079	0.26
597.2924194	0.06
602.4130249	0.20
614.3298950	0.24
616.5473022	0.26
622.2449341	0.13
634.4794312	0.13
635.4914551	0.13
647.3532104	0.08
651.0846558	0.13
662.9424438	0.18
682.6047974	0.61
684.4835815	0.27
691.3588867	0.33
692.8569946	0.17
697.0043335	0.33
704.3893433	0.50
705.4096069	0.28
712.2670288	0.10
734.4942017	0.27
737.8442383	0.48
740.2793579	0.06
743.4602661	0.14
751.1137695	0.58
754.9450073	0.25
765.1032104	0.71
768.3569946	0.12
777.9674683	0.93
782.3812256	0.81
786.8424072	0.12
787.5638428	0.05
788.4817505	0.17
789.3558960	3.25
792.3975830	0.82
794.4157715	0.09
795.6766357	0.12
799.5817871	1.95
801.6179199	0.48
802.2993164	1.11
806.1135864	2.74
809.8546753	1.83
810.5120239	0.14
811.2359009	0.73
812.4409180	0.95
815.4956665	0.63
816.5888672	0.18
817.6760254	1.62
820.5558472	1.25
822.4519653	0.21
823.1477051	0.76
824.3602295	0.09
827.1008911	2.34
827.9357910	0.93
829.9828491	0.12
831.0722046	0.53
832.2005005	2.55
834.3275757	1.10
835.3848267	1.91
837.5808716	2.03
838.4592896	3.54
839.1238403	47.91
840.2679443	1.54
840.9302368	0.07
842.0758667	0.40
842.9756470	0.80
843.8479614	1.21
844.9493408	0.58
848.1748657	0.35
849.9157104	2.21
851.5777588	2.74
852.6071167	0.43
853.4303589	0.19
855.4312744	1.94
856.4338379	12.29
857.0867920	1.81
858.0726318	1.44
858.8596802	4.10
859.5237427	1.45
860.8308716	0.96
861.8846436	0.79
863.3460083	19.29
864.3530884	2.43
865.2384644	0.77
866.5840454	1.26
867.7247925	5.05
868.5175171	0.08
869.8338013	0.30
870.9347534	2.12
871.7939453	0.69
872.9005737	0.63
873.9487915	0.61
875.5626831	0.84
876.9624634	0.14
878.4035034	0.06
880.3181152	1.55
882.2863159	0.40
884.7188110	1.84
885.3756104	0.52
887.8809204	0.29
893.1668701	0.19
910.3687134	0.10
912.7684937	0.10
916.8511353	0.29
918.4786987	0.18
920.2957153	0.66
921.7585449	0.11
924.9609985	0.38
925.6232300	0.30
929.4157104	0.10
931.3113403	1.00
932.6530151	1.07
939.1682739	0.38
940.6733398	1.30
948.5222778	0.12
949.1967163	0.23
950.5239258	0.49
951.5820923	0.21
954.4987793	1.21
957.6015625	0.43
958.5441895	0.14
961.4298706	0.14
962.6332397	0.20
964.0178223	1.89
964.9152832	1.07
968.9191284	5.33
969.7653198	0.91
970.4475708	0.10
976.0123901	0.17
979.8309937	0.11
981.8720093	0.50
983.5621948	0.47
985.0068970	0.47
986.4303589	0.54
987.9714966	0.81
989.4688110	0.41
993.3630371	0.19
996.4180298	0.54
997.9469604	2.76
998.9177856	1.26
999.7465210	0.16
1001.0164180	0.63
1001.6351930	0.81
1003.0809940	0.40
1007.1240230	9.92
1007.9250490	5.50
1008.5314940	0.81
1009.9273070	0.38
1011.3759160	0.38
1012.5471190	0.36
1013.2722170	0.28
1014.2980960	1.85
1015.1331180	0.67
1016.3227540	0.35
1017.0297240	0.83
1018.0208130	0.85
1018.7411500	0.36
1019.3645630	1.40
1020.5131230	0.51
1022.3203120	0.97
1023.2280270	1.94
1024.5543210	1.93
1025.4121090	0.38
1026.1717530	0.69
1027.7272950	1.75
1028.4572750	0.09
1030.9724120	1.52
1032.3222660	1.13
1033.2937010	1.00
1034.5307620	0.63
1035.4191890	0.71
1036.6387940	5.70
1037.4938960	4.94
1038.2912600	1.02
1039.7590330	0.68
1042.1275630	7.44
1042.9583740	3.48
1044.3945310	2.42
1045.3566890	1.13
1046.4875490	0.46
1047.5764160	3.22
1048.4324950	0.60
1049.4539790	0.35
1051.2230220	1.16
1052.3118900	0.44
1053.6032710	0.07
1055.0478520	0.72
1055.7431640	2.19
1056.7803960	2.36
1058.0163570	1.97
1059.0197750	0.30
1060.2861330	1.12
1061.6455080	15.40
1063.5095210	1.80
1064.7143550	2.27
1065.6533200	3.01
1066.9133300	1.56
1068.3933110	1.81
1069.9708250	2.07
1071.4394530	2.18
1072.1831050	0.18
1074.1854250	10.87
1075.0969240	13.14
1076.3461910	3.09
1077.5634770	1.79
1079.8684080	18.09
1080.7044680	89.17
1081.6658940	7.38
1082.4401860	8.15
1083.2471920	5.02
1084.2824710	0.48
1084.9761960	1.11
1086.6157230	1.64
1087.4416500	0.13
1088.7307130	2.02
1089.6818850	1.30
1090.5272220	4.22
1091.4892580	1.04
1092.2047120	0.79
1092.8444820	0.11
1093.8250730	1.48
1095.9659420	2.32
1096.9667970	7.91
1097.8444820	0.68
1098.5548100	0.14
1099.7650150	2.80
1100.8121340	1.20
1101.5598140	2.13
1102.3181150	2.99
1103.3779300	4.41
1104.2414550	0.49
1105.1853030	0.44
1106.3157960	4.12
1107.3458250	1.41
1108.0141600	0.19
1109.1422120	2.06
1110.1428220	0.21
1112.3709720	27.44
1113.1806640	20.26
1113.8776860	3.49
1114.5290530	0.05
1115.7219240	2.18
1117.7990720	13.89
1118.6459960	100.00
1120.2583010	1.57
1121.2159420	0.62
1122.6186520	2.91
1123.5683590	1.00
1125.0283200	1.40
1126.3248290	0.27
1126.9663090	0.08
1127.7092290	0.85
1131.0380860	0.59
1131.8735350	0.38
1132.8190920	2.33
1133.6273190	1.88
1134.7355960	1.38
1135.3535160	0.12
1136.3295900	0.36
1138.1987300	1.19
1139.5809330	0.68
1141.0781250	5.66
1141.8730470	1.71
1143.2198490	0.28
1144.4827880	5.16
1145.1207280	1.84
1145.8371580	0.99
1146.7554930	3.66
1147.5618900	2.37
1148.3957520	0.90
1149.7867430	4.59
1150.6403810	32.91
1151.2919920	19.56
1152.0700680	1.19
1152.7760010	0.24
1153.4621580	0.10
1154.1796880	0.12
1155.8885500	30.25
1156.7757570	39.51
1157.7828370	3.76
1159.0589600	0.60
1160.1308590	2.34
1161.2255860	3.30
1162.0823970	2.35
1162.9913330	0.23
1163.8498540	0.13
1165.2198490	1.18
1166.1768800	0.26
1169.7969970	0.07
1170.6096190	0.33
1172.4390870	0.49
1174.8587650	0.82
1175.5102540	0.03
1182.1751710	1.10
1183.1188960	1.44
1184.1787110	1.06
1188.5339360	0.20
1191.2901610	0.54
1192.2275390	0.59
1193.6186520	0.28
1195.3261720	0.59
1199.8959960	0.17
1204.5371090	0.10
1208.4139400	0.26
1209.1558840	0.32
1212.1542970	0.65
1216.8642580	0.49
1217.6759030	0.42
1226.0100100	0.17
1227.4410400	0.12
1231.8212890	0.64
1233.6125490	0.71
1235.3223880	0.60
1237.5529790	0.07
1239.7949220	0.95
1242.2027590	0.22
1248.9194340	0.59
1250.6245120	0.59
1251.7570800	0.10
1258.9404300	0.13
1260.2213130	0.41
1265.8101810	0.52
1266.7053220	0.47
1270.0924070	0.31
1272.3941650	0.14
1274.1866460	2.30
1275.1824950	3.08
1276.0030520	0.57
1283.7131350	0.54
1284.7076420	1.01
1285.5656740	0.28
1288.6494140	0.36
1289.5205080	0.30
1290.5793460	0.39
1291.6234130	1.58
1292.8393550	0.07
1307.3872070	1.96
1308.5042720	2.09
1309.3333740	0.15
1310.5275880	0.17
1315.9267580	0.23
1330.7899170	0.27
1333.6397710	0.13
1336.0977780	0.21
1339.7562260	0.44
1341.3162840	0.19
1343.5977780	0.15
1351.1684570	0.33
1353.4837650	0.15
1354.3948970	0.41
1370.9598390	0.61
1375.4221190	0.60
1378.8376460	0.67
1382.4328610	0.35
1385.6168210	0.13
1387.2229000	0.34
1387.8706050	0.10
1388.8438720	0.63
1389.5051270	0.12
1394.8551030	0.28
1395.5054930	0.25
1396.1359860	0.75
1398.6480710	0.33
1400.6054690	0.64
1403.1363530	0.22
1404.7941890	0.86
1406.0957030	0.21
1411.1903080	0.34
1414.0555420	0.33
1417.4200440	0.17
1418.1319580	0.33
1420.4309080	0.33
1423.1124270	0.22
1423.8530270	1.03
1424.6304930	0.07
1434.4539790	0.21
1439.1223140	0.47
1440.9566650	0.10
1443.8103030	0.73
1445.2835690	0.56
1446.4046630	0.31
1447.8081050	0.53
1450.8177490	0.30
1452.3216550	1.74
1453.4019780	3.40
1454.1024170	0.49
1457.7073970	0.53
1459.7564700	0.10
1460.3958740	0.19
1461.4097900	0.81
1463.4133300	0.10
1465.6488040	0.39
1467.1273190	0.74
1469.4276120	1.18
1471.0715330	0.31
1474.3983150	0.45
1476.7418210	0.28
1478.7722170	0.26
1479.9649660	0.21
1481.1380620	1.82
1485.1224370	0.38
1489.2117920	0.05
1494.4239500	0.66
1496.5528560	0.27
1497.2575680	0.36
1498.1883540	1.06
1499.0471190	0.39
1499.9222410	0.29
1500.5871580	0.19
1502.3500980	0.38
1504.0462650	0.56
1507.2291260	0.34
1509.2684330	0.23
1510.6711430	1.87
1511.3493650	0.13
1513.2441410	0.44
1517.4023440	0.16
1518.7904050	0.41
1520.6795650	0.72
1525.4949950	0.62
1526.8465580	2.14
1527.6993410	0.88
1530.8665770	0.20
1534.1182860	0.84
1534.8719480	0.33
1535.8347170	0.68
1537.9884030	0.50
1544.8724370	0.46
1545.5570070	0.42
1547.2679440	1.24
1548.6370850	0.52
1550.1757810	0.34
1551.2416990	0.97
1553.7796630	2.78
1554.6491700	1.24
1555.3409420	0.21
1556.4681400	1.19
1559.0411380	0.32
1560.9307860	0.16
1561.9259030	0.63
1563.0167240	2.72
1563.9573970	1.03
1565.1900630	1.04
1566.4429930	0.95
1567.4821780	0.40
1569.8614500	0.79
1570.7052000	0.44
1571.6268310	0.07
1572.5306400	0.63
1573.7281490	0.58
1574.3662110	0.10
1575.1479490	0.44
1576.1821290	0.43
1576.9698490	0.31
1578.0762940	0.63
1578.8721920	0.22
1580.9201660	0.60
1582.6533200	0.32
1585.0552980	0.32
1585.7568360	0.79
1587.7636720	0.09
1591.5533450	0.48
1594.0439450	1.94
1595.3511960	0.12
1600.2641600	0.08
1601.1916500	0.65
1602.4459230	0.12
1603.1208500	0.73
1610.8944090	2.21
1612.0745850	0.57
1620.0285640	0.55
1626.5665280	0.17
1632.7247310	0.75
1636.0979000	0.16
1640.8177490	0.54
1641.5899660	0.89
1643.8396000	0.68
1645.1046140	0.08
1648.4143070	0.18
1658.9826660	0.72
1659.6691890	0.45
1667.0593260	0.96
1668.3498540	1.92
1669.2164310	0.15
1671.0474850	0.05
1674.1822510	0.14
1677.9704590	0.08
1693.4866940	0.08
1703.4334720	0.26
1712.8953860	0.21
1716.7943120	0.08
1719.3795170	0.31
1735.3322750	0.17
1738.6389160	0.13
1754.9274900	0.12
1771.9539790	0.09
1825.1251220	0.15
1868.0158690	0.13
1870.8214110	0.17
1891.8542480	0.24
1900.6610110	5.46
1902.9630130	0.12
1906.4061280	0.12
1922.4913330	0.08
1927.5399170	0.17
1930.7135010	0.11
1986.4689940	0.09
1996.9494630	4.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	293.1241
Annotation	Ethyl (S)-3-hydroxybutyrate glucoside
Peak:m/z	Relative Intensity
84.9899445	1.56
87.0259323	0.13
88.9019623	3.66
94.9093323	0.72
96.9769898	0.43
98.8975525	0.10
100.9752808	7.02
104.9589233	0.06
106.7209778	0.14
108.9848175	0.08
113.0683212	6.13
115.1113892	1.09
117.0408859	0.05
118.9751434	3.33
125.0452042	0.23
127.0166473	1.09
127.9793625	3.44
129.0524597	0.90
131.0761871	100.00
142.3881836	0.07
142.9939575	2.70
145.0786743	0.69
146.9236450	0.11
148.8894043	0.78
155.0758972	0.15
156.9133453	0.41
159.0785675	0.33
160.8090057	0.58
164.1587524	0.22
166.9149170	0.04
168.9464569	0.09
173.0363007	7.68
175.9929504	0.12
179.0344849	1.48
181.1005402	0.09
183.0360565	0.22
184.9933319	1.34
187.1269226	0.10
203.0031128	0.89
209.4438782	0.12
216.9132385	0.08
227.1556091	0.20
233.0942078	0.31
237.6075439	0.04
239.0047302	0.10
244.8999023	0.07
246.8905640	0.36
249.1569824	0.30
257.1331787	0.67
258.0084229	0.21
262.9175720	0.04
265.0716553	0.05
275.1762085	3.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	712.1962
Annotation	Unknow
Peak:m/z	Relative Intensity
234.7570190	0.10
258.1513672	0.16
258.9658203	0.18
271.0338745	0.14
276.6801758	0.25
277.2901611	0.43
280.1976013	0.42
288.9590454	4.50
289.6907959	0.23
290.4910278	0.12
292.0991211	0.22
293.2756958	0.04
294.5470276	0.26
306.9406738	0.56
319.1146851	0.10
323.1036377	0.03
324.8021851	2.63
337.0905762	0.08
342.1704102	0.36
343.0838013	1.05
354.7275391	0.28
360.7728882	0.28
365.1554565	0.07
369.0401611	0.46
370.0921021	15.98
371.0161743	0.51
372.4880371	0.05
374.4333496	0.05
376.8927612	0.26
379.0476074	0.22
388.2465820	0.10
395.5961304	0.05
397.0181274	0.97
415.0455933	0.22
425.8482666	0.12
451.0882568	0.66
456.8916626	0.57
459.7769165	1.21
480.8170166	0.17
485.9163818	0.18
487.0938721	0.94
502.9574585	0.05
516.8996582	1.71
541.0756226	100.00
542.1889038	1.01
543.3142700	0.17
547.6425171	0.32
548.6210327	0.22
550.0530396	1.02
551.2128906	0.12
559.0874634	0.59
574.8233032	0.14
576.9822388	5.24
592.0532227	0.37
604.0170288	0.24
607.4273071	0.09
614.0919189	0.26
621.1594849	0.10
622.1055908	0.27
634.0184326	0.10
650.5187378	0.10
652.0254517	0.19
658.3250122	0.29
663.6903076	0.05
666.6370239	0.06
676.2064819	0.11
694.0051270	0.67
738.9455566	27.49
740.0720825	0.33
1080.9191890	0.69
1081.7772220	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	284.0943
Annotation	Unknow
Peak:m/z	Relative Intensity
94.9172363	0.01
103.0202026	0.02
109.2560806	0.02
114.8719254	0.03
130.9364929	9.72
134.2231140	0.02
135.2314758	0.04
149.2121735	0.03
152.3485565	0.02
157.8552399	0.02
159.9277344	0.02
162.9434052	100.00
163.9113312	0.04
164.9928589	0.02
172.1379395	0.02
197.0265503	1.00
222.4552307	0.05
223.6161194	0.03
225.4425964	0.01
239.0662537	0.02
241.4559326	0.04
242.1555481	0.02
242.9029541	0.08
248.4528503	0.04
249.3446655	0.01
260.9695435	0.01
265.6431885	0.05
266.3903198	0.02
267.1341858	0.07
269.0577698	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2838
Annotation	Halisphingosine A
Peak:m/z	Relative Intensity
90.09870911	0.14
90.98414612	0.28
92.96602631	0.38
94.88621521	1.43
95.98912811	0.05
96.89903259	0.99
102.6964569	0.09
104.7891464	0.52
106.9071808	0.54
108.1810989	0.39
109.007019	2.07
110.0697403	0.18
111.1679611	0.65
112.1215363	0.06
113.9558487	0.10
119.0798874	0.66
121.0282135	1.25
121.9432068	0.05
123.101059	2.45
124.1231384	0.17
125.0299072	0.34
129.3088074	0.11
129.9728241	0.19
132.1643219	0.12
133.1006927	1.09
135.1078644	0.88
137.0808411	0.84
138.0294189	0.10
139.2010193	0.07
140.4479065	0.03
144.9391479	0.30
147.1194763	0.78
148.1232605	0.05
149.0283203	0.83
151.0084229	1.62
153.3070374	0.27
153.9661102	0.16
154.8923492	0.17
155.9775391	0.78
157.0380554	0.35
160.2465057	0.05
161.0567322	0.48
163.0530396	0.57
165.0870056	0.72
168.9295349	0.22
175.1188049	0.46
176.0408173	0.15
177.3024597	0.45
179.12677	0.08
179.949585	0.15
182.4573517	0.06
183.1784668	0.08
189.1615753	0.54
189.9194641	0.05
191.3347473	0.81
195.269928	0.20
199.1077423	0.28
202.1951904	0.13
203.4269104	0.36
205.02005	0.17
207.1989441	0.54
210.2622681	0.10
211.3080139	0.20
219.3069763	1.60
221.0765991	1.37
222.0969543	0.11
225.0420532	0.41
227.1183167	0.47
229.2930603	0.15
230.0092163	0.04
233.3383179	2.45
236.4180298	0.15
237.2642517	1.60
239.0879822	1.48
241.1833801	0.20
242.2564392	1.67
245.3446655	2.69
249.3983765	0.14
250.2205811	1.90
251.1182556	2.35
252.4328003	0.55
253.1654053	0.13
254.0068359	0.05
256.5310669	0.07
257.6403198	0.10
258.2910461	0.07
262.2373352	4.09
263.2998657	2.97
265.258728	0.06
267.0687256	2.41
268.2663574	1.39
269.3444214	0.13
271.1185608	0.32
272.2945557	0.07
273.2742615	0.27
274.2996826	0.41
275.0583496	0.30
276.4198303	0.15
280.2525024	59.19
281.3786011	1.38
283.0838623	0.07
285.1057739	1.42
285.7443542	0.06
288.0769043	0.12
289.0264893	0.23
294.2099609	0.07
295.0883179	0.20
298.2722473	100.00
299.1567688	2.41
301.9754944	0.25
306.9012146	0.57
313.1092224	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	418.8945
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0611725	0.06
174.9876099	1.49
217.9832764	0.04
244.9689331	0.24
260.8656006	0.09
262.7832642	0.01
273.0443115	0.57
274.1228027	0.52
274.9508362	0.01
276.8845825	0.04
288.9583435	28.82
304.9235840	100.00
305.5408936	0.15
330.1284790	0.11
333.1268005	0.09
344.9501953	0.48
346.9170532	0.11
348.0515747	0.02
362.8215027	0.10
373.0278320	0.10
374.1507568	0.20
375.0207825	0.14
388.7746277	0.04
390.8962097	0.08
392.3593445	0.06
407.0384216	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.2162
Annotation	Unknow
Peak:m/z	Relative Intensity
171.1657715	0.37
217.2507935	0.45
221.0791473	0.06
231.2774506	0.12
240.1248322	0.17
245.3340759	0.16
249.9025879	0.29
257.9103699	0.17
272.3333130	0.07
282.7258911	0.15
283.5513000	0.11
300.1778564	0.84
311.3274536	0.33
325.1832886	0.20
334.4475098	0.33
338.0950928	0.10
339.1580200	0.16
357.1791382	0.35
376.2634277	0.04
379.2866211	0.44
392.3072510	0.44
393.3215942	0.71
395.0729980	0.14
402.2516479	0.09
412.1171265	30.53
413.1378784	100.00
413.7546997	0.17
427.2284546	0.10
428.6910400	1.11
442.4119873	0.55
444.5367432	0.33
452.3333740	0.14
459.0941162	0.07
461.1182861	0.07
462.9863892	0.46
463.7821045	0.24
464.7541504	0.25
466.4688110	0.49
470.3298340	0.31
477.0790405	0.65
478.2854004	0.51
479.3739014	0.47
484.2921753	0.36
495.5900269	0.68
497.8095093	0.32
502.5083618	0.43
504.5158081	0.17
515.3708496	0.07
523.2175903	0.13
538.0130005	0.18
541.2409668	2.18
543.8167114	0.23
544.4949951	0.14
547.4524536	0.25
548.6295776	0.17
549.9597168	1.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	150.06
Annotation	Methionine
Peak:m/z	Relative Intensity
55.8829727	0.48
73.9497986	0.04
77.9667587	0.06
101.9719849	1.05
104.0028687	30.43
114.2810059	0.02
132.8531342	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.1436
Annotation	Unknow
Peak:m/z	Relative Intensity
90.9037170	0.55
95.0621872	0.14
96.7667770	0.16
98.1249237	0.05
106.4213867	0.12
111.1985397	0.04
115.9498596	0.07
118.8548660	1.04
122.8959579	0.11
123.9019470	0.05
130.0572815	0.23
132.8048248	0.09
135.2115784	0.03
137.0918274	0.07
141.0762634	0.19
146.2349243	0.05
147.0514679	0.24
148.1864319	0.05
150.9652710	100.00
152.9635010	0.07
157.0003052	0.08
159.9156647	0.18
161.1618042	0.06
162.6712189	0.06
165.1734009	0.06
167.9996643	64.64
169.2668915	0.12
171.2392731	0.06
179.0079651	0.10
183.1093445	0.08
184.9528198	0.09
187.1815186	0.05
189.1663055	0.07
191.0345154	0.04
195.2133789	0.41
198.1876831	0.24
208.2352905	0.06
209.3857117	0.08
210.9071960	0.03
212.1452637	0.06
217.0941467	0.28
221.7249146	0.58
223.3158264	0.24
225.1438293	0.16
232.9237061	0.04
234.0808105	6.53
235.2456665	0.06
237.2198181	0.37
239.1670837	0.29
243.2768555	0.34
251.1484985	6.69
253.1004944	0.21
255.1246033	0.42
256.0665283	0.50
261.2842407	0.53
265.0889893	0.36
265.6896973	0.23
267.1687622	0.10
269.1509094	0.60
273.0558167	0.19
274.9913940	0.10
279.3085938	7.51
280.1305237	62.12
281.0840759	0.18
287.9671631	0.64
297.0226440	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	293.1241
Annotation	Ethyl (S)-3-hydroxybutyrate glucoside
Peak:m/z	Relative Intensity
84.9805374	1.29
86.7807770	0.26
88.8822327	2.47
94.9558716	0.79
96.9224091	0.06
98.9798279	0.29
100.9727936	5.70
113.0121307	6.96
115.2466354	1.01
118.9457397	3.94
124.9857635	0.64
127.1018295	0.97
128.9988098	0.25
131.0847473	100.00
141.0442505	0.16
143.0690918	1.78
144.9663391	0.14
149.0880737	0.47
155.1780701	0.38
156.7960510	0.17
158.9238892	0.37
160.9901123	1.62
169.2123871	0.20
170.9013214	0.15
173.0632172	9.04
179.0257568	1.44
185.0131073	0.82
203.0127563	2.12
233.2148438	0.33
249.3345337	0.07
251.0472412	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.9711
Annotation	Unknow
Peak:m/z	Relative Intensity
129.2044373	0.03
136.0933990	0.05
137.4456329	0.02
143.9581299	0.01
150.1008453	0.08
161.6786194	0.04
177.0835571	0.03
179.1355286	0.05
187.2760925	0.01
196.1908875	0.05
201.9945831	0.08
205.1461487	0.04
212.1352234	0.01
213.0244141	0.09
220.2826691	0.03
239.1545410	0.01
243.2652893	0.03
251.1690979	0.02
257.0456238	0.02
257.9360046	0.03
260.2917175	0.02
264.0535583	0.03
265.1571350	0.03
274.1816101	0.07
276.2026062	0.10
277.2944336	0.02
284.4557495	0.03
286.0202942	0.05
290.8634949	0.01
292.1867676	0.03
296.1887512	0.02
301.0145874	0.05
304.1477966	0.32
305.4684448	0.11
308.1427612	0.06
309.1704712	0.18
314.1153564	0.07
317.9284973	0.10
319.2385864	0.04
330.2276611	0.08
331.0186768	0.08
331.9866333	0.27
333.6851501	0.03
348.0185547	1.07
354.3127441	0.03
357.9551086	0.05
373.1997986	0.04
374.0551758	0.03
374.8616638	0.02
376.0508423	0.32
392.2857361	0.07
394.0704041	100.00
401.4952087	0.02
402.1416321	0.27
410.3699036	0.07
420.0187988	3.01
429.0186768	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
89.0824890	0.14
96.7718277	0.25
100.8858490	5.93
106.6736908	0.31
112.9499664	19.45
114.7498169	0.38
118.9279785	17.68
125.0104980	2.42
128.0683594	0.31
130.9497528	5.66
140.0920715	0.15
143.0259857	17.59
147.7112122	0.08
148.9224243	4.11
158.9186554	0.15
161.0149536	18.21
164.9215393	0.19
177.4725647	0.25
179.0126495	100.00
205.1812439	0.15
219.8563538	0.14
221.0429382	1.18
244.4754639	0.33
262.9937439	0.24
281.1305847	2.68
295.1233215	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.2055
Annotation	Lysergic acid diethylamide
Peak:m/z	Relative Intensity
93.0348129	0.02
108.9490051	0.01
112.1849823	0.02
120.1364594	0.06
121.0574341	0.03
138.0475159	0.02
139.0365906	0.01
146.3166962	0.03
147.1444092	0.01
149.1468201	0.04
160.2116089	0.02
162.2158508	0.01
165.1573639	0.02
166.0128937	0.08
167.4383850	0.06
175.2246552	0.05
180.0540161	0.03
183.9541473	0.38
187.4142456	0.07
191.3691406	0.07
194.0127869	0.02
204.0144043	0.05
208.1905518	0.02
212.1380920	2.88
213.1903992	0.11
215.1681213	0.03
222.1268616	0.01
223.0018311	0.01
224.0681763	0.11
228.1098938	0.02
231.9092102	0.03
238.1526489	0.02
239.5731201	0.11
240.2506104	0.17
249.1310425	0.09
252.0295410	0.15
253.3400879	0.04
254.0315247	0.10
257.2290344	0.06
258.6112061	0.07
262.4877930	0.01
263.7394714	0.03
265.1061401	0.11
268.1575317	100.00
269.2385559	1.04
270.1998291	0.04
271.0281677	0.07
272.1841125	0.03
278.5532227	0.08
279.2010803	0.26
283.1040649	1.76
285.6357117	0.01
288.2379761	0.02
289.0167236	0.02
293.6071167	0.03
294.2944946	0.08
294.9001465	0.04
296.3928833	0.06
300.9064941	0.54
301.6650391	0.08
302.7887268	0.05
306.1963501	0.35
307.0568848	0.29
308.2665405	0.20
309.3575439	0.21
314.8929138	0.14
315.6539307	0.13
316.2679443	0.02
317.3055420	0.06
324.1684570	0.02
324.9323120	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.2422
Annotation	Swietmanin I
Peak:m/z	Relative Intensity
160.8423462	0.04
306.8889160	0.17
314.0445557	0.09
314.8353271	0.11
343.3975220	0.09
349.3507080	0.09
353.1978149	0.13
361.2991943	0.03
365.4812012	0.08
367.2448120	100.00
377.1690674	0.05
403.1408081	0.81
417.5377197	0.14
419.2816772	0.04
421.8284912	0.19
431.2645264	0.05
436.2473145	0.09
451.1609497	0.05
475.3278809	0.11
478.5848999	0.21
481.1232300	0.22
482.9614258	0.09
496.5043335	0.12
502.0215454	0.05
505.2358398	0.20
510.6189575	0.04
519.0770264	0.19
521.1375732	0.45
521.8253784	0.05
523.3414917	0.39
529.4677124	0.63
537.6116333	0.07
547.3508301	0.59
548.1350098	0.21
556.4273071	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.14
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
175.0266418	0.05
176.9638367	0.53
179.0366364	2.80
181.1831360	0.12
181.9128418	0.42
183.1067505	0.15
185.0386658	0.38
192.1229553	0.44
197.0581360	0.52
203.0775452	0.22
209.0196228	0.32
210.1314545	4.31
213.0973816	0.46
228.3502502	0.04
229.1385803	0.06
236.1942139	0.36
242.3305359	0.05
252.2186127	0.30
254.1250305	13.76
260.2500916	0.10
263.1005859	0.27
268.9191895	0.11
272.1646118	42.34
286.0628662	0.70
288.1580811	7.49
304.1900635	13.35
306.0679932	100.00
319.9251709	0.81
323.1606445	0.10
331.1664429	0.08
338.0458984	39.22
338.6716919	0.07
353.1616211	0.13
430.4614868	0.08
432.0147705	0.22
438.6242065	0.05
463.9885254	1.22
464.6945801	0.17
482.1748657	32.70
485.0898438	0.21
536.1599121	0.17
575.1694336	0.81
576.0411987	0.19
593.1840820	19.87
594.0817261	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	544.73
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9047089	0.63
208.8293457	0.59
211.9653168	0.06
212.8522949	0.04
256.0549927	0.02
290.8735962	6.78
292.8259277	9.28
296.1791382	0.02
307.9354858	0.01
332.0264893	0.01
333.0785522	0.02
337.0098267	0.02
348.8757935	0.03
353.1369019	0.02
368.6547241	0.17
369.7622070	0.05
370.9108887	0.31
374.6128540	1.92
376.6079102	5.69
377.3744507	0.03
381.2059937	0.19
382.4209595	0.16
390.1919556	0.02
391.2321777	0.04
392.9860229	0.10
402.3174438	0.04
408.1727905	0.06
409.3013306	0.02
412.8430786	0.15
416.3076172	0.05
422.9252319	0.08
428.3452148	0.02
438.7872925	0.04
440.3017578	0.01
446.8400879	0.31
458.5178223	13.82
460.5516357	100.00
461.2730103	0.48
474.4307251	0.06
477.1079712	0.02
480.4925537	0.05
484.8038940	0.24
488.7178345	0.07
498.6849976	0.97
502.5747070	0.07
508.8524780	0.02
513.3890991	0.02
514.2348022	0.07
526.0773315	0.26
526.8637085	1.69
527.4771118	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	861.9438
Annotation	Unknow
Peak:m/z	Relative Intensity
245.1519165	0.57
271.9447021	0.49
274.1582031	0.29
280.2512207	1.54
283.3295898	0.22
311.2296753	0.52
319.0366821	0.37
337.2022095	2.17
346.0880127	0.31
375.1770020	0.15
396.4094238	0.51
402.5123901	0.16
413.2010498	0.82
414.6402588	0.78
416.4789429	0.40
428.2584839	0.45
440.3975830	0.17
450.4489746	0.66
452.0935669	0.32
455.1769409	0.27
458.3018188	0.23
468.9880371	0.07
476.3286133	0.20
484.1696777	0.62
487.3104248	0.61
488.4304199	0.60
494.0408325	0.24
502.2482910	0.95
503.1897583	0.19
507.4783325	2.07
524.4595947	0.18
525.3294678	0.17
529.2221069	0.21
543.3697510	0.84
544.1084595	0.20
548.2801514	0.09
554.2956543	0.62
555.2528687	0.28
564.9505615	0.38
583.6344604	0.63
586.2241821	0.34
598.2743530	0.32
599.1541748	0.64
599.7922974	0.49
606.2037964	0.25
608.3536377	2.41
616.5215454	0.13
620.2741089	0.32
630.6232300	0.93
634.3986206	1.88
641.5371704	0.15
645.9752197	0.27
654.1787109	0.37
655.0865479	2.91
655.9756470	1.25
658.7897339	0.72
662.3959351	0.87
670.1421509	0.51
676.6575928	1.24
679.3024292	1.52
680.3960571	0.57
683.4603882	0.91
687.2546997	0.14
702.9597778	0.77
709.1880493	1.28
710.1466064	0.41
711.3030396	0.88
711.9360352	1.53
713.0168457	1.15
715.3587036	0.64
729.0664062	0.59
733.4135132	0.20
734.5622559	0.31
738.8804321	0.65
740.0058594	0.42
744.0236206	0.30
745.2394409	1.71
747.9971313	4.64
748.6912231	0.12
749.5750122	1.09
752.2922974	7.24
754.7202759	0.18
764.1906738	0.53
765.6618042	1.02
766.4592896	8.01
767.3916626	1.74
768.3893433	0.43
771.6990356	1.78
773.3428345	1.18
776.8320923	2.31
777.9675903	0.92
779.4624023	0.49
782.9448853	0.29
785.3908691	0.14
787.9973145	6.12
790.4582520	0.42
792.2798462	15.53
793.7781372	0.59
795.6792603	0.51
799.0103149	0.71
800.2209473	0.24
803.6169434	1.13
808.4773560	1.16
812.0040283	2.94
812.7891235	1.10
817.8643188	2.15
820.2883911	1.92
822.7984009	0.19
824.5006104	3.45
825.1251221	3.12
829.1750488	17.95
829.8826294	1.53
830.7276001	1.05
831.9770508	0.20
834.0955200	0.38
836.3090210	0.54
837.4939575	4.07
838.4638672	0.34
846.3477173	1.90
847.2021484	0.52
848.6044312	0.96
849.2846680	1.20
851.1081543	0.93
875.6163330	1.07
876.2412109	0.45
879.6124878	0.20
888.1563110	1.78
894.0761108	41.83
895.1535034	1.35
896.4041138	0.69
901.4611816	0.38
902.2799683	0.52
906.5252075	0.25
910.5886230	0.81
912.2713013	1.21
923.0083618	5.93
923.8230591	0.28
925.7426147	0.31
927.3582153	0.14
929.7292480	0.90
931.6416626	0.12
935.0256958	1.17
936.4714966	0.19
937.3527832	0.40
940.3774414	0.72
941.0319214	2.27
946.6934204	11.98
948.5925293	1.74
949.4618530	1.33
950.1871948	2.64
952.6161499	1.53
954.5824585	0.22
959.7302246	0.27
962.3126831	0.40
968.5041504	0.63
969.4291992	0.72
970.6109009	0.17
974.4724731	4.06
976.2153320	2.77
980.3503418	21.54
981.3966675	1.33
982.3961792	0.47
983.7656860	0.31
984.5593872	0.53
988.6331177	0.90
993.3224487	3.05
997.7974243	1.06
999.2982788	13.35
1000.1345210	2.20
1002.9701540	0.81
1007.6840820	0.27
1009.1525880	0.40
1010.3110350	0.27
1010.9360960	0.65
1014.7334590	1.18
1023.6232910	0.81
1029.0568850	0.70
1031.0412600	7.77
1031.9008790	1.48
1036.9566650	47.34
1037.5718990	17.39
1038.4647220	0.90
1039.7965090	0.51
1041.0317380	0.96
1046.6677250	0.33
1050.3374020	12.65
1051.7041020	0.29
1053.0955810	0.25
1056.0910640	75.16
1057.2438960	3.17
1057.8463130	0.12
1059.6475830	1.58
1060.8515620	0.25
1062.0009770	1.08
1063.2832030	1.10
1067.6459960	0.30
1069.0561520	5.01
1075.9526370	0.89
1078.6689450	0.60
1081.8505860	1.06
1083.5109860	0.18
1086.3465580	1.23
1087.4055180	0.60
1090.1171880	0.28
1092.1682130	0.86
1093.2514650	0.38
1094.6268310	2.17
1095.7985840	2.78
1099.3466800	5.68
1102.0139160	0.28
1105.1560060	100.00
1106.3251950	3.13
1107.1855470	0.83
1107.9433590	0.56
1110.4780270	0.13
1126.4202880	0.54
1127.6485600	0.93
1134.2697750	0.84
1134.9913330	0.78
1141.9302980	0.28
1142.9019780	0.25
1148.8664550	0.43
1156.0960690	0.39
1157.2214360	1.15
1163.0473630	0.10
1175.8627930	0.48
1186.2358400	0.99
1191.6275630	0.94
1192.7889400	1.44
1195.6340330	0.29
1196.6552730	0.60
1212.0733640	0.23
1227.2045900	0.52
1241.2590330	0.56
1266.4757080	0.23
1269.6412350	0.86
1272.8271480	0.86
1274.5833740	1.34
1280.3927000	0.25
1285.8367920	0.49
1308.6867680	1.84
1309.9090580	1.29
1310.6490480	0.76
1313.1346440	0.35
1322.6333010	0.29
1340.7297360	0.32
1341.9996340	0.53
1358.6240230	0.48
1366.5031740	0.43
1367.2655030	0.21
1373.8011470	0.32
1415.8254390	0.51
1416.7896730	0.38
1418.1981200	0.31
1419.6285400	0.98
1445.4711910	0.19
1450.5839840	1.03
1482.1140140	0.13
1494.2207030	0.22
1495.0358890	0.43
1507.8795170	0.82
1511.6733400	0.20
1519.3798830	0.61
1542.6333010	0.66
1543.5982670	0.09
1552.8709720	0.16
1614.8946530	1.19
1615.6594240	0.27
1622.9621580	0.85
1655.6939700	0.38
1691.2546390	0.14
1742.7819820	0.09
1818.9915770	0.42
1819.8302000	0.49
1820.4732670	0.16
1879.9053960	0.11
1920.5290530	0.16
1942.7198490	0.20
1960.5129390	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	566.2056
Annotation	Unknow
Peak:m/z	Relative Intensity
164.9823456	12.63
181.9620972	100.00
183.7962036	0.18
186.9680176	0.11
204.8980255	5.81
222.6648865	0.23
259.0392151	0.03
276.0964966	0.09
289.1291504	0.12
331.3906860	0.13
344.0953369	1.02
361.7472534	0.96
362.3541870	0.11
366.5236206	0.62
367.2778931	0.53
374.1551514	0.07
385.9825439	2.92
400.2974854	0.07
403.5301514	0.16
404.2015991	0.05
436.6204224	0.09
469.6750488	0.21
524.3328247	0.17
530.2858276	0.04
547.8844604	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	199.99
Annotation	Unknow
Peak:m/z	Relative Intensity
57.8588524	0.02
68.0456390	0.03
68.8476257	0.09
69.7250061	0.03
70.8707962	0.02
72.0441589	0.05
72.9624786	0.02
74.1531219	0.04
81.0417480	0.09
82.1215210	0.04
83.0972214	0.19
84.0107880	0.23
84.8818207	0.03
85.9756775	0.06
87.0022736	0.07
94.9856567	0.07
95.6681061	0.04
97.0484467	0.07
98.1006927	0.15
99.9140778	0.19
100.8699036	0.22
107.0951843	0.09
110.9135742	0.26
113.9565125	0.06
115.0935364	0.13
117.0687408	0.06
118.7684326	0.02
120.9631195	0.02
122.0785522	0.10
124.2866669	0.06
124.9981842	0.08
128.0443420	0.10
129.0175171	0.07
133.6746826	0.18
136.1226044	0.02
137.8235321	0.01
141.0626221	0.14
143.8258362	0.07
147.6498260	0.05
153.9905243	0.10
154.8476715	0.01
155.8577881	0.05
157.1551666	0.04
158.8159180	100.00
159.7646790	0.04
164.0861969	0.17
171.3898773	0.05
172.2255707	0.12
176.7541046	1.14
181.8110504	0.85
182.4253235	0.01
183.0437775	0.04
183.8385468	0.03
191.4238739	0.22
194.4553528	0.29
200.0012207	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	450.2628
Annotation	PE(16:1(9Z)/0:0)
Peak:m/z	Relative Intensity
139.8648682	0.10
152.9356384	0.05
196.1032410	1.90
214.1201935	1.34
221.0872192	0.18
225.1459808	0.06
238.0126953	0.20
253.2215881	100.00
253.8398132	0.17
276.4895630	0.08
280.1510010	0.10
322.2859497	0.09
336.4377441	0.25
337.2089233	0.07
348.3852844	0.30
350.3972778	0.27
352.0992737	0.08
363.2917786	0.11
375.0881958	0.07
376.3575745	0.18
387.4824829	0.05
389.2528381	0.09
394.2075806	0.17
406.2416077	0.29
407.3493652	0.04
412.2709351	0.15
414.3988342	0.37
431.2753601	0.14
432.3757019	0.22
435.3451233	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	402.917
Annotation	Unknow
Peak:m/z	Relative Intensity
130.9710388	0.05
159.0861511	0.24
174.9768372	0.74
229.1559143	0.03
244.9447937	0.29
247.2598572	0.01
272.9860229	3.32
287.3143921	0.03
288.9367676	100.00
307.2657166	0.04
313.9701538	0.01
328.9514465	0.26
346.9986877	0.03
348.8469238	0.02
355.8168640	0.03
356.9846497	0.13
359.1180115	0.06
373.1608887	0.03
375.1750488	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	594.74
Annotation	Unknow
Peak:m/z	Relative Intensity
193.2005920	0.10
207.0649109	0.65
213.0387268	0.04
218.9408722	0.04
223.0270081	0.05
234.8796692	0.17
250.9315796	0.04
252.9125214	0.18
256.8526611	0.31
258.9812927	0.14
274.8889160	1.86
277.0528564	0.06
284.6805725	0.05
290.8090210	3.22
292.9898071	0.04
342.5393677	0.25
356.8190308	0.05
358.6524658	3.11
372.5956421	0.04
374.6345825	0.24
381.0631104	0.13
386.8664551	0.29
400.2327881	0.07
400.9431152	0.06
405.1320190	0.02
406.2567749	0.09
407.2536011	0.18
419.1926880	0.51
420.1465454	0.72
424.7723389	0.07
426.6627197	11.46
428.7423706	1.77
432.9863281	0.16
440.1671143	1.30
442.4714966	12.71
443.1766357	0.09
450.8134766	0.10
458.6462402	2.67
464.7702026	0.05
466.5928955	0.09
474.6850586	0.61
487.5585938	0.67
488.7608643	13.74
492.8044434	0.03
507.9556885	0.13
508.9169312	0.24
510.6864014	100.00
518.3930054	0.03
522.8925171	0.04
526.5970459	7.86
527.2644043	0.14
530.1351929	0.20
530.7860718	0.02
534.8759155	2.15
541.1626587	0.17
545.9597778	0.08
547.8893433	0.27
548.7039795	5.36
550.7177124	0.03
559.1875610	0.27
559.8959351	0.07
564.5673828	0.11
577.1646118	10.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.03668213	0.17
99.11245728	0.04
102.9372101	0.06
105.0997009	0.04
106.961113	2.82
108.9326553	3.16
111.0171738	0.22
112.9395752	0.03
116.974968	0.32
119.0378113	0.23
121.0286713	7.28
123.1197205	0.66
124.998909	0.62
127.9654388	0.08
128.9177094	0.39
130.9400787	0.51
133.0126343	1.37
134.9933014	7.87
137.1870422	0.34
139.0697479	0.30
140.9787903	0.38
142.9917755	1.80
144.8576355	0.17
147.0740356	0.40
149.0264587	3.35
151.0654907	0.67
153.3246613	0.08
154.9042969	0.33
157.0284424	1.63
159.0105591	1.12
160.868042	0.54
163.0462036	1.55
165.1950073	1.34
166.0005035	0.25
167.0296631	0.32
169.0065918	1.46
171.0269165	0.77
173.0127563	1.35
175.1204987	0.25
177.1202087	1.34
179.122467	0.59
181.0642242	0.04
183.0176849	1.08
184.9798279	0.27
187.0216827	2.84
188.0381165	0.03
189.0941772	0.56
191.1897583	0.30
193.1525726	0.16
195.1539307	0.10
197.0520172	0.88
199.0417175	0.11
201.0134277	0.85
202.999939	0.24
205.1688995	1.05
206.8847351	0.06
209.0918579	0.33
211.1257324	0.92
213.1491089	0.17
215.1236877	0.50
217.1472778	0.92
218.9533997	0.30
220.0499878	0.05
221.102417	0.21
223.1027527	0.71
225.1411438	0.10
227.136322	0.28
227.9511108	0.04
229.0902405	1.11
231.2065125	1.11
233.1746521	0.03
235.1895447	0.15
238.9002991	0.22
239.5290833	0.17
241.1535645	0.16
243.1760254	0.28
245.1807556	5.96
247.2713013	10.46
248.9844055	0.18
253.166626	0.21
255.3045044	0.10
257.1022339	0.44
259.1478271	1.02
261.250885	0.06
263.3033142	0.09
265.170929	0.13
267.2400513	0.14
269.1818237	0.14
271.2081909	0.26
273.4007568	0.11
277.0895691	0.38
279.3519897	0.15
281.2359009	0.42
282.2905273	0.04
283.1607056	0.07
285.1383057	0.59
287.3431396	0.21
291.3059082	0.18
295.162323	1.32
296.460083	0.15
297.3614502	0.09
299.2769165	3.12
300.1774902	0.12
303.0588379	0.07
305.3216248	2.53
307.3311768	0.04
309.3508301	0.19
310.1794434	0.16
311.4699097	0.10
313.2134399	0.63
313.9869995	0.03
321.5076294	0.03
323.243988	100.00
323.8588867	0.73
324.508667	0.11
325.3080444	0.19
332.2442627	0.44
341.286438	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	624.2007
Annotation	kappa-Lactone
Peak:m/z	Relative Intensity
250.2730255	0.09
282.1138000	100.00
298.4238892	0.05
341.1668701	3.45
454.5187378	0.03
463.6032104	0.04
506.0432739	0.13
534.8231201	0.09
562.3408813	0.05
565.1129761	0.08
578.2931519	0.04
605.4055786	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	989.4816
Annotation	Unknow
Peak:m/z	Relative Intensity
280.1693115	0.06
299.0912170	0.06
363.2267456	0.07
422.9479065	0.04
423.6212769	0.07
425.6129456	0.22
473.1903687	0.19
491.2342834	0.14
506.1015015	0.09
553.3786621	0.30
562.4527588	0.03
568.0683594	0.02
580.1375732	0.03
584.3563232	0.06
598.3110352	0.04
603.2540283	0.09
611.0402832	0.12
614.8409424	0.10
620.4399414	0.77
621.7653809	0.14
623.6173096	0.14
624.3215332	0.21
627.6124268	0.15
633.7703857	0.45
681.6049805	0.27
682.5447998	0.07
686.9580688	0.50
687.5759277	0.15
695.0574951	0.09
696.4454346	0.05
697.5991821	0.14
698.3648682	0.05
699.2414551	0.11
734.2258301	0.17
742.9338379	0.19
743.6596680	0.17
749.4306641	0.07
750.3047485	0.02
751.7418823	0.10
752.6559448	0.06
753.3604126	0.10
754.3009033	0.16
759.4562988	0.47
761.9662476	1.50
762.7072754	0.61
765.5233154	0.09
792.5695801	0.14
798.2066650	0.05
802.5706787	0.17
803.2910156	0.12
806.7825928	0.22
809.5341797	0.14
810.1756592	0.06
815.8208008	0.11
817.0941162	0.19
819.8518066	0.27
820.5334473	0.61
821.1484375	0.05
827.1450195	0.03
843.1250000	0.05
856.9359131	0.40
857.6400146	0.21
858.9367676	0.05
860.0445557	0.33
860.6949463	0.14
861.8918457	0.28
862.8488770	0.14
863.5910645	0.30
865.2048340	0.34
868.2458496	0.82
873.6417236	1.23
874.4426270	2.33
879.8843994	0.90
880.7426758	0.15
882.3616943	0.11
886.0584717	0.29
891.2113037	0.08
891.9908447	0.43
892.9471436	0.26
894.3594971	0.27
898.0692139	0.33
908.2312012	0.45
909.0020752	0.11
915.3695068	0.03
917.1175537	2.63
917.8419189	2.36
918.6341553	0.25
920.6801758	0.03
921.3029785	0.03
922.6307373	3.61
923.2696533	100.00
924.8276367	1.57
925.5826416	0.52
926.2990723	0.09
927.1408691	0.22
932.2509766	0.17
934.4624023	0.33
940.8966064	1.17
941.9715576	0.17
946.6398926	0.24
954.3033447	0.09
960.2319336	0.22
960.8500977	0.30
961.4924316	0.22
972.3726807	0.58
974.3437500	1.12
977.9056396	1.22
978.5574951	0.10
979.5017090	0.80
980.5148926	0.28
993.6486816	0.04
1007.5234380	0.04
1009.3801270	0.18
1010.2666020	0.28
1019.4710690	0.06
1029.0017090	0.04
1044.7380370	0.22
1050.4710690	0.07
1065.4948730	0.21
1072.9146730	0.11
1074.1364750	0.62
1075.2678220	0.60
1097.4854740	0.24
1098.7463380	0.14
1105.8666990	0.03
1108.0759280	0.41
1109.3251950	0.58
1128.2552490	0.15
1136.4840090	0.05
1137.6425780	0.32
1138.9761960	1.03
1139.7114260	0.31
1147.1730960	0.11
1163.7128910	0.10
1166.2526860	0.14
1172.9620360	0.57
1173.8916020	0.55
1174.6687010	0.16
1175.3382570	0.23
1180.4848630	0.08
1203.3681640	0.44
1207.5388180	0.11
1226.1784670	0.12
1227.7000730	0.05
1228.7926030	0.43
1229.6375730	0.14
1237.2098390	0.60
1238.6809080	0.31
1239.7414550	0.25
1244.6210940	1.28
1245.6590580	0.69
1246.5274660	0.44
1247.1921390	0.27
1253.2351070	0.16
1257.9533690	0.18
1261.7364500	0.08
1265.7280270	0.05
1266.7294920	0.03
1268.0439450	0.17
1287.3945310	0.15
1297.4201660	0.19
1302.6575930	1.55
1303.5871580	0.41
1304.3312990	0.21
1310.6363530	0.05
1319.4132080	0.05
1327.0631100	0.07
1328.7127690	0.45
1335.2731930	1.88
1336.0343020	2.02
1336.7808840	0.08
1346.5996090	0.13
1347.4659420	0.17
1372.7687990	0.11
1375.3848880	0.20
1383.5391850	1.83
1384.3983150	3.38
1385.2485350	0.47
1395.4857180	0.07
1425.5238040	0.11
1448.5388180	0.08
1465.5446780	0.20
1466.6707760	0.18
1497.8331300	0.05
1501.5684810	0.06
1522.5544430	0.11
1594.5093990	0.14
1596.7733150	0.34
1618.8734130	0.15
1633.0338130	0.05
1718.7459720	0.02
1722.9869380	0.09
1759.5953370	0.13
1773.9459230	0.07
1775.7030030	0.03
1835.0134280	0.05
1859.2147220	0.06
1860.8209230	0.09
1921.2376710	0.10
1947.1351320	6.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	788.4133
Annotation	Unknow
Peak:m/z	Relative Intensity
227.0815735	0.23
228.9920959	0.04
234.0739746	0.03
237.2896423	0.27
238.0249786	0.10
240.1765442	0.12
253.6138000	0.11
254.4095459	0.17
258.2437439	0.07
259.3130188	0.12
280.0261841	0.25
282.3904114	0.17
288.2531738	0.16
296.1717529	0.22
298.2366943	0.96
298.9921265	0.14
306.5032654	0.15
309.0859375	0.47
314.4559937	0.08
324.2269897	0.35
326.0287781	0.03
328.2871704	0.21
333.1483765	0.06
337.1635742	2.52
338.3262329	0.40
339.3881226	0.07
341.1884460	0.12
342.1331177	0.02
353.0957642	0.23
357.1694031	0.04
359.0914612	0.21
363.8790894	0.04
367.1360779	0.34
369.2733154	1.87
370.0107422	0.18
378.3897095	0.06
381.0214233	0.16
387.0399780	0.77
395.3765869	0.04
399.1524658	0.14
407.1740723	0.40
409.2847900	0.40
411.1275635	0.09
423.3480225	0.27
426.6162109	0.06
436.1843262	8.21
437.1476440	0.41
441.1077271	0.51
444.8544312	0.13
448.2310181	0.09
450.2388916	0.08
452.1538086	0.92
453.2657471	0.89
454.3091431	0.66
456.3782349	0.28
457.5260010	0.03
460.3015137	0.15
461.2597046	0.16
466.3206787	0.67
467.2702637	0.08
468.1433105	0.45
469.6401978	0.05
470.5582886	0.18
478.3831787	0.05
480.3274536	0.27
482.3911743	0.22
486.0511475	1.04
494.4536133	0.33
495.3492432	0.18
498.4406128	0.10
500.3204956	0.10
504.0242310	0.09
506.3561401	0.98
508.4037476	0.58
509.6694946	0.11
510.5743408	0.06
518.3454590	0.05
519.0673828	0.03
520.1077271	0.13
524.2758789	1.95
525.2338867	0.07
528.4059448	0.09
534.4113770	0.31
535.2755737	2.64
536.5126343	0.30
537.4959717	0.09
539.1412354	0.04
546.9606323	0.26
548.6154175	0.33
549.2701416	7.30
550.3441162	0.21
551.4713135	0.55
552.3043823	0.08
553.6704712	0.18
555.3530884	9.82
556.4882812	0.34
559.6414185	0.11
560.3867798	0.12
563.1491089	0.18
565.3705444	1.69
567.2489624	0.43
571.2272949	0.19
577.2766724	1.91
578.3252563	0.08
581.3356323	0.20
582.2290649	0.04
583.4319458	4.33
584.2867432	0.14
585.1652222	0.17
591.5982056	0.08
592.5825806	0.11
595.2990723	48.30
596.3925171	1.87
599.2302856	0.56
603.3348999	0.05
606.9859009	0.04
607.6082153	0.07
609.6506958	0.16
611.4807129	0.39
613.4125977	0.23
614.0211792	0.24
619.1428223	0.17
620.4347534	0.05
621.3279419	0.05
625.5189819	0.05
626.8240356	0.43
632.5801392	0.23
635.1046143	0.25
636.2899780	0.18
637.3707886	1.16
638.4945068	0.07
640.0440063	0.16
642.9915771	0.25
646.0245972	0.04
648.2882080	15.24
649.3242798	0.82
651.2597656	0.39
654.3057251	0.83
657.4064941	0.12
659.9484253	0.15
660.6394653	0.20
662.2610474	0.09
664.2974854	16.59
665.4174194	1.08
666.2507935	0.10
670.0905151	0.23
677.3356323	0.29
678.3200684	0.81
679.2488403	0.06
682.3242798	56.43
683.2536011	2.40
684.3703003	0.69
685.4522095	0.16
686.3074341	0.89
687.6840210	0.08
692.4002686	0.44
693.2542114	0.18
695.3923950	2.28
696.5699463	0.24
698.6276245	0.09
699.2975464	0.05
704.6624756	0.18
705.5271606	0.04
706.4044189	0.43
708.3103638	0.68
713.2565918	0.03
715.3218994	0.06
721.6520386	0.07
722.7252808	0.69
723.4458618	0.25
724.6896362	0.22
726.7803955	0.37
728.4089966	0.05
730.5273438	0.39
732.4957886	0.26
743.8693848	0.64
745.1452026	0.10
746.4085083	0.10
749.1427002	0.89
750.4696655	0.62
754.4121704	0.03
758.8040161	1.04
759.5914307	0.22
763.3341064	0.66
764.2161255	0.07
767.6524048	0.94
770.4241943	0.25
772.4304810	0.08
776.9737549	1.73
777.7462769	2.92
778.5161133	0.09
795.3244629	0.87
796.2083740	0.17
799.0878296	0.34
805.2973022	0.09
807.5769653	0.59
821.9488525	0.26
823.4398804	0.12
829.0966187	0.16
831.0866089	0.45
834.2730103	0.22
839.4558716	0.04
841.5819092	0.23
847.0052490	0.18
849.8503418	0.38
852.9301147	0.05
854.9439087	0.66
860.1372681	1.17
869.1619873	0.23
874.4390869	0.09
876.7352905	0.20
877.9485474	0.26
892.5213013	0.72
894.4130249	100.00
895.4558716	6.40
917.2739258	0.43
923.8510132	0.05
924.4841309	0.32
944.0747070	0.27
960.5864868	0.11
963.9916992	0.13
964.6049805	0.25
967.4110718	0.34
974.9338379	0.13
986.3298950	0.25
993.4028320	5.72
994.2579956	0.62
1001.7821660	0.83
1003.2819210	0.24
1004.2961430	0.03
1013.8236690	0.19
1014.5385130	0.34
1019.4031370	0.23
1020.7871700	0.11
1021.4105830	2.65
1022.2470090	0.44
1033.1374510	0.15
1040.6594240	0.12
1051.2739260	0.50
1053.5136720	0.12
1057.8029790	0.32
1061.1397710	0.04
1076.3493650	0.10
1081.8264160	0.02
1091.5552980	0.29
1092.5402830	0.17
1094.2705080	0.03
1102.6740720	0.25
1120.9523930	0.53
1145.6308590	0.25
1159.7597660	0.43
1189.5802000	5.92
1190.5800780	1.17
1247.1857910	0.07
1248.0396730	0.26
1260.5321040	0.27
1261.3914790	0.11
1301.7169190	0.25
1318.6234130	2.43
1319.6109620	0.08
1345.6407470	0.16
1347.6922610	0.18
1371.7506100	0.39
1372.7672120	0.27
1375.8723140	0.08
1380.1878660	0.14
1389.5297850	44.08
1390.5264890	3.99
1420.6219480	0.19
1479.0429690	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	632.2095
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9682922	1.98
187.1549835	0.07
188.1379395	0.07
215.0199127	0.30
215.6634979	0.03
221.2635193	0.05
223.2444916	0.07
226.2267914	0.04
227.6442261	0.07
229.1323242	0.02
233.0586243	2.49
238.0316010	0.05
245.1042633	0.23
246.8600769	0.07
248.2087860	0.05
256.0440979	0.03
264.1675110	0.02
271.9583130	0.24
273.2126770	0.12
282.0793457	0.03
286.0934448	0.09
287.0755615	0.05
289.0624390	0.38
290.0611267	0.75
291.1196289	0.25
291.9906616	0.10
308.1233521	100.00
320.9086304	0.02
323.9365234	0.05
336.8508911	0.03
340.4697876	0.76
341.0737305	2.39
359.3826904	0.01
373.5078125	0.15
379.8130493	0.06
386.4479980	0.07
388.3842163	0.12
395.0686646	0.23
398.3895264	0.07
399.9683228	0.52
405.5026855	0.02
426.0789795	0.04
432.8115845	0.14
434.1323853	0.51
452.1859741	0.72
470.1203613	42.28
485.7474365	0.03
499.5210571	0.10
500.4601440	0.09
503.1721191	1.18
511.4039307	0.04
512.4636841	0.07
517.9842529	0.17
521.9958496	0.15
543.3747559	0.07
548.4418945	0.23
553.5729370	0.11
557.1328735	0.36
560.7734985	0.22
563.6500244	0.25
575.5434570	0.17
594.9185181	0.10
598.3199463	0.24
614.1593628	1.36
614.9229126	0.25
622.8668823	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
76.92613983	0.81
84.92481995	1.68
91.18771362	1.15
93.14234924	0.57
95.03507996	0.33
96.93995667	1.11
98.94828796	0.71
102.9477997	2.20
104.9376221	0.63
107.0298462	0.98
108.8105316	0.71
111.053299	0.36
123.1866455	1.51
126.7563019	0.57
129.0102539	10.58
129.7937927	1.47
135.010849	1.10
139.1042023	0.95
140.7900543	0.27
142.0792999	0.91
147.017868	1.28
149.1987762	0.27
150.932663	83.44
152.001358	4.17
157.2985535	0.75
159.1203156	1.00
161.171402	4.07
165.0834503	0.30
166.8541718	0.60
169.3454742	0.27
175.0735321	0.95
177.2027435	1.06
178.2181244	0.65
179.015274	1.70
181.9861145	0.75
182.951355	0.60
185.1045685	2.74
189.2264557	3.25
193.1303406	3.93
193.9354095	0.42
195.0392914	0.95
197.1108246	4.13
206.9443207	1.55
209.2789612	0.45
211.4171906	1.11
217.1604004	1.38
224.2173615	1.30
225.1194611	8.54
226.2140656	1.27
235.1687469	13.82
236.5610809	0.49
238.1782227	10.22
251.2637177	2.19
253.0797882	100.00
254.0367584	15.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	390.12
Annotation	Unknow
Peak:m/z	Relative Intensity
121.9286499	2.82
125.5994720	0.07
146.2043610	0.10
163.8829346	0.18
185.5986328	0.06
188.0633087	0.06
199.9710388	0.22
209.1246643	0.26
210.9059448	10.09
214.0230408	0.07
214.6750488	0.25
216.8780518	0.05
227.9661255	100.00
230.3230896	0.11
248.0178223	0.98
251.9527283	0.24
254.7435303	0.10
255.8105469	0.29
258.1371765	0.08
266.1523743	2.03
269.9850769	0.59
273.0353394	0.16
284.1752930	11.13
286.1379700	0.07
287.9687195	0.05
300.2245789	0.08
313.0839233	0.29
314.8723755	0.79
329.2285767	0.04
329.9572144	0.39
331.3407593	0.27
344.0888062	0.50
344.6986694	0.07
347.1037598	0.10
348.6813660	0.04
351.9582825	0.05
354.0974426	1.21
364.1338196	0.07
365.0028076	0.05
367.1741638	0.60
368.8890381	0.16
372.1618652	2.33
373.1091309	0.11
375.0125427	0.15
377.2194824	0.04
378.2825012	0.59
379.9511414	0.21
381.1501465	0.23
382.1211853	0.04
399.2565002	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
97.07801819	0.11
138.9567261	0.44
149.1225128	0.36
165.2661438	0.37
166.7288361	0.55
168.2732086	0.36
169.1497955	0.11
176.9211578	0.11
179.1424713	1.10
195.3464203	0.20
206.4803314	0.36
207.1364746	2.48
208.1752167	2.25
209.1355286	2.26
222.0895233	2.37
223.0506744	3.58
224.0608826	0.87
233.0836334	1.48
235.0617065	0.56
236.0575104	0.37
251.065918	100.00
252.0853271	17.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.82
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8282089	0.40
124.9618149	0.08
174.8793335	0.17
190.8793793	6.09
206.8776550	8.46
214.9895325	0.54
231.8029480	0.60
234.0761108	0.19
251.2037354	0.48
252.0138855	0.39
253.1030579	1.94
258.8147583	1.76
274.8161926	100.00
290.8458862	60.08
298.3316956	0.08
306.8870239	0.16
314.1138000	0.09
337.2745972	0.17
342.8098755	19.39
354.8395691	0.10
358.9249878	11.73
366.8046570	0.80
381.0692444	0.16
409.5086670	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	797.3073
Annotation	Unknow
Peak:m/z	Relative Intensity
293.1899414	0.13
381.4610596	0.06
481.3156738	0.20
487.2773438	0.14
507.8099976	0.07
532.2128296	0.24
550.6711426	0.08
565.0039062	0.07
591.8937988	0.38
592.5339355	0.06
594.5661011	0.06
633.5162964	0.08
683.7179565	0.11
693.5119019	0.26
694.4531860	0.41
700.3280640	0.09
701.9002075	0.09
706.1997681	0.10
711.4520874	0.04
712.3774414	0.08
723.9608154	0.11
728.5310669	0.20
736.3040161	0.11
749.0032349	0.11
754.2886963	100.00
755.1814575	0.03
756.4974976	0.29
768.7542114	0.26
776.5642700	0.38
779.7302856	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0027
Annotation	SC-58125
Peak:m/z	Relative Intensity
129.0096741	0.19
130.8593445	0.05
155.1670837	0.05
173.0192261	1.46
179.0633545	0.05
185.1195679	0.25
191.0006104	100.00
213.0125275	0.19
229.1279755	0.05
244.8181152	0.12
254.9778442	0.47
259.2206421	0.05
273.0008850	0.74
288.2216187	0.08
289.2305298	0.16
299.0283203	0.52
300.3226929	0.10
306.1962280	0.38
307.0948486	0.09
316.9972534	3.63
323.4480286	0.03
332.2431030	0.09
359.0578918	0.44
375.1076355	0.05
377.2659607	0.08
383.0878296	0.51
383.9887085	0.04
384.8244324	0.24
386.1471252	0.13
403.0616760	7.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0712
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
116.7919617	0.07
131.8635254	0.20
149.0136566	0.71
165.1510468	0.30
174.1253204	0.45
180.3026886	0.43
180.9598846	0.08
193.7101746	0.42
194.9564514	1.06
206.2593536	0.74
207.1282043	4.05
208.0284576	2.45
209.1846008	1.49
222.1101379	5.10
223.1526337	4.11
224.2242126	0.41
251.0757599	100.00
252.1606903	24.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	643.1859
Annotation	Unknow
Peak:m/z	Relative Intensity
194.2753906	0.03
198.9563751	0.32
201.0334473	0.23
205.1839600	0.07
215.8038635	0.29
217.0218811	2.22
225.0537872	0.09
226.0781555	0.10
230.0172424	0.20
234.9723816	0.55
238.2406921	0.07
245.3134003	0.18
247.1768188	0.64
255.2062836	0.04
258.2414551	0.09
268.4783325	0.06
272.1052246	0.12
272.9712219	0.09
276.2036133	0.70
276.9853516	0.35
287.0875854	0.09
287.9955444	0.07
289.0533447	0.21
300.0491638	0.08
300.9893188	0.12
302.0576172	0.41
303.0978088	21.51
303.9788208	0.07
310.9051819	0.08
312.0424805	0.14
313.0236816	0.31
318.0894775	0.10
319.0764771	0.05
321.9155273	0.03
330.3287964	0.18
331.1457520	2.66
332.1678467	0.09
336.7133789	0.64
341.3754883	0.24
344.3120728	0.06
345.1278687	0.09
346.9302368	0.47
349.0072021	100.00
349.8515625	0.09
350.8876343	0.11
361.1387329	0.17
362.1586304	0.11
365.9833374	0.25
366.7990112	0.06
378.0228271	5.01
379.0740356	5.22
379.9842529	0.04
385.0097656	0.04
390.9158325	0.40
397.1704712	0.09
408.4633179	0.43
409.1778564	0.08
417.4469604	0.04
419.1609497	0.07
421.1110229	0.25
425.9387207	0.04
431.8989258	0.08
432.9247437	0.02
435.7378540	0.29
436.9078369	1.72
439.0603638	0.18
443.9786377	0.03
445.2973022	0.06
446.2776489	0.08
451.1247559	0.40
452.2648315	0.03
462.9688110	0.57
465.9724731	0.17
466.7929077	0.28
468.6444702	0.11
469.2872925	0.15
474.8745117	0.10
477.8927002	0.08
480.4001465	3.64
481.0779419	32.04
483.2219238	0.03
485.4100952	0.08
493.0626221	0.05
497.2425537	0.28
499.2970581	0.23
510.0026245	1.68
511.0992432	19.22
523.1140747	0.43
529.1673584	0.05
531.9468994	0.21
552.7703247	0.07
569.1561890	0.38
576.0981445	0.53
582.4169922	0.18
585.6834717	0.13
593.9979858	0.17
597.9628296	0.06
600.4985962	0.09
619.3812256	0.16
623.9493408	0.18
625.1157837	1.16
628.6273804	0.26
635.1273804	0.06
654.5825195	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.84591675	0.09
98.8799057	0.11
102.7454529	0.04
105.0938416	0.32
106.9528656	0.89
109.0614014	2.19
111.030899	0.40
112.9433365	0.30
115.1927643	0.04
116.8966751	0.19
118.9051666	0.22
120.988266	2.71
123.0212097	1.23
124.9369812	0.23
129.1022644	0.04
130.9187775	0.19
133.0121002	0.90
135.0432281	3.81
137.046524	0.68
139.0058289	0.02
140.0742188	0.11
141.1040344	0.18
143.0649414	0.42
144.9521179	0.21
146.9883118	2.29
149.0116272	2.01
151.072113	0.61
153.0684357	0.02
155.0513	0.07
156.9912872	0.88
159.0800171	0.24
160.9675598	2.42
163.0965881	1.26
165.0673218	0.73
167.0246582	0.23
168.125061	0.05
169.0609131	0.52
169.9201355	0.02
170.9650269	0.55
173.0517578	1.06
174.1140137	0.04
174.9848938	1.12
177.0780945	1.03
179.1052246	0.07
181.086441	0.30
183.0331268	0.19
184.8793182	0.23
187.1026001	1.44
189.0285339	0.84
191.0672913	0.39
193.2009735	0.15
195.2718048	0.34
196.0413666	0.10
197.0200958	0.79
199.1554718	0.21
199.9776001	0.20
200.9612732	0.18
202.9696045	1.14
205.1840515	0.44
207.0852661	0.34
209.1834717	0.12
210.9764404	0.81
212.0777588	0.10
213.1040344	0.17
215.1561279	0.40
217.0731201	0.99
219.0139771	0.26
221.1639709	0.29
223.4538879	0.60
225.1436768	0.16
227.1691284	0.20
228.2602539	0.04
229.063324	0.17
230.1785278	0.03
231.2175598	1.67
233.2070312	0.04
235.1706848	0.16
237.1221924	0.13
238.1891174	0.06
239.5113831	0.03
241.2770081	0.94
243.1172485	0.48
245.2633057	1.23
247.2921143	6.93
249.2658386	0.11
251.1097412	0.14
253.1535339	0.13
254.0689697	0.05
255.0270996	0.42
257.0209961	0.75
259.3027954	0.31
260.8347168	0.11
265.1772766	0.06
267.2709656	0.53
269.0708313	0.13
271.0315552	0.41
273.142334	0.03
277.1888428	0.07
279.0282593	0.05
281.286499	0.35
283.093689	0.13
284.5019226	0.15
285.2567749	0.33
287.3764648	0.22
294.2285156	0.13
295.2096252	0.20
295.9607544	0.08
297.1141052	0.86
299.2663574	2.17
300.7754822	0.06
303.296814	0.07
305.2486877	2.34
309.1474609	0.03
311.9735718	0.03
313.3330078	0.66
318.6813965	0.08
323.2412109	100.00
324.0121765	0.59
325.2183228	0.03
331.9229736	0.25
339.1880188	0.03
341.1796265	0.61
353.1801453	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0807
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
122.9125366	0.02
136.0667877	25.30
146.9645996	0.07
153.8958130	0.02
157.9686737	0.06
164.9732819	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2416
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
91.1389389	0.06
92.90600586	0.97
94.99620056	1.60
96.92232513	0.55
98.96995544	0.09
104.8760757	0.17
107.0033112	0.27
109.1012726	0.97
110.9991608	0.45
111.9812012	0.09
113.0201263	0.56
117.0689316	0.36
118.9149475	0.14
120.9540939	0.97
123.0121002	2.72
125.1190033	0.79
127.1551437	0.13
128.9192047	0.21
130.2628479	0.10
131.0960388	0.42
133.0491638	0.39
135.0387878	2.62
137.0802917	1.64
138.9228516	2.21
141.0432434	0.68
143.0160217	0.12
144.9903412	0.30
147.1706543	0.23
149.1264648	0.93
150.8778534	0.78
152.0827484	0.06
152.9314575	0.81
154.9830627	0.98
156.9119873	0.12
159.1333008	0.27
161.000351	0.56
163.1233215	0.72
165.0587769	0.30
166.881897	0.30
169.0532684	1.90
170.8617249	0.84
172.3134766	0.15
173.1079865	0.66
175.1864929	0.43
176.9575806	0.48
179.2881317	1.86
181.1030884	0.40
183.049469	3.85
185.1446533	1.37
187.1704254	0.78
189.0146484	0.78
191.0967102	0.43
193.0074768	0.61
194.1210022	0.31
195.1054382	0.35
196.4452209	0.26
197.122818	2.96
197.9739532	0.25
199.1366577	0.51
200.9121094	0.27
203.2003479	1.24
205.0411377	0.30
207.1362915	0.18
209.2414551	1.29
211.1054993	2.22
213.0668335	1.43
215.4190979	0.09
217.1446533	0.35
219.2612	1.58
221.1912842	1.84
223.1582031	1.06
225.0563354	2.15
225.6566162	0.09
227.2327576	0.67
228.5599365	0.05
232.8529968	1.46
233.5650635	0.59
235.2548218	0.31
236.3731079	0.21
237.1742859	2.48
239.1503601	9.85
240.2599182	0.06
241.1911926	0.82
242.1282654	0.34
243.269165	2.14
247.3212585	0.57
251.2607117	2.68
253.3351746	1.10
255.3759155	1.97
257.0344238	0.25
261.1445618	4.81
263.3986511	0.09
264.8482666	0.23
269.0617371	0.42
271.3273315	0.12
275.2392578	0.12
277.1492004	0.15
279.2391663	100.00
280.2750854	0.16
281.2473755	1.43
283.1151733	0.38
287.9674072	1.88
288.8944702	0.15
297.3665161	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1143
Annotation	Unknow
Peak:m/z	Relative Intensity
179.1400757	0.10
284.8420715	0.02
312.9313354	0.01
341.1483765	100.00
351.2967224	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
99.09100342	0.07
107.0561981	1.12
108.9561844	1.37
110.9136047	0.15
113.2408981	0.14
116.7110672	0.35
118.7682495	0.27
120.9823608	4.06
122.894516	0.62
124.9379425	0.23
128.9941406	0.50
130.9365845	0.58
132.8207855	0.21
135.0501556	4.40
137.1759949	0.63
139.0359344	0.27
143.0069885	2.20
144.8487244	0.56
146.8647461	1.67
147.4679871	0.07
149.0994873	1.24
150.9972839	0.99
151.9266968	0.09
153.1394958	0.30
155.0356445	0.26
157.0506897	0.94
159.013092	0.61
160.9560852	1.61
161.9214172	0.08
163.1400452	0.83
164.9436951	0.29
166.9967957	0.20
168.9755859	1.22
170.5735474	0.22
171.176651	0.12
172.9552155	1.08
174.9702454	1.22
177.1786346	0.49
178.0892029	0.21
179.1044617	0.26
183.1106262	0.95
185.1844482	0.18
186.99263	1.58
189.0517578	0.81
193.3034363	0.08
194.442688	0.16
197.0914001	1.66
199.0354919	0.12
201.2006531	0.42
203.07547	1.06
205.2193909	0.70
205.8535156	0.36
207.1902618	0.52
208.9191589	0.83
211.0088806	1.20
213.1055298	0.47
215.1236267	0.22
217.1160583	1.36
219.1777344	0.15
221.0379944	0.51
223.2714539	0.44
224.0611572	0.16
225.0560608	0.61
227.0684509	0.09
228.0467834	0.10
229.2433472	0.28
231.086853	1.43
233.0452881	0.52
237.0993652	0.25
238.8839722	0.29
243.007782	0.62
245.1257629	1.91
247.2327271	5.03
249.2652283	0.21
251.0784302	0.25
253.0773315	0.68
254.0485535	0.37
255.1458435	0.37
257.2264404	0.14
259.1762695	0.94
261.4590759	0.06
267.1566162	0.40
271.2261658	0.87
274.5604248	0.22
277.1481323	0.22
279.1971436	0.48
281.2423706	0.30
281.9757996	0.10
282.9372253	0.42
284.1263428	0.09
287.4025879	0.08
292.403717	0.12
293.9973755	0.07
295.1741943	1.52
296.0984192	0.39
297.3011169	0.33
299.2199707	2.36
300.1367188	0.51
305.1335449	2.12
306.3099976	0.33
309.1802979	0.28
309.8720703	0.10
312.1066284	0.23
313.5299377	0.82
314.9448242	0.06
323.244873	100.00
324.0876465	0.50
325.149231	0.06
326.4240723	0.39
331.7947693	0.25
333.2490845	0.20
341.1436462	0.91
343.9487	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
122.9707642	2.87
131.0644989	2.87
135.0142517	10.70
145.2521362	2.48
149.2704315	6.45
159.0705872	3.92
160.1456604	3.83
161.4049835	2.39
173.1541748	1.59
174.9324341	7.20
193.1324005	15.09
199.1769257	3.14
210.1281586	2.76
221.3269348	7.04
228.5900269	5.72
239.8342285	2.49
245.2394409	2.23
253.1671753	9.93
256.7648621	8.27
263.3666382	4.62
281.1335449	8.39
285.5593262	1.75
286.9960327	11.03
289.209259	11.18
293.4061584	5.97
300.9799805	2.71
307.242981	7.36
323.1397705	6.28
326.866394	14.50
328.9750671	3.78
342.3040466	10.53
356.4402771	12.59
372.1895142	7.63
377.428009	12.81
380.334137	7.98
382.3619385	3.27
383.5438232	7.03
384.4151306	3.03
388.0632935	1.83
390.3314209	25.08
391.6001892	6.65
395.3103027	36.74
408.2774353	100.00
409.3049316	44.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.2553
Annotation	Unknow
Peak:m/z	Relative Intensity
291.7955627	0.04
293.2140808	100.00
294.0561218	0.06
306.3223877	0.10
320.8515015	0.06
324.9655762	0.05
351.6807251	0.15
353.2070923	0.04
355.2345581	0.14
359.4373779	0.10
361.5349121	0.06
372.9933472	0.10
382.2152710	0.10
422.1939087	0.08
425.2149658	0.05
444.9853516	0.04
461.6806030	0.09
473.5445557	0.12
480.2348633	0.08
491.0032349	0.19
524.9545288	0.05
539.4208374	0.14
541.4915161	0.20
543.2653809	2.98
549.4570923	0.17
551.3272095	0.28
557.5866089	0.17
559.7174683	0.06
564.7206421	0.17
565.3489380	0.25
567.2180176	0.06
568.2935181	0.47
569.1567993	0.46
569.7667236	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0852
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
77.05371094	0.20
78.91151428	0.42
79.89260864	0.19
81.05649567	0.98
82.97681427	0.32
85.11230469	0.23
90.97351074	0.42
92.95288086	0.71
94.89192963	1.73
96.90762329	1.16
98.90499878	0.65
102.8952942	0.77
103.9700775	0.16
104.9949188	2.32
107.0558929	1.60
109.00914	0.95
110.8696899	0.57
113.0107269	0.70
114.8953857	0.24
119.0738068	1.15
121.0251312	1.38
123.0026703	1.82
125.178009	0.32
126.0503082	0.31
126.9809875	0.69
128.8760986	7.14
130.0485077	0.54
131.0955048	0.53
133.1030426	1.44
135.1199341	1.65
136.7861023	1.25
138.9614716	1.66
140.7454376	0.57
141.3693695	0.12
142.9081879	0.71
145.0285339	0.72
147.0695801	1.72
149.0252228	0.55
150.9160004	67.56
152.027771	4.88
153.1223145	0.63
154.1101685	0.33
155.1350403	1.64
157.1503906	0.31
161.149231	1.81
162.0704803	0.38
163.2760773	0.96
165.0044098	1.60
166.1490479	1.73
166.9728851	4.32
168.158432	0.12
169.0617065	1.40
170.168045	0.28
171.0559845	1.11
173.8952179	0.14
175.1960602	1.56
177.1444092	0.12
177.9573212	0.56
179.0581512	1.71
181.238266	0.35
182.1225128	0.94
183.0683594	1.45
185.0714264	1.53
189.2661591	1.31
189.8870087	0.50
191.3090668	1.18
192.1491241	0.64
193.134964	1.47
194.0762482	0.58
195.1741028	2.58
196.9700775	4.13
198.2977753	0.96
199.0520172	0.75
200.8318634	0.13
207.1613312	1.63
208.4858551	0.36
209.207962	0.29
210.1138458	0.22
211.2097626	2.08
212.0519867	1.22
213.1704254	0.19
217.2063141	13.61
218.1916809	0.28
221.5036469	0.34
223.115509	0.33
225.1549835	8.81
226.1445465	0.10
227.0904083	0.59
231.0612793	0.50
235.104187	22.95
236.0617676	0.29
238.0701141	12.49
239.0646515	2.37
244.1283417	0.94
250.9617462	1.41
253.0801544	100.00
254.0114746	16.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.1821
Annotation	Unknow
Peak:m/z	Relative Intensity
148.9449005	0.71
183.1941528	0.06
215.1716461	0.06
231.1344452	0.06
233.9704285	0.11
259.0414429	0.17
262.5403748	0.23
273.1186829	0.04
276.2543030	0.05
286.1520691	0.34
303.0397949	0.06
308.1431885	0.06
311.0244141	0.16
317.1381836	0.06
331.2643738	0.07
337.0383911	0.09
341.1748047	0.13
343.2890015	0.39
347.3011475	0.11
349.2614136	0.06
360.8008118	0.18
368.2399902	0.15
375.2891541	0.09
379.3932800	0.10
385.1838074	0.06
393.2621460	100.00
395.1619568	0.06
396.3139038	0.25
409.2116699	0.09
420.2648010	0.13
421.3961487	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.18
Annotation	Tanzawaic acid E
Peak:m/z	Relative Intensity
122.876709	0.12
123.7941284	0.43
126.927887	0.79
139.0276337	0.10
148.8134766	0.06
169.1942902	0.26
171.1053772	0.10
176.3611908	0.08
183.0538025	0.25
187.9585266	0.17
197.1008301	0.08
199.1477051	0.10
201.3066101	0.16
209.2244263	0.48
225.1835022	0.32
227.3894653	0.19
239.2932129	0.07
243.4573975	0.37
244.9749146	0.69
247.1234436	0.15
253.2314148	0.62
255.1124878	0.06
259.2806091	0.04
260.6693115	0.17
262.1344299	0.28
271.1774597	100.00
272.3103638	0.59
273.1926575	2.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	380.156
Annotation	(R)-Pantothenic acid 4'-O-b-D-glucoside
Peak:m/z	Relative Intensity
112.8005981	0.16
116.0473633	0.68
118.8860550	0.86
124.9632416	0.09
128.0749512	0.37
141.8659210	0.10
143.0079651	0.07
143.8683014	0.17
146.0695190	61.48
147.0851593	0.49
159.1259766	0.11
160.9580383	1.08
167.2733154	0.09
173.1379089	0.17
174.1164856	1.12
188.0389404	0.10
200.1156921	2.72
218.0822754	5.66
226.3194885	0.09
233.2994690	0.31
260.2167053	0.91
263.1636963	4.97
272.0952759	0.10
274.1643677	0.13
279.2209167	0.10
288.2365723	0.23
290.1986694	13.38
291.2498474	0.79
302.2173462	0.12
308.2684021	71.05
309.2772217	0.65
314.2468262	0.09
318.0056458	0.58
318.6278992	0.17
320.0416565	0.55
334.3012085	0.91
336.3007812	0.42
337.2144165	0.92
342.0654602	0.32
344.1830139	0.08
362.1994019	100.00
363.1927795	1.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	919.16
Annotation	Unknow
Peak:m/z	Relative Intensity
279.1072083	1.72
282.0990601	0.44
324.1680908	2.11
336.3469238	0.92
337.2597351	0.47
342.4702759	0.54
432.9753418	0.99
439.3748779	9.77
440.4353638	3.02
462.0463257	0.27
471.2749634	0.49
476.3886108	0.44
511.3052368	0.87
524.0314941	1.34
532.5339355	0.79
534.1552734	0.62
560.1677246	0.89
562.5111694	0.98
567.5715942	0.96
591.2039185	0.30
608.5525513	0.76
635.2734985	0.65
648.5440674	0.79
697.0741577	1.73
737.5892944	0.41
756.3012085	0.77
763.7395630	0.41
770.4269409	0.50
772.4955444	1.29
796.0304565	1.01
804.5767212	2.41
807.7964478	3.03
816.5474854	5.13
823.8480835	1.60
828.3253174	4.14
829.4260864	4.90
830.9452515	1.51
834.1901245	7.98
835.5420532	1.04
836.2857056	3.88
837.6696167	0.69
842.8214111	2.24
845.2926636	2.05
847.1535034	0.27
848.5561523	2.50
851.4422607	0.82
854.0138550	2.98
854.7730103	1.47
855.6062622	0.60
856.4295044	0.38
857.3347778	3.99
858.3693237	3.25
860.7025757	0.49
861.5704346	2.78
862.6950684	4.12
866.1638184	3.44
868.6038208	3.95
872.6237183	9.37
874.0438843	2.59
874.9961548	6.65
877.2155762	2.27
879.5972290	18.95
880.2132568	8.32
881.3839111	0.79
882.2218628	0.97
883.8043823	1.39
886.4957886	30.95
887.7608643	6.07
888.9473267	3.15
890.7603149	11.85
891.5535278	9.40
892.3515015	0.68
893.4192505	1.01
895.2183228	5.46
896.0725098	0.58
899.5350342	1.26
901.1745605	0.55
903.4583130	5.48
905.3654175	2.78
908.0005493	8.17
926.3890991	0.25
932.3204956	1.43
937.3790894	0.38
939.3571167	1.23
940.5462036	1.99
946.5078125	1.48
949.2678833	2.85
961.4251099	3.75
965.8727417	2.43
968.2131958	3.90
970.4778442	0.28
971.4171753	1.37
977.0822754	0.41
978.2753296	0.44
983.7009888	1.37
985.1289673	4.09
992.1415405	0.36
994.5903320	2.18
997.0724487	1.79
998.3950195	0.63
1001.1535640	0.89
1015.6918950	3.54
1016.8519900	2.71
1017.9290160	0.77
1022.6671750	2.52
1024.2056880	3.09
1025.5009770	3.90
1026.9578860	0.85
1028.8093260	1.43
1032.5262450	4.42
1033.3502200	6.61
1034.8630370	0.57
1035.9708250	1.63
1041.3796390	4.78
1041.9975590	0.98
1043.4680180	3.46
1044.4289550	1.89
1050.6158450	1.67
1051.4874270	4.78
1052.4129640	1.64
1054.8120120	2.44
1056.1529540	2.92
1058.5214840	2.81
1059.1477050	4.43
1060.0065920	0.76
1061.7808840	0.66
1064.2109380	1.15
1066.9729000	4.25
1067.6850590	6.23
1068.6752930	4.55
1069.7775880	3.15
1070.4224850	3.30
1072.4916990	1.97
1073.4831540	7.35
1076.1127930	4.15
1077.5625000	1.21
1079.3925780	23.72
1080.5361330	14.77
1082.9237060	3.26
1084.0780030	1.39
1086.8660890	2.84
1087.7679440	0.99
1088.7268070	4.64
1089.7005620	2.07
1090.8002930	5.24
1092.9926760	1.28
1094.1440430	2.16
1096.4736330	3.52
1098.9770510	0.85
1100.7194820	1.77
1102.4422610	3.78
1103.3012700	0.71
1105.7980960	11.49
1107.4006350	2.37
1108.3906250	0.27
1110.6345210	7.88
1111.9125980	3.11
1113.6291500	21.74
1114.3541260	11.52
1115.9364010	5.85
1116.6411130	1.84
1117.7524410	15.83
1118.6971440	1.39
1121.1597900	7.37
1122.3937990	2.92
1123.2940670	9.21
1123.9510500	2.35
1125.1638180	10.02
1126.5881350	4.82
1127.4656980	8.26
1130.4401860	12.21
1131.3861080	2.45
1132.5317380	28.66
1133.3571780	3.72
1134.0288090	5.25
1139.0212400	10.88
1139.8087160	0.82
1140.4921880	0.69
1141.8406980	5.29
1142.6296390	10.93
1143.4978030	10.08
1144.6083980	5.96
1146.2844240	2.99
1147.5507810	1.53
1149.2900390	42.73
1150.2854000	3.14
1150.8964840	3.20
1151.7998050	3.35
1154.3083500	2.82
1155.1181640	11.36
1155.9051510	9.44
1157.2194820	2.05
1158.3348390	1.49
1159.5100100	7.45
1163.5589600	25.59
1164.2873540	1.55
1164.9091800	4.28
1166.6788330	3.29
1168.2934570	6.68
1169.1279300	3.96
1170.6101070	1.64
1171.2340090	1.56
1172.5974120	15.46
1173.6679690	1.77
1176.1544190	15.26
1176.8752440	5.46
1178.3815920	8.87
1181.5563960	100.00
1182.3728030	11.16
1183.2038570	4.11
1183.8549800	2.80
1184.5338130	2.43
1185.3126220	0.63
1187.6394040	74.45
1192.2897950	4.72
1193.0615230	10.42
1208.2827150	0.74
1210.4996340	0.79
1215.6307370	0.90
1216.5187990	1.82
1220.5449220	0.74
1230.3438720	0.33
1231.2387700	2.38
1233.8673100	2.32
1241.6063230	0.74
1249.6137700	3.17
1250.6713870	1.03
1251.7413330	1.68
1264.0782470	0.49
1273.5432130	5.20
1287.0313720	1.70
1290.8090820	0.71
1293.7203370	0.44
1295.8695070	3.01
1308.1970210	0.60
1313.0218510	0.99
1321.6947020	1.59
1322.8321530	2.39
1330.6085210	1.07
1339.5531010	1.61
1354.6563720	5.58
1356.7861330	1.20
1361.9774170	0.74
1365.7954100	1.72
1371.9812010	0.79
1377.4559330	2.40
1379.9229740	2.90
1384.4752200	1.45
1387.5876460	1.75
1388.7932130	1.42
1391.6390380	1.26
1399.7962650	1.53
1400.9010010	4.98
1407.9401860	3.13
1408.8034670	1.36
1423.5367430	2.21
1436.1661380	4.84
1438.8496090	2.41
1442.0814210	3.44
1442.6915280	0.66
1451.6477050	2.32
1460.5450440	4.48
1467.0062260	1.80
1468.9539790	1.47
1475.5706790	1.04
1477.5323490	1.26
1480.1197510	1.69
1481.2462160	1.01
1482.7108150	0.27
1502.8604740	4.65
1508.5877690	1.56
1515.5185550	0.33
1517.3455810	0.63
1520.0296630	2.35
1525.5668950	2.87
1526.6362300	1.06
1528.1047360	1.25
1531.3547360	2.30
1533.6287840	1.49
1541.3314210	1.11
1546.2236330	3.11
1549.0057370	2.81
1549.8687740	3.80
1551.3927000	0.52
1552.4805910	2.96
1553.1258540	7.44
1554.0345460	6.76
1555.1646730	0.80
1558.3096920	3.73
1562.1313480	1.41
1568.3193360	0.50
1570.0933840	2.54
1577.6386720	1.84
1579.2465820	3.58
1581.4604490	1.23
1584.5823970	0.88
1594.1007080	1.59
1601.4556880	1.34
1605.7214360	2.59
1606.4603270	2.13
1621.3323970	1.27
1624.6741940	0.52
1625.8221440	4.31
1627.7008060	2.52
1628.4185790	1.67
1635.1522220	0.72
1638.6080320	0.93
1642.1491700	3.23
1646.9055180	3.25
1653.2966310	2.57
1656.7889400	0.52
1670.3210450	1.26
1672.0422360	1.20
1679.2839360	6.85
1679.9342040	0.56
1685.5789790	0.55
1687.9608150	2.16
1688.6950680	0.90
1695.6434330	0.46
1700.8028560	1.59
1708.4527590	2.95
1709.6413570	1.06
1713.7277830	2.59
1726.8425290	0.91
1729.6138920	0.30
1756.4143070	0.33
1759.6273190	0.35
1771.0208740	1.26
1801.8737790	0.38
1815.6397710	0.74
1866.4569090	0.65
1893.7789310	0.90
1951.5242920	0.60
1957.9813230	0.40
1959.4742430	1.49
1988.6260990	0.63
1989.8942870	0.41
1995.7701420	1.42
1996.5003660	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	859.4294
Annotation	Aplasmomycin C
Peak:m/z	Relative Intensity
242.9167938	0.04
244.0885010	0.05
255.3030090	0.03
279.3859863	0.23
299.1489868	0.07
315.0484009	0.04
341.3205566	0.07
351.6137085	0.05
413.5309448	0.04
414.9565430	0.07
455.7814941	0.08
470.4271240	0.04
484.3348389	0.12
489.5464478	0.11
505.3194580	0.31
509.6178589	0.03
510.3978271	0.12
511.2260132	0.07
526.7827148	0.20
536.3137817	0.16
539.6486816	0.05
545.8396606	0.45
554.2536011	0.51
558.0959473	0.08
564.1397095	0.16
569.4431763	0.12
572.8781738	0.91
573.6524048	0.38
581.3386841	0.09
597.4971313	0.10
602.8867798	0.71
609.1400146	0.08
617.2686157	0.16
622.5408325	0.17
624.7050171	0.64
634.1292114	0.17
650.3272095	0.13
651.2776489	0.47
660.0550537	2.60
660.8927612	0.54
665.0203247	0.10
671.7129517	0.07
672.3799438	0.25
673.5061646	0.06
681.9750977	1.87
682.6001587	1.55
687.0829468	10.47
688.0276489	0.98
692.6025391	0.75
693.5238037	0.51
694.5426636	0.17
695.8831177	0.03
696.5706177	0.32
698.8323975	0.05
706.2625122	0.12
706.9968262	0.12
715.4071045	2.31
716.0560303	1.20
720.9419556	0.17
724.6833496	0.07
727.2001953	0.44
728.3928833	0.36
729.1636353	0.12
730.1403809	0.17
737.4265747	2.39
738.0720825	0.96
743.6705933	0.11
746.3032227	0.47
749.0787964	0.04
751.1355591	0.21
752.9440308	0.82
757.8781128	0.16
763.9738770	1.78
764.7417603	1.51
767.2809448	0.13
771.3426514	0.28
773.1562500	3.92
773.9177856	0.24
775.7938843	0.07
777.0144043	0.45
781.4528198	0.08
784.4204712	0.14
786.1240845	3.73
786.9298096	0.04
792.6868286	0.16
794.1727905	3.35
794.9685059	2.82
795.7839966	1.32
796.5317383	0.09
797.1953735	0.05
799.4247437	0.24
802.9740601	0.13
803.8201904	0.11
806.1250610	0.24
806.9733276	0.14
808.6359863	0.07
814.1229248	0.14
815.1996460	0.53
816.9427490	0.40
819.5486450	0.20
822.9707031	0.38
823.9312744	0.16
828.7067871	2.79
829.6772461	0.27
837.7080078	100.00
838.4553223	18.31
839.0875854	0.94
840.2149658	0.07
841.7498779	0.58
842.3832397	0.22
850.4866333	1.67
852.0852661	0.09
856.4689331	0.08
862.5134888	0.13
904.4385986	0.03
994.7327271	0.31
999.5430298	0.15
1003.3700560	0.10
1017.6215210	0.09
1019.4821780	0.22
1020.7876590	0.08
1035.5068360	0.12
1064.3072510	0.08
1117.3564450	0.03
1120.8872070	0.07
1130.2828370	0.12
1130.8861080	0.06
1138.4707030	0.06
1146.6541750	0.18
1147.7353520	0.26
1148.6794430	0.22
1162.3768310	0.06
1164.5689700	0.25
1205.5747070	0.07
1206.5867920	0.16
1218.9332280	0.08
1227.8217770	0.11
1231.5526120	0.15
1245.7084960	0.13
1246.5083010	0.08
1249.6129150	0.16
1250.7967530	0.23
1251.9533690	0.12
1264.5452880	0.06
1302.5958250	0.74
1303.5339360	0.84
1304.5500490	0.35
1346.4046630	0.55
1347.8043210	0.75
1348.8978270	0.05
1370.2601320	0.15
1415.7595210	0.10
1431.1835940	1.29
1432.0013430	0.62
1432.8448490	0.57
1433.9776610	0.18
1457.8688960	0.66
1459.6809080	0.18
1475.6285400	0.51
1476.5755620	0.61
1477.6739500	0.04
1485.3763430	0.20
1510.3955080	0.17
1528.5418700	2.22
1529.5040280	0.95
1530.6928710	0.40
1554.8316650	0.27
1555.9302980	0.26
1556.6374510	0.15
1572.7436520	2.15
1573.6734620	0.71
1574.3968510	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.61346436	0.12
98.97724915	0.12
105.0510788	0.16
107.030426	0.75
109.0643311	1.02
110.9940796	0.16
116.9173584	0.28
117.8811646	0.04
121.0237808	1.93
123.1500244	1.03
125.0942535	0.49
127.041153	0.06
128.9644623	0.15
130.8681641	0.73
132.9140015	0.47
134.1750946	0.07
135.0808868	2.76
136.9911194	0.24
139.0861053	0.08
140.9954834	0.10
143.0230713	1.13
144.936676	0.30
146.9997864	0.45
148.9826965	1.43
150.6585999	0.13
152.0880737	0.05
152.897522	0.07
154.9832764	0.30
156.9159851	0.94
159.024704	0.82
160.957428	0.49
163.0897827	0.37
165.1145935	0.65
167.0903931	0.51
169.0117493	1.69
171.0172424	0.66
172.0943909	0.09
173.0188751	2.06
175.2331238	0.20
177.1034393	0.07
179.2427826	0.21
181.1129456	0.17
182.920166	0.98
185.07547	0.22
187.1295166	1.67
188.9515076	0.21
191.0884399	0.38
193.0752411	0.16
195.0012665	0.11
197.0933533	0.52
199.1160278	0.09
201.0759583	0.46
205.2254181	0.98
207.2587891	0.08
207.8885803	0.16
209.4098206	0.08
211.0932617	0.90
211.8290405	0.07
213.0505676	0.02
214.9507446	0.11
217.0122375	0.26
217.9201355	0.10
221.0588379	0.06
223.1289368	0.55
224.5122681	0.20
225.1149292	0.32
227.2281494	0.10
228.2087097	0.12
229.0050049	0.35
231.2095337	0.32
233.1565857	0.44
235.2118225	0.02
237.191925	0.03
241.3572083	0.24
243.1404114	0.05
245.3307495	0.99
247.3011475	4.27
249.1545105	0.11
250.2119446	0.03
251.3084717	0.50
253.1984253	0.14
257.4041748	0.32
259.2533569	0.68
263.3121338	0.13
265.1043091	0.07
267.1004639	0.20
268.9853516	0.10
271.2619019	0.04
272.9073486	0.13
273.524353	0.19
277.3892212	0.40
279.2126465	0.07
281.2921143	0.13
283.2317505	0.26
285.2537842	0.23
287.3086548	0.43
293.3676758	0.04
295.1326599	1.08
297.210144	0.38
299.2203979	2.24
305.2831421	3.43
306.4728699	0.12
309.180603	0.11
313.3473511	0.68
323.245697	100.00
324.1359863	0.27
340.5055847	0.12
341.3672485	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
84.9101944	0.43
91.06690979	0.09
92.88305664	0.30
94.99768066	1.73
96.91568756	1.75
98.98779297	0.49
109.1392441	1.15
111.036087	0.72
113.0259781	1.21
116.9590607	0.04
118.9754715	0.24
121.0485916	0.43
123.0195999	1.25
124.981102	0.77
127.0810394	0.59
129.0189514	0.06
130.8805237	0.60
132.8435822	0.14
134.9430237	0.61
135.9629822	0.14
137.1715851	0.29
138.9389648	6.70
140.9866943	0.58
142.8336182	0.31
144.9842834	0.04
147.0534363	0.55
149.1650696	0.43
151.000946	0.51
152.4669495	0.22
153.1448517	3.21
154.960144	0.77
156.6408691	0.10
159.0915375	0.72
160.6293335	0.13
161.3749084	0.15
162.8802795	0.10
165.0657654	0.86
167.235672	0.41
169.1003571	0.81
171.2112885	0.12
173.1730804	0.32
175.1521149	0.37
178.1193237	0.20
179.1164093	0.54
180.2697144	0.16
181.1942902	0.83
183.1820068	1.66
185.0431671	0.56
187.2465973	0.09
189.0515594	0.08
191.5119171	0.12
195.111618	1.33
197.066803	4.67
199.2116089	0.35
201.2476807	0.28
203.1802368	1.57
207.0820007	0.20
209.1494141	0.26
211.2451477	1.04
213.3178406	1.00
217.1688232	0.29
219.1503296	0.69
221.3570862	2.11
223.2693481	0.29
225.0985718	1.51
226.2880859	0.15
227.1730652	0.98
228.1374207	0.08
233.2148438	0.75
235.2310791	0.44
236.0342407	0.06
237.1914368	4.41
239.1522522	11.49
241.2088318	0.30
243.1560669	1.21
248.5762634	0.15
250.0941467	0.13
251.2310486	0.79
253.0820923	0.82
255.1438904	1.92
257.0610962	0.88
261.20755	1.85
262.1768188	0.12
265.4225464	0.13
269.2801208	0.78
279.2264709	100.00
280.3828125	0.66
281.1036072	0.44
282.4676208	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	789.4252
Annotation	Unknow
Peak:m/z	Relative Intensity
231.0201569	0.15
271.9908142	0.07
287.0447388	0.18
287.9635620	0.16
299.5996704	0.34
315.3952332	0.07
326.2036438	0.08
332.3496704	2.27
333.1638794	0.12
352.2529297	0.23
377.0786133	0.29
380.5094604	0.13
382.7869263	0.14
386.8933105	0.15
396.5419922	0.42
411.1246948	0.52
422.2761230	0.10
430.2705688	0.25
431.2989502	0.16
439.4287720	0.09
442.7885742	0.38
464.0900269	0.48
468.3410645	0.24
470.3029785	0.23
472.2249146	0.07
477.9104614	0.16
482.0375366	0.43
482.8944702	0.26
504.0101929	0.07
505.3878174	0.31
508.4591675	0.28
509.4817505	0.09
512.4340210	0.23
513.8497314	0.37
522.4129028	0.17
523.1091919	0.10
539.1231079	0.33
549.2805176	1.34
554.1269531	0.50
562.9003906	1.00
564.0548706	0.27
570.1853638	0.20
572.0828247	0.73
597.4556274	0.15
605.3350830	0.11
606.7246704	0.27
611.9642944	0.79
614.3706665	0.14
621.0673828	0.30
630.5908813	0.47
632.2985229	0.22
643.2821655	0.31
658.0259399	0.18
666.8922729	0.46
672.0457153	1.28
672.6576538	0.34
675.1739502	0.67
684.4932251	0.14
688.1277466	0.57
688.7886353	0.46
689.9098511	0.41
690.9187622	0.29
691.8966675	0.32
695.7302856	0.35
698.4530640	0.11
707.0863037	3.17
711.4333496	0.33
714.8095093	0.24
715.4496460	0.26
718.7492065	0.27
723.5481567	0.26
724.6900024	0.24
725.4774780	0.25
727.7400513	25.27
728.7626343	2.34
729.5724487	0.13
730.9971313	0.07
732.2392578	9.94
733.3591309	1.22
734.3380737	0.18
738.5740967	0.31
742.6974487	0.09
752.5103149	0.55
753.6495972	0.35
756.7925415	0.10
759.7756348	1.31
762.6248169	0.17
763.9129028	0.27
766.2601318	0.80
767.4673462	1.56
771.1044312	1.74
772.0077515	0.56
775.1779175	0.11
776.6068726	0.89
777.5430298	0.21
778.4780884	0.26
779.3841553	0.50
779.9901123	0.11
781.4573364	0.13
794.3830566	0.06
796.7883301	0.06
806.7388306	0.13
814.3214111	0.22
817.5174561	0.27
819.2670898	0.14
826.5375366	0.49
831.6664429	0.47
840.8380737	0.67
844.5462646	1.10
845.5747681	1.03
852.1289062	0.50
855.9913940	0.15
859.7760010	0.15
866.4869995	0.84
869.1588745	0.13
877.5051880	0.10
880.1614380	0.15
885.3966675	0.78
886.0374146	0.08
888.4116821	0.28
890.3721313	0.09
891.0065918	1.04
894.4931641	0.55
895.7133789	0.27
896.6541138	0.69
908.5704956	0.40
909.8871460	4.80
910.7218628	0.30
912.0490112	0.11
912.7608032	0.06
913.9314575	1.51
917.0072632	0.07
918.2378540	0.53
922.8252563	0.31
927.2038574	0.30
935.3115845	0.22
936.0283203	0.44
936.7953491	0.34
942.2556152	59.60
943.5399780	1.75
944.3784790	0.21
945.5377808	0.09
947.5772095	0.19
949.5079956	0.23
951.6731567	0.09
955.6998901	0.76
957.1869507	0.12
958.9849243	0.12
959.8836060	0.88
961.4182129	0.72
963.9943237	0.11
967.1655884	0.67
970.1449585	0.06
971.1190796	0.62
973.2433472	0.25
975.9497070	100.00
977.5845337	1.41
978.8023071	2.31
979.7297974	0.22
981.6734009	0.25
983.2910156	0.30
985.8728027	0.32
989.0876465	0.39
990.5197754	4.90
996.2344360	0.07
997.7417603	0.56
999.2685547	0.52
1003.0614620	3.73
1007.3338010	8.10
1008.7294310	11.42
1009.3982540	1.63
1010.6192020	0.76
1013.1150510	0.17
1014.6857300	1.20
1019.1104130	0.20
1022.8606570	0.70
1026.7481690	0.31
1028.6469730	0.42
1031.3857420	0.09
1036.5571290	0.14
1039.0550540	0.41
1042.8105470	1.54
1043.6833500	0.47
1044.5217290	0.90
1053.7602540	0.07
1062.8491210	0.78
1077.7448730	0.97
1092.0303960	0.30
1093.0747070	0.20
1096.4316410	0.12
1126.8669430	0.24
1129.8212890	0.75
1142.4877930	0.90
1143.5030520	0.36
1145.6091310	0.11
1173.8054200	0.49
1192.0043950	0.48
1257.4171140	0.11
1269.6968990	0.14
1275.1468510	0.05
1315.3231200	0.10
1326.0743410	0.20
1399.3458250	0.36
1418.7639160	0.27
1442.7143550	0.16
1529.4166260	0.39
1543.0705570	0.24
1557.9630130	0.26
1638.2462160	0.20
1641.5286870	0.24
1837.0828860	0.26
1852.8092040	0.23
1951.0863040	0.15
1995.7325440	26.70
1997.5076900	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.0758
Annotation	Beta-Citryl-L-glutamic acid
Peak:m/z	Relative Intensity
101.8390350	0.09
129.9174652	100.00
130.8324738	0.04
146.9881592	0.20
148.2089844	0.05
149.9711914	0.03
174.9230804	0.12
176.0048218	0.09
192.0769958	0.11
193.0596924	0.97
232.1372375	0.03
250.1456909	0.06
255.9277954	0.02
258.0040894	0.05
262.8141479	0.01
266.2474976	0.01
267.7776489	0.08
273.8179016	0.02
275.3239136	0.06
275.9526062	0.14
277.1697388	0.06
284.9319763	0.40
285.9730835	1.89
287.0128174	1.58
302.9946289	4.21
304.0373840	9.69
305.0979919	1.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.0476
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
175.2308655	0.02
191.2074738	0.02
192.8169708	0.05
211.0344849	2.29
218.0313110	0.01
241.1327820	1.04
273.0644226	0.09
280.0490723	1.07
291.1384583	0.03
292.9350586	0.13
305.1625366	0.32
321.1135254	0.57
323.0515137	100.00
324.0176392	0.03
334.4495239	0.05
378.8292847	0.04
385.0475464	2.81
390.8853149	3.09
396.9213867	0.12
403.0842896	2.69
408.8568726	0.07
410.1710205	0.02
412.7708130	0.03
425.7255859	0.01
428.8510132	5.33
429.9074707	0.19
444.6077881	0.03
450.3047485	0.02
453.0617065	0.04
467.2028809	0.15
476.5989380	0.04
478.8372803	0.16
480.8687744	1.79
496.9569092	0.20
517.8451538	0.02
518.8279419	0.23
522.4091797	0.02
547.1549683	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	653.5323
Annotation	Petroformyne 4
Peak:m/z	Relative Intensity
187.4587708	0.63
200.9067993	0.84
214.9968109	0.68
223.3389282	0.74
232.7472992	1.49
240.2833252	0.50
247.2272339	0.75
251.457962	0.34
264.921936	1.69
285.7731018	1.05
297.2938843	0.40
305.5419006	0.86
323.5369263	0.80
327.5390625	1.58
329.0656738	0.29
343.4335327	0.33
361.3945923	1.01
363.8762817	0.33
369.3106079	2.27
371.3671875	0.89
383.347229	0.73
387.8812256	0.96
389.2047119	6.98
389.8195801	3.23
401.3626709	2.79
403.3754883	2.20
406.9104614	0.71
425.1906128	0.36
439.4076538	6.05
443.230896	2.86
453.0472412	1.16
461.1861572	0.30
469.378418	1.03
471.3955688	2.12
479.4036865	1.07
485.0247192	1.07
486.3026733	0.70
499.3618774	0.46
525.5893555	1.03
529.390564	1.88
553.5292358	1.33
575.5901489	0.33
595.5180664	0.93
598.3574829	2.74
599.725708	2.41
600.6418457	0.26
602.3983765	0.99
617.5587769	0.56
625.4085693	0.45
635.5194092	100.00
636.133606	2.43
637.2297363	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1145
Annotation	Lactulose
Peak:m/z	Relative Intensity
178.9190674	0.08
194.9505615	0.01
221.2601013	0.02
241.2217102	0.01
262.5870972	0.02
300.3329773	0.03
327.2787476	0.02
337.2865601	0.02
341.1610413	100.00
368.9808044	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
79.18315125	1.11
80.86758423	4.46
82.94172668	1.55
84.94181061	0.71
91.14923096	0.32
95.07171631	7.21
97.05368042	1.71
98.88656616	5.67
100.9118652	0.69
102.9947357	4.20
107.0419617	1.26
109.0007782	2.57
110.945694	1.74
112.8795776	1.04
118.719162	2.48
121.0288391	4.23
122.9766388	4.93
124.0755157	0.60
124.8062897	0.98
126.970993	6.64
128.9969482	14.04
130.2842712	1.06
131.2882996	0.74
133.0191498	5.66
135.0375061	3.83
136.128952	1.34
136.9928436	6.50
138.8495331	1.43
140.9563446	2.80
143.3338776	0.47
144.9349213	0.37
147.0404053	4.26
149.0255585	7.76
149.6554718	0.87
150.9566193	74.64
152.0141754	3.67
153.0035095	2.51
155.1054077	7.77
156.9917145	1.31
158.0469971	0.45
158.9807739	1.83
161.0551453	3.40
163.1281738	0.31
165.0343628	0.90
166.9279633	0.87
168.9937744	7.66
173.1039581	0.83
175.2029266	3.75
177.0821686	3.49
179.0963287	2.67
180.1330719	0.58
181.188797	2.20
182.9385834	2.01
185.0315399	0.44
187.4107361	0.57
189.008194	3.74
191.1698151	3.82
193.149704	4.62
194.2188721	0.43
195.1555023	3.71
197.0671234	11.00
199.3085175	0.77
203.3248138	0.65
205.9463043	0.91
207.0415192	4.81
209.3292694	5.43
210.1743317	2.02
211.2050323	14.21
212.0453644	2.41
217.0542755	16.85
223.02034	2.29
225.2362976	22.42
232.5475311	1.59
235.166214	72.68
236.0426025	2.06
238.0581055	12.08
239.3161469	4.67
253.0908661	100.00
254.2511597	24.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.19110107	0.12
104.8285065	0.24
106.986412	1.51
109.0010529	2.45
110.9179153	0.75
112.9853668	0.08
114.1479492	0.12
114.8501434	0.11
116.9227295	0.64
118.9604645	0.32
120.9519501	3.08
122.9995956	2.06
125.0112534	0.47
126.7291107	0.20
128.9510651	0.68
131.0588074	0.69
132.9110718	1.02
134.9941864	5.25
137.0791626	1.23
140.786026	0.25
143.0324402	0.78
145.0050964	0.34
147.0109253	2.13
148.9856262	2.67
151.0863342	0.68
153.0587463	0.23
155.1101685	0.44
157.08255	0.96
158.9947815	0.72
160.97995	2.05
163.0761414	1.83
165.0546875	0.53
166.7736969	0.06
168.9764099	1.07
170.9998169	0.78
171.9987793	0.06
172.9761353	0.88
175.1038971	0.33
177.2530518	1.00
181.2549438	0.04
183.0289917	0.80
183.8207397	0.07
185.0667267	0.32
187.0232849	1.58
189.1538391	0.59
191.1683044	0.26
193.0627136	0.81
195.1436462	0.19
197.1051025	0.81
198.8887634	0.72
201.0658722	0.74
203.1697235	0.42
205.0940552	1.07
207.1845093	0.05
207.9855957	0.10
209.2477417	0.31
211.0889282	0.72
211.8992615	0.21
213.0582275	0.39
215.0976868	0.35
217.1998291	1.21
218.9526978	0.19
220.317627	0.14
221.2376709	0.12
221.9472656	0.06
223.3084412	0.49
225.016449	0.98
227.1547546	0.25
227.9476013	0.10
229.1318359	0.95
231.242218	1.20
232.8917542	0.37
236.181366	0.24
239.0641479	0.28
241.047699	0.35
243.157074	0.23
245.0745239	1.43
247.27005	6.71
248.9953003	0.10
252.1722717	0.12
253.3744202	0.11
254.010376	0.16
255.0945435	0.32
257.1175537	0.35
259.1610718	1.28
260.3407898	0.27
263.2539062	0.21
265.3184204	0.16
269.2200928	0.68
270.3842163	0.14
271.3545532	0.26
273.3718262	0.13
274.0471802	0.07
277.4334412	0.24
279.4063416	0.18
280.1016235	0.07
281.3618164	0.09
281.9749146	0.04
283.2197876	0.27
285.2490234	0.91
287.2709045	0.53
294.7599792	0.48
295.5458984	0.33
297.3023376	0.55
298.0200806	0.11
299.3159485	1.50
300.8287964	0.09
303.0888977	0.04
305.2841797	5.31
306.1705627	0.16
307.0935669	0.24
311.1095581	0.39
313.2990112	0.54
314.9983215	0.12
318.2052307	0.21
320.6899414	0.33
323.2434692	100.00
324.10849	0.75
325.5155334	0.17
332.0402832	0.42
337.3305054	0.05
341.103363	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Lactulose
Peak:m/z	Relative Intensity
119.0953979	0.05
142.6205750	0.03
143.2458191	0.03
161.0643005	0.14
179.1107178	0.73
197.1283569	0.30
215.1160278	8.63
293.1055603	0.03
321.1611938	0.07
341.1261597	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2499
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.07093048	0.08
98.76133728	0.32
103.1299133	0.28
105.0340958	0.51
106.9577484	1.69
109.0551529	1.56
110.1467514	0.12
111.0497131	0.40
115.0271378	0.20
116.8909073	1.15
118.918396	0.35
121.0456543	4.69
123.0283737	1.40
124.9796295	0.59
128.921524	0.36
131.078125	1.68
132.9956512	0.39
135.0619049	4.22
137.057724	0.31
139.3174744	0.14
141.0880432	0.58
142.9777679	5.67
145.0444183	1.19
147.0563965	0.24
149.1003723	3.48
150.9154358	0.83
152.0342407	1.04
152.9887085	0.58
154.0432129	0.10
155.046051	1.26
157.0773926	0.77
159.0371704	4.68
160.0707092	0.16
160.8695374	0.46
163.1812744	0.61
165.1721802	1.12
166.0582886	0.32
167.0055695	0.84
169.0240021	5.79
170.2466125	0.20
171.1859436	0.20
173.0150757	13.41
174.9199829	1.97
177.0307007	0.13
179.2085266	0.40
180.8377991	0.15
182.144104	0.06
183.1373138	1.88
184.8856659	0.53
187.0712585	2.61
188.9545135	0.25
191.1500854	0.70
193.1045227	0.30
194.9662781	0.48
196.7567749	0.40
201.0456696	1.28
203.0540771	0.21
204.9825745	0.35
207.0091095	0.27
208.2064514	0.11
209.1032104	0.16
210.9077759	3.99
211.507782	0.03
213.1816711	0.13
215.1907959	0.72
215.9884949	0.55
217.3374939	0.30
221.2461548	0.10
223.2745972	1.78
225.2085876	0.35
226.3567505	0.25
227.4245911	0.85
228.0937195	1.49
229.1468201	5.12
230.1401978	0.42
230.9815063	0.13
232.3877869	0.66
233.2146301	0.76
233.9376831	0.21
237.1741333	0.24
239.1208801	0.61
241.4094543	0.04
243.2492981	0.87
245.2557373	3.60
247.2502747	10.98
248.1609802	0.52
249.0630798	0.49
251.1510315	1.44
253.1431885	0.07
255.2436523	0.51
256.1721191	0.33
257.0461426	0.31
259.2949829	0.48
261.076416	0.10
263.2371521	0.13
265.1285095	0.83
267.427124	0.62
269.7166138	0.41
271.300293	0.68
273.7048035	0.04
277.2615356	0.52
279.0542603	0.78
281.1512451	0.71
282.1026917	0.35
283.3467407	0.10
284.1644287	0.35
285.3809204	0.22
287.448761	0.44
288.0837708	0.06
295.2094116	2.40
296.8261719	0.16
297.4418945	0.37
299.3300171	1.90
300.2798767	0.22
300.9165344	0.10
303.0597534	0.12
305.2717285	4.00
306.0730896	0.44
313.3481445	1.04
316.5848389	0.13
323.2378845	100.00
324.0736084	0.33
325.3298645	0.10
326.2267456	0.14
329.3607788	0.14
332.8327026	0.70
337.302124	0.24
341.4125061	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.1753
Annotation	Dorsmanin F
Peak:m/z	Relative Intensity
128.0439911	0.22
128.9657745	0.14
129.8655396	0.35
131.0112610	0.11
142.9393005	0.38
146.0975342	21.47
147.1190186	0.87
149.0796814	0.10
158.9746094	0.24
161.0611115	0.69
183.0511322	0.10
191.2800293	0.20
199.2559509	0.05
201.3806610	0.06
205.6843567	0.09
211.4284668	0.10
217.1668243	5.40
226.2645416	0.29
229.2491302	0.15
234.9808044	0.42
241.1618958	0.16
243.2374878	0.19
253.1379395	0.27
259.1694946	1.46
260.2438354	0.09
262.1872864	0.15
263.1828918	1.12
277.2200012	20.76
279.1353760	0.05
290.2014160	3.18
300.1028137	0.11
301.3098450	0.12
308.1966553	100.00
309.1896973	0.18
310.4187012	0.05
319.9125977	0.15
324.2068787	0.52
334.1172791	0.15
343.0729675	0.11
349.0001221	0.08
353.2334595	0.18
357.1797485	0.05
359.3660278	0.09
361.5509033	1.14
362.2792358	11.06
373.2608032	0.06
377.1215515	0.12
379.2080688	84.34
393.3490295	0.37
396.9577332	0.05
403.0198669	0.11
405.2990417	2.98
421.1426086	0.79
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.184
Annotation	Unknow
Peak:m/z	Relative Intensity
130.0480957	0.03
136.0921936	0.04
139.1273499	0.02
151.0637207	0.03
167.1357727	0.04
179.1457825	0.07
180.4363708	0.04
181.0518494	0.08
186.9666290	0.03
201.4658508	0.03
205.1136780	0.05
217.3747559	0.01
218.2349854	0.03
218.9897766	0.04
235.1331177	0.62
236.3258972	0.52
237.2373352	0.08
237.9995728	0.02
242.9531555	0.48
244.1354675	0.04
246.0941467	0.03
259.1555176	0.12
267.2712402	0.02
275.3259888	0.01
279.3065796	0.05
282.9603577	0.07
284.0086365	0.14
285.4975891	0.02
287.1951294	0.07
302.2501526	0.01
308.1713257	0.39
309.0889893	0.68
310.1031494	0.35
314.8637695	0.09
323.9365845	0.02
333.6887512	0.03
335.2160950	0.01
338.3019714	0.01
339.0429382	0.02
342.3748779	0.16
347.0804443	0.72
348.2169189	0.27
353.4064941	0.07
357.2618713	0.04
364.2289124	0.42
365.1197815	0.86
366.2793884	0.38
369.2554626	0.08
370.1289062	0.06
371.9232788	0.03
376.1269226	0.10
377.3764038	0.04
378.5235596	0.15
380.8097839	7.75
384.0962219	0.26
385.2066345	15.66
386.5762329	0.09
387.2338867	0.03
388.2826843	0.05
389.0628052	0.02
391.0350037	0.16
395.1210632	0.03
396.0551453	0.03
397.2220764	0.03
398.8907776	0.11
399.5151978	0.06
400.3965149	0.08
402.9083557	0.46
404.7226257	0.39
421.1041565	0.23
421.7404175	0.23
427.1864319	1.20
459.1318970	0.07
464.1892700	2.75
465.0138245	0.02
470.2961121	17.51
471.4486694	0.03
472.7832642	0.01
479.0449524	0.03
483.7471008	0.19
490.8918762	0.01
496.0418091	0.63
501.0861206	2.11
501.9310913	0.61
507.3441467	22.76
508.7372437	0.26
511.8946228	0.07
513.2786865	100.00
514.8412476	0.50
516.1114502	0.50
516.7715454	0.08
519.6867676	0.17
520.6356812	0.10
533.4495239	0.09
543.2427368	0.02
545.4577637	0.03
551.9332886	0.11
565.2881470	0.02
569.1671753	0.02
571.2459106	0.06
575.5274048	0.02
607.4697876	0.04
608.4788818	0.01
621.8858032	0.12
624.2879028	0.06
629.9871216	0.08
631.1345825	0.05
656.3103638	0.01
678.4425659	0.03
680.3644409	0.07
686.7188721	0.39
687.4559937	0.01
692.4397583	0.05
693.3208618	0.03
708.7388306	0.03
763.8020630	0.02
799.3552246	0.01
801.2510376	0.05
809.4607544	0.01
819.2568970	0.04
835.3823242	0.02
922.5636597	0.01
950.9791870	0.02
967.6596069	0.07
974.3704224	0.10
984.1375122	0.04
1060.4591060	0.03
1088.6563720	0.01
1103.2084960	0.01
1539.7648930	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	478.2942
Annotation	PE(18:1(9Z)/0:0)
Peak:m/z	Relative Intensity
140.0230408	0.11
162.9542847	0.12
196.0837402	1.55
214.0515747	0.44
239.8947754	0.08
243.0877838	0.04
254.2189636	0.14
281.2559509	100.00
288.0780334	0.11
310.2090454	0.10
388.2807007	0.17
393.1152954	0.08
414.4110413	0.20
417.2539978	0.39
417.8702393	0.18
420.2789307	0.06
434.6287537	0.20
440.274292	0.08
454.8483887	0.06
459.9847717	1.02
461.1297913	0.22
463.4479675	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
99.0262375	0.19
100.9846802	5.94
106.9232788	0.13
112.9225006	19.00
114.9140625	0.59
116.8065338	0.10
118.9002838	15.85
124.9594727	3.05
130.9862671	5.36
142.9684296	18.47
148.9335022	2.99
160.9434814	19.41
179.0111542	100.00
190.9764709	0.53
221.0207825	0.56
223.2402344	0.24
250.8515015	0.35
280.1967468	0.09
280.9184875	1.87
294.9074707	0.16
305.4198608	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.18
Annotation	Tanzawaic acid E
Peak:m/z	Relative Intensity
92.93423462	0.04
101.0808182	0.07
111.1585846	0.05
125.1268997	0.08
156.8356018	0.05
160.9410095	0.17
163.0025787	0.04
175.1210327	0.06
181.2020264	0.04
187.1732788	0.06
199.1405029	0.13
209.4551697	0.06
212.4761963	0.10
225.108551	0.22
227.0839844	0.40
229.2085876	0.24
235.3208008	0.08
242.8819885	0.26
244.020752	0.12
245.1639099	0.56
248.6185913	0.83
251.0335999	0.07
253.2585754	0.23
255.2059631	0.16
261.4088135	0.20
268.9796143	0.12
271.1762695	100.00
273.1633606	3.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	304.91
Annotation	Unknow
Peak:m/z	Relative Intensity
87.0039673	0.04
112.7647247	0.09
114.9039459	0.24
130.9740295	4.79
143.1226807	0.13
146.8084717	0.67
158.9621582	1.66
160.9295044	0.16
162.6806030	0.19
174.8910675	100.00
176.1467743	0.06
179.0931702	0.03
190.9929962	0.09
215.8953857	0.11
230.9358826	0.61
231.8577271	0.10
232.8057861	0.05
248.7628174	0.40
259.1181946	0.77
260.8453369	11.78
275.0800476	0.17
276.9509277	1.80
277.7388916	0.14
287.0875244	0.26
304.9819336	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2915
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
144.2603760	0.03
148.9668274	0.03
188.7767639	0.04
197.1131592	0.04
198.1012878	0.02
200.2268982	0.16
201.2427368	0.03
215.1245117	0.03
235.1899414	0.09
242.6797485	0.11
245.3540497	0.05
253.4598694	0.13
263.0970154	0.07
285.2874756	0.14
306.4160156	0.37
307.1876831	0.04
315.3870544	0.08
324.3285217	0.04
337.2889404	100.00
337.9243164	0.09
367.7883911	0.04
380.4903259	0.02
387.0753479	0.15
388.9349060	0.07
394.9668274	0.02
405.4429016	0.18
411.3746948	0.09
416.5531311	0.05
417.3654480	0.02
419.3141174	0.03
426.0769043	0.09
431.3401184	0.23
432.2136536	0.15
434.0138245	0.03
435.0538330	0.04
446.8438721	0.03
460.2163086	5.10
461.1841736	0.15
478.9949646	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	174.09
Annotation	O-(L-Norvalyl-5)isourea
Peak:m/z	Relative Intensity
86.0896378	0.01
102.0538635	0.01
113.2461395	0.02
130.9944763	100.00
132.0099792	0.06
155.7513885	0.11
157.0551605	2.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	568.5471
Annotation	Unknow
Peak:m/z	Relative Intensity
169.0120544	0.11
191.3088531	0.07
195.8370667	0.09
198.2233582	0.17
213.1475372	0.05
217.1004028	0.17
221.0117798	0.05
227.0098114	0.04
236.7847595	0.07
238.9868469	0.07
243.1400452	0.16
249.2224884	0.36
251.1430511	0.23
253.2838440	0.19
259.2634583	0.12
270.9050903	0.06
272.0248108	0.03
279.0576782	0.13
281.3793945	0.15
286.7561646	0.13
292.0565796	0.16
295.2541504	1.79
296.1062927	0.35
298.3685913	0.06
299.3109131	0.11
307.1439209	0.04
309.2358398	0.34
311.5835571	0.68
312.3444214	1.42
313.2351685	2.09
314.3223877	3.18
315.3582153	0.45
316.0992432	0.14
316.9586792	0.09
322.6127319	0.09
329.1869507	0.24
330.3004761	13.38
331.2330933	1.23
332.2753296	0.51
351.4268188	0.12
353.5908203	0.12
354.4451294	0.24
355.3355103	0.11
362.4095459	0.05
364.4678955	0.03
373.0367432	0.08
377.0810547	0.03
379.1300049	0.06
380.3063965	0.27
405.2318115	0.10
411.5049438	0.05
417.1115723	0.06
429.5032349	0.04
435.0871582	0.08
437.6544189	0.18
438.3746338	0.10
442.5029907	0.24
445.5601196	0.13
449.2517090	0.07
455.2630615	0.14
461.4633789	0.18
464.3761597	0.06
467.3952026	0.21
479.4608765	0.13
481.2567749	0.13
483.2913208	0.10
484.5443726	0.04
493.0563965	0.10
494.3815308	0.21
497.0825806	0.23
498.0494385	0.26
501.2354126	0.61
502.8257446	0.22
505.0440063	0.05
509.2299194	0.04
514.0559692	0.07
519.1600952	0.38
523.3821411	0.83
530.2484741	0.28
532.3250732	0.35
533.4336548	0.37
534.7484741	0.39
535.5414429	0.10
536.6195679	0.17
537.3455200	0.29
538.2258911	0.05
550.6154175	100.00
551.5916748	22.49
552.6421509	1.26
553.5586548	0.33
559.0742188	0.11
567.6690674	0.12
568.6723633	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	403.1609
Annotation	6-Deoxylamioside
Peak:m/z	Relative Intensity
137.0879517	0.76
141.2668457	0.43
146.8770905	0.55
158.9138794	0.73
161.1682129	1.46
181.3518982	1.04
186.7926636	0.31
194.9064941	0.36
197.0429688	13.66
223.119751	1.63
233.4500732	0.67
241.1051636	100.00
246.9772339	0.77
261.1642456	0.41
266.4054565	0.74
281.2753906	0.26
283.0827026	1.65
299.2193909	0.39
305.1078186	0.36
307.0415344	2.22
313.1443787	2.41
331.6570435	1.32
336.1942749	1.23
343.1903687	2.02
349.2201538	0.62
357.2608032	5.11
358.2217712	0.72
359.9792786	0.52
361.2586975	2.68
365.4905701	1.42
366.1263733	1.19
367.0932922	1.15
373.6695251	1.90
380.6970825	0.70
382.7452698	1.76
385.061554	6.82
386.1991882	2.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
100.0466003	0.11
102.1946259	0.12
102.9063416	0.03
105.0818634	0.06
106.9848022	1.68
109.0449524	1.25
111.0673218	0.15
113.07164	0.13
114.8632507	0.05
117.0347061	0.67
119.3469086	0.06
121.0808716	2.70
123.0624008	1.07
125.1086426	0.11
127.7974243	0.07
129.0254822	0.41
130.9223633	0.56
132.9228363	0.65
134.9747467	3.16
137.0396729	0.40
138.9332428	0.06
141.0158234	0.23
142.9986267	2.97
145.0202942	0.55
146.7722778	0.61
149.0860291	1.24
151.0862427	0.57
152.8946838	0.13
155.0000916	0.13
156.98703	1.29
158.0462341	0.19
159.00177	1.14
161.0541382	0.52
163.1193848	0.75
164.9555969	0.40
167.105835	0.48
169.0718994	2.46
170.9359741	0.24
172.9244537	3.12
174.2604218	0.10
175.0890503	0.38
177.1213074	0.41
179.0766144	0.25
180.4086761	0.09
181.1534271	0.29
183.0249481	1.75
185.1208801	0.04
187.0113525	4.47
188.9937897	0.49
191.1334686	0.90
193.1585541	0.40
195.4357758	0.04
197.1436462	0.76
199.2642365	0.10
201.1706543	0.44
205.0270081	0.58
206.4172516	0.05
207.4525452	0.04
209.1740112	0.21
210.3435059	0.27
211.0282898	1.13
213.1686707	0.10
215.0878296	0.23
217.2170715	0.33
219.1827087	0.12
221.1547241	0.16
223.1966858	1.20
225.3919373	0.09
227.1497192	0.31
228.1651611	0.21
229.1083374	1.37
229.7165833	0.07
231.4238281	0.03
234.243988	0.08
237.4393616	0.11
239.4107361	0.17
241.1598816	0.35
243.1905823	0.65
245.1383057	0.93
247.2698669	4.62
248.1506042	0.04
251.1993408	0.27
255.2796936	0.12
256.2860107	0.03
257.2130127	1.14
259.2110596	0.15
260.9189758	0.08
268.9158325	0.21
271.2845154	0.23
273.1934814	0.14
274.9164429	0.27
277.2407227	0.53
278.4397583	0.10
279.2761536	0.28
281.233429	0.50
283.293335	0.20
285.2453308	0.95
286.2563171	0.12
287.2540588	1.05
288.2025146	0.04
292.3191223	0.15
293.0317993	0.12
294.0049133	0.02
295.1992188	1.87
296.2117615	0.64
299.2200623	1.22
300.0800476	0.29
300.8158264	0.05
303.247467	0.15
305.1817322	3.42
306.1292725	0.06
307.41922	0.07
313.133728	0.77
315.0733032	0.20
323.2389526	100.00
323.9361572	0.88
325.6732788	0.19
328.7947998	0.22
341.1603699	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
99.01013947	0.35
103.036377	0.07
105.0599899	0.15
106.8007965	0.76
109.000473	0.94
111.0413895	0.36
112.908493	0.10
121.0115356	2.42
123.0247421	1.69
125.045517	0.13
126.9562073	0.14
129.1269684	0.08
130.8026123	0.17
133.0894775	1.54
135.0864258	2.64
136.9529114	0.44
138.9572449	0.44
140.9004517	0.08
143.085144	0.99
145.2582092	0.13
146.9287109	1.70
149.1469421	1.51
150.9825439	0.51
151.770874	0.35
153.0959473	0.23
153.8681946	0.11
154.9138641	0.16
157.1543884	1.76
159.0870361	0.67
161.0767517	1.14
163.1043701	0.47
165.0712891	0.65
167.2326965	0.36
168.9577179	1.08
171.275528	0.11
171.9980774	0.20
173.0762024	1.07
175.0939484	1.00
177.0345764	0.89
179.2229309	0.18
180.8345947	0.12
183.0273285	0.98
185.2544098	0.44
187.0686951	0.99
189.0039215	0.18
191.1051941	0.98
192.0570374	0.23
193.1482086	0.49
195.3373413	0.11
197.088562	0.78
203.0374756	0.42
205.2182922	0.89
207.0909882	0.47
208.9960327	0.91
209.7460938	0.15
211.1044006	0.54
213.1279602	0.95
215.1965637	0.42
217.0243835	1.05
221.256012	0.53
222.0944824	0.17
223.2365723	0.58
225.0080261	0.41
227.1682739	0.46
228.077301	0.35
228.9969177	0.46
231.1829834	1.16
233.0501709	0.38
235.2401428	0.18
236.9736023	0.09
239.1995239	0.17
241.1428223	1.23
242.9442139	0.23
245.0921631	0.56
246.1853027	0.13
247.3119202	5.85
248.2644043	0.35
249.211731	0.51
251.2513733	0.09
253.0692139	1.09
254.0244751	0.11
255.244812	0.36
257.2799072	0.05
259.2221069	0.37
260.2336426	0.20
261.4441833	0.23
263.1013794	0.10
265.2762756	0.39
267.0915527	0.72
269.3757935	0.05
271.2321472	0.11
277.2647095	0.10
278.9144897	0.20
281.2615356	0.11
281.9911499	0.97
283.3823547	0.74
285.2601318	0.28
287.203186	0.68
295.0933838	0.86
297.2887268	1.04
299.2264404	2.16
300.0957947	0.49
303.5166626	0.08
305.3572998	2.49
306.1583252	0.19
309.354187	0.39
310.5483704	0.08
312.966095	0.19
313.5701599	0.38
320.4199829	0.40
323.2415161	100.00
324.4668579	0.12
332.548645	0.07
341.1580811	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.77988434	0.42
78.87662506	0.68
80.95029449	2.78
83.04341125	0.37
84.97129059	0.15
90.86869812	0.16
93.05735779	0.65
95.09564209	2.40
97.03648376	1.78
98.91311646	0.42
103.0518646	3.93
104.9528809	1.27
107.0164337	0.44
108.7996368	0.72
110.8045502	1.34
115.1112213	0.17
118.868866	0.47
121.0779419	1.42
123.0228729	1.53
124.9203339	1.52
126.9929962	2.68
128.8808289	9.66
130.1426086	0.51
132.9918976	0.96
135.0322266	2.30
136.8771515	0.92
139.317749	0.50
141.0330658	2.25
142.8683624	0.44
144.9650726	0.28
146.9959564	1.12
147.8426819	0.58
149.0021515	1.65
151.0053864	67.97
152.0258484	3.05
154.0253601	0.77
155.0044708	2.08
161.2332458	2.39
163.0744629	0.41
164.9464569	0.92
166.515152	2.25
167.211319	3.52
167.9982452	1.15
169.0326385	2.53
170.1284637	0.15
171.0128632	1.71
175.1169739	1.45
176.1944427	0.16
177.1883087	2.51
177.9621887	0.82
179.0298767	3.59
180.0988922	0.76
181.0441132	1.71
182.0954437	1.27
183.0635376	1.03
185.0766602	1.56
186.0704346	0.29
190.3660278	0.32
191.2641144	0.31
193.2227936	2.84
194.0395355	0.95
195.0852203	3.67
197.0907135	3.91
198.3710938	0.39
199.1551514	1.96
201.2833252	0.38
205.1209564	0.46
207.1121063	3.14
208.8780365	0.15
211.0827637	5.79
212.0118256	0.95
217.2537384	14.01
222.9816437	0.22
225.0688934	11.30
225.8091278	0.89
235.1229858	36.71
236.0317841	0.39
238.1542969	11.44
239.1420288	1.67
244.2994232	1.32
251.0200195	1.37
253.0835724	100.00
254.2416229	21.09
260.7199097	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	2'-Methoxyflavone
Peak:m/z	Relative Intensity
74.7791748	0.20
77.01869202	0.21
79.9630127	0.13
80.88816833	2.59
82.78703308	1.61
86.99599457	0.51
91.00403595	0.78
93.05417633	1.44
95.05889893	3.59
96.99449921	0.98
98.80815125	0.76
102.8618927	0.16
105.0482788	0.51
106.3789062	0.18
106.9998474	0.23
108.7601776	0.95
109.3716583	0.14
110.9197998	1.27
112.9202881	0.80
114.999527	0.59
116.5761108	0.26
118.1021729	0.30
118.9404602	1.23
119.9828796	0.68
120.9585571	2.03
123.0003815	3.40
125.1096954	2.14
126.991394	1.77
128.9888	10.75
129.9851532	1.62
132.8771057	1.16
135.1300201	1.04
135.7682037	0.17
137.0029755	1.83
139.017868	1.98
140.5926208	0.55
143.065033	0.33
145.0799408	0.92
147.2118073	0.82
149.0751343	1.24
150.8865967	67.69
151.817337	1.44
153.0545959	0.48
154.1587524	1.67
155.0145416	1.65
157.1219025	0.83
161.1017609	1.43
163.0783997	1.13
165.138382	2.04
165.9834595	0.59
167.067215	2.00
169.0233307	1.07
170.4163055	0.46
171.1985321	1.12
173.0691986	0.89
175.1713562	3.14
177.090332	1.78
178.2775726	0.30
179.4516754	0.37
180.3201752	1.00
181.1634827	0.59
181.9781189	1.66
182.8697662	0.89
185.0075531	1.86
188.972702	3.21
191.0922699	0.75
193.1707306	1.72
195.0946808	2.63
197.0830231	6.30
198.4126129	0.57
199.1783295	1.57
203.1923218	0.47
205.1490936	0.66
207.1376495	5.17
208.3308868	0.31
209.3535919	3.26
211.0414276	3.80
211.94487	2.19
217.191391	12.74
218.2718964	0.15
220.1739807	0.31
222.8018799	0.68
224.0473785	0.54
225.1871796	12.21
226.0875244	0.50
232.3188629	0.98
235.1904755	44.50
238.1003265	8.70
239.1033325	1.96
244.1605072	0.55
251.1310883	0.70
253.0761871	100.00
254.1833344	14.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.0842
Annotation	Unknow
Peak:m/z	Relative Intensity
101.9661942	0.18
103.9772644	1.62
104.9881363	0.14
105.8964996	0.04
114.9475403	0.08
131.0653076	0.05
131.8386688	0.11
132.8770752	11.28
144.9760132	0.03
147.8140564	0.15
149.9103699	100.00
151.0288391	0.02
152.1767273	0.03
156.9154205	0.03
162.9563293	0.16
164.0670166	0.10
175.1731873	0.12
178.9254608	0.05
179.9337769	0.06
184.9939270	0.07
193.0301208	0.22
195.3629761	0.04
203.2022400	0.07
204.1622620	0.06
209.0640869	0.08
213.0043640	0.21
220.7224426	0.09
240.3490601	0.04
245.7148438	0.08
249.2346497	0.07
251.7313538	0.03
252.9680786	0.11
254.9581604	0.09
257.0386353	0.17
262.8763428	0.02
269.6568298	0.08
277.3645020	0.03
282.1153259	0.08
284.2268372	0.08
289.1308594	0.04
294.2800293	0.04
295.9692078	0.04
297.0932312	0.03
298.1905518	0.05
300.9898682	0.10
306.3208923	0.04
307.1147461	0.10
310.6039429	0.04
312.2839355	0.07
314.2368774	0.07
323.2493286	0.13
324.2787170	0.32
324.8980103	0.40
332.8799438	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	290.85
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.8008957	2.35
129.1294250	0.01
177.1816711	0.03
206.8038940	100.00
207.5992126	0.04
221.0228882	0.02
221.9686890	0.02
223.0155640	2.55
229.4982605	0.06
239.0992737	0.04
245.1809692	0.02
246.8052063	0.08
272.9192505	0.04
281.6562500	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.8807831	0.44
106.9908905	1.17
108.9442291	2.32
111.0116196	0.26
112.8012085	0.17
114.5679626	0.06
116.9186859	1.19
119.1097641	0.08
121.0214539	4.67
122.9658813	1.68
124.9506226	0.57
125.8347778	0.11
128.9544678	0.06
131.0794373	0.56
133.1020355	0.69
134.0207672	0.37
135.1059265	4.83
137.0784302	0.52
141.0244904	0.08
143.0451355	1.80
145.0536499	0.13
147.0016785	1.13
149.0124207	2.64
151.1154938	1.11
153.0174866	0.11
155.0659637	0.17
155.9472351	0.07
157.0089569	1.68
158.9947052	1.04
161.0977173	1.25
162.9192505	1.20
164.9837952	0.98
167.0214081	0.28
168.9562836	1.83
171.1508484	0.61
173.045105	1.62
175.2030792	1.41
176.9444427	0.70
178.8914185	0.59
181.1651917	0.23
182.9981995	0.77
185.205307	0.43
187.0265198	2.22
189.1045685	1.08
190.9317322	0.14
193.1809692	0.57
195.3534241	0.66
197.0636749	0.26
198.1835938	0.13
201.1691895	0.37
203.0886993	1.42
204.0839844	0.07
205.1854401	0.65
207.0684814	0.25
209.2294006	0.38
211.176178	0.71
213.1451721	0.53
215.1546936	0.62
217.058075	1.73
219.0143738	0.14
222.682251	0.08
223.3097839	0.51
225.0076904	0.49
225.9507751	0.16
229.1480408	0.55
231.1481018	2.18
235.3471375	0.17
237.8824768	0.09
239.1361084	0.09
241.2385864	1.21
243.1984253	0.41
244.559906	0.51
245.2928162	2.11
247.3021545	5.48
249.3425293	0.10
251.0976257	0.39
253.234375	0.36
254.762085	0.18
257.2042542	0.20
259.2078857	0.99
261.5670776	0.12
263.5231628	0.09
264.1401978	0.09
265.212677	0.15
265.9066467	0.24
267.1048584	0.43
269.4214478	0.15
271.1812134	0.11
273.4164124	0.18
276.9820557	0.37
279.2584229	0.13
281.04776	0.07
281.8974915	0.22
282.967041	0.32
285.0233765	0.25
286.8067017	0.06
293.8106079	0.21
294.7818604	0.13
295.4122009	1.13
297.1557007	0.93
298.2866211	0.23
299.2081299	2.83
299.9508667	1.14
300.7615662	0.12
303.3774109	0.07
305.1291199	3.83
306.0394592	0.37
313.3614502	1.22
317.6251831	0.24
321.3815918	0.19
323.2314758	100.00
324.2247314	0.23
326.2388611	0.23
332.4121704	0.24
341.328064	0.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.1604
Annotation	Triptriolide
Peak:m/z	Relative Intensity
109.2208557	0.02
130.9835663	0.05
136.8741455	0.04
178.9650726	0.02
201.2301178	0.05
201.9518738	0.05
215.3587036	0.02
263.0010681	0.07
263.9265137	0.04
269.1520386	0.05
281.1353760	0.07
283.4102478	0.06
287.1436157	0.12
291.2272949	0.13
323.3721924	0.16
331.0823669	0.12
333.1101990	0.61
336.3434753	0.02
338.7624817	0.03
341.1970215	0.75
343.1928406	0.04
349.0942078	0.11
359.2092590	100.00
368.3448181	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.875
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0670166	0.08
174.8735657	1.00
198.8979187	0.17
214.9732056	0.06
217.0737457	0.08
244.9170380	0.16
273.0102539	1.20
287.2712402	0.02
288.9714966	13.10
304.9922485	5.65
387.0119629	0.05
388.2453613	0.34
392.2587280	0.15
402.9160767	7.51
403.6188965	0.02
417.1126099	0.10
418.8428345	100.00
458.9831543	0.22
460.6217041	0.03
485.6652222	0.03
486.9033813	0.27
488.3472290	0.03
515.0607910	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.9546051	0.72
78.95307922	1.17
80.87936401	2.37
82.70094299	0.30
84.91230011	1.13
92.98023224	1.34
95.02761841	3.80
96.88735962	0.44
102.9830322	1.34
104.4449463	0.61
105.0521851	1.73
106.9210052	0.28
109.1424103	2.08
111.1377106	1.12
113.02742	1.49
114.6491089	0.19
117.0892487	0.30
118.8856812	1.41
120.9257355	2.25
122.9448242	1.68
124.7991333	0.59
126.8196564	2.37
128.9711914	4.78
129.9068604	0.23
131.0930481	0.32
133.0566254	2.56
135.0222778	3.89
137.0426636	1.03
138.8865204	0.69
141.146286	0.28
143.2041473	0.20
145.0049591	0.74
146.9794312	2.30
149.1160431	0.52
151.0068054	72.17
151.9467316	6.74
153.0472565	2.27
154.9239044	2.08
157.0276794	0.35
159.2457733	1.21
160.9612579	1.33
163.2000275	0.52
165.1397095	1.95
166.0225677	0.28
166.966156	2.09
167.898819	0.20
168.9226074	5.28
173.0050507	0.54
174.9027252	4.51
177.0040131	1.45
179.0583801	3.13
180.3043671	0.19
182.9699249	0.24
185.0730286	1.75
187.1740875	0.45
187.7915955	0.32
189.0938263	1.54
189.8768158	0.53
191.6641388	0.46
193.1655426	2.03
194.1479645	1.05
195.0712738	4.50
197.03508	4.38
199.011795	0.52
205.2980499	0.80
207.0391998	3.91
209.2261963	0.92
210.1707306	0.34
211.0365143	1.92
211.9663696	1.12
217.1694794	13.33
222.7467957	0.46
225.1799927	15.64
226.1935577	0.31
235.046463	32.77
238.1186676	15.15
244.1009979	0.47
253.0853424	100.00
254.1147003	19.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2497
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.94329071	0.05
102.9670563	0.04
104.8361969	0.06
106.9458847	0.82
109.0662537	2.05
111.0211945	0.44
112.7598877	0.07
116.9046631	0.14
118.393837	0.04
119.1068573	0.10
121.0499268	2.86
123.0816727	1.14
124.9765396	0.16
129.0626221	0.24
129.9813385	0.06
131.0472107	0.31
133.0081787	0.75
134.9674988	3.47
135.5918121	0.02
137.0278168	0.46
139.0575867	0.09
141.1510315	0.12
143.0446472	0.69
144.9629211	0.11
147.0159607	3.17
149.0962524	2.03
151.0696106	0.54
153.3414307	0.06
154.8609619	0.04
157.1178589	0.62
157.8825989	0.03
158.9724731	0.30
161.038147	3.04
163.0773621	0.85
165.1168518	0.42
166.9930878	0.08
169.0549316	0.60
171.0211334	0.24
172.0216675	0.04
173.0720673	0.66
175.0667267	2.05
177.1297607	0.18
179.1547241	0.05
180.2402954	0.04
181.1676178	0.02
183.1532288	0.50
185.1549988	0.03
187.0909271	0.61
188.9569855	1.28
190.4128418	0.02
191.0791626	0.25
193.2197876	0.05
194.9055328	0.03
196.9628601	0.21
199.0149841	0.12
201.0327301	0.37
203.084137	0.80
205.0672913	0.63
206.7294006	0.03
208.8710022	0.02
210.5160217	0.02
211.1630859	0.51
213.0232239	0.22
215.0493774	0.41
217.1867676	1.00
218.0811157	0.04
219.1937256	0.26
221.0091858	0.14
223.2140503	0.23
225.1690674	0.20
227.2067566	0.35
228.321167	0.07
229.1953735	0.17
231.1251221	1.09
232.2048645	0.02
233.1125183	0.07
235.4335938	0.04
237.2276917	0.06
238.1054993	0.06
239.2330017	0.16
241.2257385	0.12
243.167572	0.08
245.2362366	1.32
247.3182373	5.87
249.2503357	0.14
251.2166748	0.06
253.1746216	0.18
255.1204224	0.04
255.9129028	0.06
257.2962036	0.10
259.1269531	0.34
264.3191528	0.08
265.1116943	0.05
266.3414307	0.05
267.0898743	0.11
269.4348755	0.19
271.1973267	0.29
273.2649841	0.05
275.2055664	0.04
277.147522	0.22
279.4454956	0.06
280.2825317	0.04
281.2758179	0.24
283.0914612	0.04
285.1846313	0.87
286.2597961	0.01
287.3674927	0.23
289.0708618	0.14
291.2258606	0.03
295.2586975	0.42
296.1376953	0.03
297.1070251	0.04
299.1847534	1.34
300.0913696	0.07
305.3228149	1.83
307.2734985	0.03
310.4588013	0.08
311.378418	0.05
313.2574463	0.12
321.3461304	0.05
323.2424011	100.00
323.8442993	0.49
324.7608643	0.04
325.3999634	0.06
331.5299988	0.14
341.0596924	0.80
341.7886658	0.02
343.2640686	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	678.7
Annotation	Unknow
Peak:m/z	Relative Intensity
191.0232544	0.06
206.7611694	0.52
231.8685303	0.04
232.9454956	0.06
250.9569855	0.12
274.2904053	0.40
274.9561768	1.43
279.0076904	0.07
290.8229370	3.35
300.0076294	0.08
340.0867920	0.15
342.5793457	1.17
347.1236572	0.15
354.8715210	0.16
358.7186279	4.59
362.1910400	0.28
374.9354858	1.13
380.2175293	0.15
381.8468628	0.06
386.6970825	0.25
400.1380615	0.07
402.8112183	0.09
418.2849121	0.71
419.1307983	0.08
426.7402954	9.34
427.4224243	0.05
439.9769897	0.03
442.5368042	23.19
443.2575684	0.03
458.5314941	3.72
466.2226562	0.10
470.3945923	0.39
480.0174561	0.21
483.1249390	0.09
486.8350830	0.20
488.7605591	0.29
494.4266357	0.07
496.8547974	0.10
502.9398193	0.14
504.2947388	0.19
505.0135498	0.47
510.6418457	56.70
512.7033081	2.71
516.1899414	0.05
517.2422485	0.09
523.1704712	0.93
526.5636597	100.00
527.2914429	0.40
541.2643433	0.31
542.5433960	11.48
543.2620239	0.12
547.8311157	0.16
548.7863159	0.83
550.0638428	0.13
558.6795654	0.06
572.5535278	17.70
588.2015991	0.13
591.9312134	0.94
592.7639771	0.21
594.0189819	19.97
594.6489868	73.64
595.7683716	0.05
602.7507935	0.16
610.4744263	3.01
611.2448120	0.43
614.7219849	0.79
618.5719604	0.21
625.0891724	0.10
631.9708862	3.46
632.8822021	17.56
633.5932007	0.17
636.7073364	0.16
655.0864258	0.20
660.1874390	1.82
661.2273560	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	797.3079
Annotation	Unknow
Peak:m/z	Relative Intensity
293.2684937	0.77
294.1925659	0.16
351.1843262	0.05
366.5776367	0.04
406.1986084	0.08
503.2792969	0.08
504.3364868	0.18
557.2351074	0.07
578.1028442	0.09
592.2290649	0.87
618.1417236	0.04
627.3253784	0.04
633.4813232	0.32
634.0848999	0.05
641.0482178	0.11
648.9015503	0.03
652.3819580	0.16
654.0672607	0.06
678.1473389	0.05
683.3644409	0.04
694.1660156	0.33
708.0773315	0.04
711.3153076	0.12
712.1562500	0.28
754.2633057	100.00
754.9479980	0.40
756.5732422	0.05
764.3321533	0.04
766.7006836	0.04
776.7943115	0.80
779.1168823	0.10
780.1760254	0.73
781.1134033	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	271.228
Annotation	16-Hydroxypalmitate
Peak:m/z	Relative Intensity
92.76451111	1.70
112.8184814	1.20
125.2245941	0.97
127.0901642	0.76
132.012619	1.23
139.2080994	0.86
177.0115051	0.81
181.2015533	2.43
183.247467	0.75
187.3579102	2.02
197.3707428	5.04
199.2069855	0.91
206.8604279	0.71
209.2542572	6.67
211.3486786	3.82
213.1567688	3.57
225.2952423	45.67
226.3594055	4.23
227.2392578	11.70
228.1257172	1.69
228.9499207	0.97
235.0677948	20.29
236.9972076	1.59
243.4221802	0.87
251.2278442	5.10
253.2109528	100.00
254.0287933	2.69
255.0983887	8.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
93.09164429	0.18
113.1260376	0.18
181.2434845	0.56
191.1079865	0.24
199.1163788	1.25
201.0474854	0.40
205.1996307	0.19
215.1460724	2.09
216.8893585	1.81
219.1127777	0.25
219.9662933	0.16
224.7277527	0.40
227.3065338	0.19
231.1916351	0.28
233.1103363	0.39
243.1387177	100.00
243.9259796	0.82
245.1867828	2.50
246.9432831	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
76.84127808	0.90
80.89611816	1.24
82.92195892	0.35
85.02953339	0.67
88.86509705	0.60
90.89320374	0.17
93.05774689	0.40
94.95626831	1.84
97.07374573	0.91
99.0216217	1.78
102.950058	0.77
105.0658112	0.43
106.8843842	0.12
107.9444275	0.29
108.833725	1.52
110.2532959	0.33
110.9492645	1.26
112.9356995	0.15
115.8803558	0.18
118.8672485	0.60
120.9662781	1.54
122.9074097	2.18
124.9449005	1.11
127.0244293	3.49
129.0193634	7.00
130.0451202	0.87
131.2270203	0.13
133.1133118	1.91
135.0966339	4.40
136.0242615	0.08
137.0740509	1.15
138.8178558	1.56
141.0417633	2.82
143.0278168	0.50
145.1060333	0.70
147.0594635	1.04
149.1221161	0.20
151.0063019	77.86
152.0189362	5.04
153.1508636	2.03
154.0489655	0.39
155.0553131	1.87
157.0945282	0.56
161.0925446	1.73
162.9884644	0.90
164.9815826	2.92
166.0449219	1.21
167.1720276	4.67
167.9711151	0.58
168.9142303	1.88
171.1398773	0.68
175.1178589	2.82
177.1265564	1.08
179.1125793	1.46
179.9602814	0.26
181.0553131	1.56
182.0618286	0.91
183.0411835	1.09
185.2272339	3.00
188.7848511	0.48
191.1731415	0.33
193.2445984	1.10
194.9206696	2.51
197.1096191	9.63
198.2418213	0.72
199.1890869	0.58
207.1027222	3.38
208.2210541	0.14
209.0830536	3.13
209.8013306	0.35
211.1267395	3.79
212.0101776	0.57
215.0001831	0.10
217.132309	15.79
221.2395172	0.12
224.0996246	0.58
225.1782684	17.58
226.0255737	0.64
229.6309967	0.70
235.1313934	35.74
236.2177277	1.04
238.1495514	13.13
239.0962067	1.51
250.9819946	0.87
253.077713	100.00
254.1579132	20.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	319.0782
Annotation	Unknow
Peak:m/z	Relative Intensity
111.0196228	0.10
171.0657349	0.07
173.1339874	0.10
195.0938263	0.09
215.1041565	0.17
239.0327454	42.20
257.1922913	0.01
275.3378601	0.02
283.1305847	1.89
301.0122681	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2496
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0074463	0.20
106.9954681	0.98
109.0623474	1.66
111.0872192	0.11
114.9710388	0.11
116.9740829	0.14
118.7971725	0.06
120.9548035	3.68
123.0966568	1.17
124.6296539	0.47
128.9065247	0.17
130.905426	0.22
132.9228973	0.37
135.0735931	4.19
137.0663147	0.33
138.9311218	0.15
141.1170959	0.08
142.9612885	1.16
143.9526367	0.13
147.0440063	4.07
149.094574	3.20
149.9734192	0.10
151.0759583	0.42
152.914093	0.06
157.0550385	1.38
158.966217	0.60
161.0000916	2.49
163.1201477	0.94
164.9449463	0.72
166.728363	0.11
169.1085815	0.33
171.0285339	0.51
173.1217346	1.05
175.0649872	2.68
177.0443878	0.28
179.1346741	0.28
180.9572906	0.22
183.1096344	0.71
184.3009491	0.04
185.0447083	0.16
186.974884	1.18
189.1768799	1.30
191.1433258	0.68
193.0619507	0.23
195.0774536	0.07
197.0668335	0.33
199.0953369	0.33
201.1353455	0.58
203.1550903	1.11
205.2831726	1.04
209.112793	0.34
211.2111816	0.46
213.1797791	0.22
215.2757263	0.17
217.0302124	1.59
221.1158447	0.17
223.1938171	0.31
225.0592346	0.15
227.0931396	0.32
228.2642212	0.10
229.0849609	0.52
231.102356	1.20
233.4093933	0.06
235.9883423	0.05
237.6211243	0.03
239.2263184	0.22
241.1166687	0.33
243.2226562	0.42
245.1406555	1.74
247.1991272	6.46
253.3786011	0.05
255.259491	0.15
257.1298523	0.22
259.21875	0.86
260.1025391	0.05
263.2866821	0.05
265.3943481	0.07
266.2189636	0.06
267.3468628	0.27
269.1433411	0.23
271.1962891	0.44
273.3931274	0.04
277.2124023	0.63
280.4405518	0.08
281.2950745	0.47
282.2174377	0.09
283.0899963	0.18
283.991272	0.08
285.203186	0.65
287.0638428	0.18
295.3036499	0.66
297.2991943	0.15
298.9479065	1.33
299.5672913	0.88
305.2928467	2.61
306.261322	0.19
310.1867065	0.09
312.3824768	0.03
313.2163391	0.55
314.0669861	0.05
323.237915	100.00
324.0463867	0.61
325.309967	0.06
341.1761169	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	524.1955
Annotation	Herbicidin E
Peak:m/z	Relative Intensity
147.1079712	0.77
163.3191071	0.09
165.0543213	13.59
179.3660889	0.17
181.9969788	100.00
198.7325439	0.24
291.9262085	0.32
310.1000977	0.08
324.8183594	0.49
332.2656860	0.13
342.6601562	0.20
343.9832153	0.99
348.9194946	0.15
361.7970581	1.75
362.4547729	0.41
377.1788330	0.12
378.2362061	0.30
394.4677734	0.25
395.2756958	1.03
408.9310303	0.09
449.2949829	0.41
460.0695190	0.28
488.3003540	0.19
489.2536621	0.09
506.2942505	1.13
523.7766113	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	349.1343
Annotation	N2-(2-Carboxymethyl-2-hydroxysuccinoyl)arginine
Peak:m/z	Relative Intensity
112.0644836	0.36
112.8023987	0.06
113.8442383	0.15
115.9375458	1.68
126.8678284	0.02
130.0619507	1.47
137.0299530	0.02
139.9325714	0.05
140.8727417	0.08
148.9757385	0.02
157.1182556	1.88
158.0126495	3.19
158.9680634	0.01
161.2039185	0.06
172.9388428	0.01
175.0372009	100.00
176.2078705	0.04
187.1245422	0.06
209.0881805	0.13
220.0094604	0.02
228.9716492	0.05
246.2150574	0.02
259.1376953	0.05
268.0178833	0.02
270.9680176	0.03
272.1828308	0.02
281.6863403	0.08
289.1507568	0.10
290.1844482	0.03
296.0802002	0.24
303.0934753	0.05
305.0474854	0.01
313.3054199	0.03
314.2779236	0.12
318.9429016	0.02
331.1636353	0.64
332.1199341	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	714.5883
Annotation	Unknow
Peak:m/z	Relative Intensity
200.9268494	0.07
212.9682465	0.10
247.1982269	0.87
283.7562561	0.33
338.7332153	0.13
358.2611694	0.09
391.6873779	0.07
423.9486694	0.36
429.3543701	0.15
442.7796021	0.18
447.4511108	0.24
468.5035400	0.22
479.3952026	0.13
485.2550659	0.18
543.9473267	0.23
544.7128296	0.43
551.1657715	0.44
552.3706665	0.86
588.3722534	0.14
610.5045776	0.13
625.4425659	0.41
626.2931519	0.54
629.4689941	0.09
633.6055298	0.19
647.8948975	0.44
653.1898804	1.86
657.3086548	0.56
668.9617920	0.66
672.0094604	1.11
673.5558472	0.13
676.7479858	0.10
677.5675659	0.20
678.2420044	1.85
679.3290405	0.70
680.2510986	0.33
687.7429810	1.17
691.7031860	0.28
697.5763550	0.17
698.9319458	2.34
699.5619507	0.79
730.6278076	0.72
739.4243774	0.13
747.9239502	2.81
755.0815430	0.41
787.7282104	0.42
804.3811035	1.52
821.5500488	0.11
823.2648315	0.32
827.8167114	1.95
840.1676636	0.23
864.5845337	1.02
870.6279297	38.77
871.3069458	7.40
872.1437988	0.19
877.6660156	0.17
881.4370117	0.09
885.9423828	3.13
886.6217651	0.54
887.9403687	0.15
897.5142212	2.23
898.2250366	0.92
900.8332520	0.20
903.0065918	0.69
903.8095703	100.00
904.7273560	3.02
905.5702515	1.87
906.5686646	0.46
907.6271362	0.20
908.3679810	0.10
909.1486816	0.12
927.3289185	0.25
932.5603638	0.64
933.9603882	0.07
950.1484985	0.59
950.7837524	0.68
958.4927368	0.16
959.2177124	0.37
969.3340454	0.31
976.3624878	0.22
987.4477539	0.52
1004.3815920	0.26
1009.5908810	0.23
1017.1525880	0.38
1021.4085080	0.24
1051.5876460	0.24
1067.4039310	0.10
1124.3623050	0.36
1126.6203610	0.20
1164.7867430	0.09
1249.8807370	0.65
1251.0311280	0.09
1459.4715580	0.27
1613.5521240	0.12
1623.6594240	0.14
1928.5084230	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	401.0724
Annotation	Unknow
Peak:m/z	Relative Intensity
128.1757812	0.04
197.2394104	0.04
207.4008484	0.22
221.2142944	0.02
227.1427002	0.05
231.0340576	0.03
239.0804749	0.05
243.1763916	0.13
265.4189453	0.08
281.4178467	0.03
295.0112610	0.04
315.1828308	0.03
317.1398926	0.04
327.0469971	0.06
328.1229858	0.04
355.1355896	2.76
357.1269531	100.00
357.7569275	0.17
359.2555542	0.05
365.4744873	0.04
371.1913147	0.11
373.1479187	0.12
383.1479187	0.79
383.9666443	0.02
384.8489685	0.02
401.0267029	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	746.1969
Annotation	Unknow
Peak:m/z	Relative Intensity
331.2193604	0.21
333.2200317	0.06
442.0165405	0.07
538.5641479	0.16
547.9584351	0.06
550.6600952	0.04
552.9262085	0.13
564.5541382	0.08
577.7232056	0.12
594.0751953	0.16
609.7359619	0.39
615.4568481	0.33
661.6666870	0.31
678.3322754	3.59
700.2000122	100.00
700.8366089	0.15
722.5883179	0.05
729.3466187	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.86
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8566132	1.42
132.7878723	0.04
152.0326996	0.02
156.2293701	0.04
162.0491028	0.54
164.7800598	0.05
174.2220764	0.05
179.8416290	0.13
180.6394958	0.06
182.9608917	0.04
190.9191589	3.81
196.8682861	4.83
198.9132996	0.06
204.9753265	0.03
206.9041748	16.53
207.5094910	0.04
212.9273071	0.51
215.2108765	0.04
216.1884460	0.05
220.3093262	0.09
226.0077820	0.11
227.3658142	0.05
240.0076904	0.06
240.6661072	0.04
252.1967468	0.87
257.1173706	0.09
258.8156738	91.13
259.4192505	0.12
265.3032227	0.08
268.2612305	0.05
270.1384888	0.10
274.7805481	100.00
275.4260864	0.21
283.0942078	0.33
284.6937561	0.07
296.2268982	0.69
297.1616821	0.81
299.2368164	0.06
302.0312500	0.04
314.2645874	0.05
315.2033691	0.28
320.8561096	0.25
324.1054993	18.08
325.0931396	3.54
325.9415588	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	348.0695
Annotation	dGMP
Peak:m/z	Relative Intensity
100.0965500	0.02
108.8153229	0.04
116.0646439	0.08
118.9530029	4.94
129.1536560	0.06
130.0982971	0.07
135.9458466	100.00
136.6894836	0.01
137.9609680	0.03
140.1011047	0.07
144.6521149	0.02
146.8176117	0.10
148.2441406	0.07
175.1371460	0.14
179.1642914	0.04
186.0849915	0.11
197.0852966	0.05
198.3904266	0.10
199.0441284	0.10
202.1401672	0.11
214.0984802	0.05
214.9791260	0.04
216.1423035	0.50
227.1112976	0.04
232.1462708	2.02
234.2517090	0.04
244.0710144	0.02
246.9562073	0.03
248.3242493	0.04
249.1782837	0.04
250.0936279	0.05
258.1783142	0.12
265.8815308	0.03
270.0791016	0.05
270.8358765	0.20
288.2539978	0.03
291.0915222	0.04
294.8621826	0.06
299.8040771	0.02
304.0399170	0.02
306.9815674	0.02
312.1835632	0.13
330.0312500	0.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Unknow
Peak:m/z	Relative Intensity
179.0000458	0.08
221.0150909	0.06
341.1265564	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	594.2216
Annotation	Unknow
Peak:m/z	Relative Intensity
162.8513794	0.35
169.0016479	0.18
173.1789856	0.24
175.1622925	0.05
179.0427704	0.32
179.9802551	0.09
181.0936279	0.56
186.9365540	0.13
188.9719543	0.15
192.8171692	1.14
198.9697571	0.64
201.1789856	0.12
206.7880402	0.06
210.9217834	0.06
217.1208191	0.61
222.2783051	0.22
223.0380096	1.61
225.0956726	0.07
229.0246582	0.81
235.0004120	0.10
240.9522858	1.70
242.7741394	0.08
247.0596466	2.08
251.9399414	3.95
253.0705414	3.72
253.7257385	0.19
258.1524658	0.90
259.0096130	7.30
260.5971680	0.07
270.0188599	4.14
271.0262756	7.88
276.6509399	2.75
284.7616577	0.15
287.3200684	0.65
288.8233643	31.11
289.5152588	0.11
291.1333618	0.05
306.1843262	0.96
307.0370789	7.76
311.5252686	0.18
324.1983643	5.62
324.8850708	100.00
325.5949097	0.54
340.3862915	0.06
341.0821533	0.21
342.8128662	33.24
343.5046997	0.14
413.9448242	9.60
414.5936890	0.08
420.2891846	0.10
432.1318359	27.82
450.4954224	0.12
486.7261963	9.31
487.3485718	0.30
502.8073730	0.07
503.9833374	0.60
504.7061157	3.50
548.0003052	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	334.1389
Annotation	Tryptophyl-Glutamate
Peak:m/z	Relative Intensity
109.9790497	0.04
116.0343246	0.11
116.8151398	0.02
118.0528946	0.05
121.3071747	0.05
121.9666977	0.08
125.0092392	0.01
131.7998047	0.05
141.1194458	0.05
143.9658508	0.06
146.0325623	0.79
155.2550354	0.05
157.6104736	0.04
159.0435486	0.83
160.9239807	0.09
162.9759216	0.04
166.5924835	0.03
168.2837219	0.04
169.2736511	0.05
173.9439697	0.04
175.0772095	0.09
188.0164185	65.73
189.1346130	0.05
195.2681885	0.08
201.0680389	0.05
202.4062347	0.05
203.2118530	0.07
205.0743713	100.00
206.0863342	0.02
206.9922485	0.03
208.2524109	0.02
209.8090515	0.05
211.3460693	0.01
217.2078857	0.02
219.1726379	0.03
225.2312622	0.07
226.9175720	0.05
230.2933960	0.13
237.3110046	0.08
242.7791138	0.02
244.2130127	0.14
245.3647156	0.07
247.7883301	0.14
253.0996704	0.02
256.5149536	0.12
257.4034119	0.03
260.0597839	0.04
262.1333618	0.05
263.3849487	0.05
264.9864502	0.04
267.0269775	0.08
271.2239990	1.33
274.1564331	0.09
277.7018433	0.08
285.0529175	0.22
288.2319336	0.36
289.0254517	0.05
290.5549927	0.12
293.2396851	0.22
298.2080688	0.63
299.0321350	0.11
300.1572876	0.04
303.1350098	0.04
306.1466980	0.06
316.1278381	4.06
317.1858521	3.79
319.1040649	0.03
324.8890686	0.26
326.0805054	0.02
334.8030701	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	206.89
Annotation	Unknow
Peak:m/z	Relative Intensity
122.7630463	100.00
123.6712494	0.04
162.7953491	0.01
189.0879974	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	410.1454
Annotation	Unknow
Peak:m/z	Relative Intensity
121.1389008	0.04
126.2551804	0.02
127.4703293	0.02
128.0789490	0.70
135.0424957	0.08
154.0968628	0.80
162.0819397	0.04
202.1799622	0.03
204.2006531	1.10
218.2681580	0.02
227.1380310	0.03
230.3074341	0.09
248.0960083	100.00
281.2002563	0.05
288.2017212	0.10
290.1402283	1.10
315.0462646	0.05
332.3665161	0.02
364.1689453	0.05
392.0543213	0.12
401.0786743	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1119
Annotation	D-Fructofuranose 1,2':2,3'-dianhydride
Peak:m/z	Relative Intensity
96.9346161	1.57
98.9581680	0.21
109.0404205	0.72
114.8818817	0.03
117.0663147	0.02
126.9741211	7.17
129.9838562	0.03
135.0452881	0.14
137.3878479	0.03
138.9312134	0.11
144.8505096	11.80
146.7987823	0.16
148.9597778	0.05
150.6456909	0.05
152.8837891	0.08
154.8762512	0.08
155.4983521	0.02
157.3446045	0.08
161.1349792	0.10
162.7846069	17.01
165.0773926	0.11
169.0982819	0.02
172.8716583	0.06
176.9628754	0.17
179.0714111	0.03
180.5144501	0.09
181.1759644	0.33
184.0360565	0.16
186.9364929	0.11
188.9603729	0.26
190.9754944	0.26
191.8101196	0.03
192.8188171	1.26
193.9966278	0.05
195.1295166	0.16
198.9345245	1.62
202.9486389	0.03
204.9927979	0.41
207.0355225	0.24
210.9052124	0.96
212.2211304	0.33
213.2537231	0.20
216.4011230	0.40
217.0122986	2.32
219.1755676	0.08
220.0422974	0.11
222.9411926	3.02
223.8346252	0.05
225.0892334	0.48
229.0478516	1.19
231.0630188	0.02
235.0649414	0.46
236.0470276	0.01
240.3156433	0.52
241.0482788	1.05
243.0660706	0.51
247.0652466	3.91
252.9934692	8.24
253.6183167	0.07
254.7639160	0.03
257.9892578	2.05
258.7800903	12.52
259.5778198	0.04
261.1239319	0.37
268.1907349	4.10
269.1392212	1.67
271.0742188	23.85
272.0950928	0.03
273.6732788	0.09
276.9559631	0.08
279.1100769	0.41
280.4648132	0.06
281.3738708	0.05
282.3359680	0.05
283.0575256	0.15
283.7442017	0.05
284.4960327	0.01
285.4569092	0.21
287.0521851	0.88
288.8291626	100.00
289.5969238	0.11
303.6206055	0.07
305.1944275	0.04
307.0186462	7.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	544.7
Annotation	Unknow
Peak:m/z	Relative Intensity
174.9776917	0.16
193.1202240	0.05
193.9249420	0.09
207.1484680	0.15
235.0347900	0.14
288.6616821	0.03
291.1140747	0.10
309.2241821	0.03
324.9688110	0.08
351.3500977	0.25
364.0033569	0.05
369.1502075	1.33
374.4116821	0.05
376.8474121	1.99
383.0353394	0.06
392.9210205	0.17
402.8505859	0.13
406.8370361	0.50
407.6134033	0.14
408.9053955	2.44
424.8834229	0.06
432.8859253	0.11
445.7299805	0.08
458.9123535	0.04
460.7177124	100.00
461.3464355	0.19
470.8800049	0.23
476.5435181	1.01
477.1884155	0.18
485.1441040	0.74
497.9177856	0.20
516.3391724	0.23
526.1697388	0.15
527.1598511	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
76.74101257	1.81
78.93701172	1.17
80.99886322	4.09
84.77329254	3.14
94.98625183	7.29
97.06974792	1.89
97.94023132	0.62
98.85185242	1.20
104.9990997	0.90
107.0765991	0.92
108.986557	2.36
111.0982208	2.29
115.0900574	0.25
118.954422	2.39
120.9830933	1.10
122.8714752	4.18
124.9231873	4.57
127.0388794	5.58
128.9540863	5.90
130.0244751	0.95
132.9852295	1.38
135.0293274	0.73
137.0200958	1.88
139.0266724	3.43
140.7880859	1.46
142.0660248	1.58
143.3410645	1.73
145.0135498	0.56
147.085022	4.68
149.0087738	0.82
151.0055695	86.53
152.1479034	5.37
153.105896	1.45
154.0687256	0.67
155.0831451	5.52
157.0335999	1.49
159.0446472	2.90
161.0249786	6.55
163.1702728	5.70
165.1558075	0.61
165.9761353	2.23
167.1825867	1.11
167.8081512	1.76
169.082077	6.62
171.0406342	4.02
173.0830841	0.52
175.0907898	5.78
177.0110168	2.97
179.2107391	5.90
179.8562927	1.05
181.2958374	1.84
183.0386963	3.46
183.84758	1.88
185.0920868	3.79
189.1193085	3.34
193.0260315	4.50
194.0756531	1.66
195.1504059	4.08
196.9923096	11.97
198.9982452	1.74
205.1789856	1.66
206.9058838	9.14
209.0097809	5.56
211.1569366	8.90
211.980545	1.52
215.2710571	0.24
217.1412048	27.52
222.811142	0.63
224.0547943	1.05
225.0547638	18.16
235.1932373	68.99
236.2285309	1.32
238.0997772	13.14
239.1090851	4.72
251.2154999	1.04
253.0786285	100.00
254.1128387	13.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0465088	0.12
106.9245148	0.66
108.9498596	3.30
111.0936508	0.17
112.906311	0.14
117.0700302	0.34
120.9725342	5.40
123.1869507	1.92
124.7958221	0.57
128.9784241	0.21
132.9946289	0.84
134.9682922	3.65
137.1556549	0.98
142.993988	1.39
145.0316772	0.57
147.0726318	2.44
149.0720215	2.53
151.0931396	2.10
152.9009094	0.53
154.2870483	0.40
155.1417542	0.68
156.9420471	0.70
158.0001221	0.32
159.2270508	1.23
160.0507812	0.18
161.0664673	3.15
161.8334961	0.27
163.1696777	0.78
164.6830444	0.82
165.3525848	0.14
167.1936646	0.09
168.9596252	0.70
171.276825	0.68
173.0500793	2.02
175.0322418	1.67
177.278595	0.57
178.8356934	0.38
181.160675	0.79
183.2220459	0.87
185.1401062	1.88
186.6991882	1.07
187.4238586	0.15
189.0192719	2.10
191.0711975	0.32
192.2213135	0.22
193.2075806	1.52
196.8641968	0.27
201.0462952	1.43
203.0478973	1.78
205.2503967	1.18
207.1116943	0.46
209.2556458	0.13
211.0846558	1.39
212.9822693	0.55
215.0507202	0.49
217.2333069	1.56
219.3950195	0.24
220.1352844	0.17
221.0153503	0.31
223.148407	1.29
224.1589966	0.18
225.1414795	1.12
227.2017212	0.54
229.1479797	0.78
230.2485962	0.38
230.9559937	1.34
235.0341187	0.38
237.6414185	0.58
239.1782227	0.38
241.0428772	2.31
242.0507202	0.13
243.2256165	0.71
244.6135559	0.32
245.4201965	1.12
247.2493591	7.62
249.2120056	0.55
251.1077271	0.09
252.651001	0.22
253.2720032	1.07
254.0042725	0.32
255.1532593	0.56
257.0761719	1.26
259.3081665	0.83
260.2094727	0.83
263.3754883	0.11
265.3371887	0.29
266.9937439	1.02
271.2204895	1.12
277.3199463	0.56
279.5404663	0.90
280.3283691	0.16
281.2037354	0.94
282.9526978	2.57
283.6144409	0.34
285.4933472	0.88
287.244751	1.18
295.0944519	1.64
296.9968872	1.52
299.1223145	1.53
299.9625854	1.96
305.241333	4.59
307.3582458	0.14
310.187561	0.61
313.3658142	0.67
320.422699	1.24
323.2406616	100.00
324.1934814	0.43
325.2027893	0.25
332.9853821	1.34
341.2487488	1.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	185.0319
Annotation	Unknow
Peak:m/z	Relative Intensity
84.0879364	0.09
127.0742340	0.06
166.9184570	100.00
167.9594269	21.16
176.2073212	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	235.1089
Annotation	Alanyl-Phenylalanine
Peak:m/z	Relative Intensity
81.9700012	0.02
83.9637451	0.21
110.0894318	0.04
111.9303741	0.11
112.8775635	0.03
124.8920441	0.04
127.9586334	3.60
128.9556580	0.03
142.9849548	0.03
145.9540253	0.04
147.8315887	0.04
148.7274628	0.01
152.8671112	0.02
159.9686584	0.08
163.1914215	0.06
166.9936371	0.02
174.1767273	0.04
179.2205200	0.02
189.1212463	0.56
190.2457733	0.03
191.1800385	2.02
192.0964050	0.07
193.2040710	0.01
199.1981964	0.21
204.9981995	0.04
207.1381378	0.03
217.0823669	100.00
235.1817017	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	385.2126
Annotation	Voacristine
Peak:m/z	Relative Intensity
112.9964752	0.08
114.5392685	0.04
123.9168701	0.05
129.1231079	0.57
130.0660095	0.67
132.8356781	0.45
141.0264893	1.32
142.1097107	0.24
147.0788269	1.02
147.9936829	0.18
156.0477600	0.83
156.9903259	0.05
159.0485535	0.07
165.8130493	0.55
167.0565491	0.22
176.8945618	0.08
183.1519318	0.82
184.1626434	0.36
185.0403137	0.07
197.2371826	0.09
199.2095947	0.06
201.0613403	59.02
202.1263885	4.97
205.2698669	0.06
209.8951111	0.07
212.1896362	0.12
213.1397095	0.09
214.2487488	0.04
220.0677490	0.52
221.1290741	0.56
222.0632172	0.16
228.9744263	16.81
230.0393982	1.33
231.2377625	0.09
235.2771606	0.09
239.4446411	0.31
243.3117981	0.10
251.1132812	0.23
252.1825867	0.68
253.1152954	0.64
254.0715332	0.05
260.2640381	2.47
261.2087097	0.24
263.4148865	0.09
267.9241028	0.15
270.3698730	0.04
271.3367615	1.98
277.3415527	0.14
280.1312866	0.10
282.5166016	0.11
286.0447693	0.71
288.2859192	0.18
290.4784851	0.10
295.0646057	0.70
296.4344177	0.05
298.3811951	0.05
299.2518311	0.15
305.4964600	0.09
310.9295654	0.07
314.4150085	0.18
318.7589111	0.64
319.8903809	0.32
322.5927124	0.23
323.3181763	0.18
324.8879089	0.32
327.8895264	23.01
333.1006165	0.33
337.4218140	0.27
338.2335205	0.17
340.2082520	0.06
340.9294128	0.06
341.8634033	0.27
344.1397400	0.46
345.4836426	0.03
346.5338135	0.10
347.2307739	0.16
349.1023865	0.50
353.9080505	0.15
356.7397461	0.19
361.2810364	0.49
362.4782104	1.53
365.1659241	0.15
367.2096863	4.81
367.9273987	1.87
373.3123474	1.02
376.5498657	21.05
377.4913635	0.80
378.6918030	0.37
380.1148987	0.06
395.1282654	0.35
396.0592346	0.06
397.4246826	0.71
398.6310730	0.18
431.4278870	0.06
460.5139465	0.06
464.1210632	0.07
466.1270447	0.10
470.0894470	0.63
473.7558899	0.36
482.3331909	0.27
483.2560425	0.13
484.3529663	2.19
485.2936401	0.66
491.3418579	0.09
492.2880554	0.51
493.4963989	0.20
498.7463989	0.11
505.4164734	0.30
510.3464966	2.95
511.3710632	0.78
522.0038452	0.21
523.3350220	2.94
524.1765747	0.06
538.5230103	0.09
541.3590698	100.00
542.4244995	18.60
593.5496826	0.17
595.4403076	0.42
623.3880005	4.65
624.4501343	0.50
641.5206909	0.14
642.3554688	0.40
644.1505127	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	678.21
Annotation	Unknow
Peak:m/z	Relative Intensity
192.9469452	0.05
220.1721954	0.07
231.2237854	0.06
249.1205750	0.08
263.3493042	0.06
275.1029968	0.88
293.1738586	8.25
303.4901123	0.03
319.2459717	0.15
323.1941833	0.48
337.1824951	0.58
341.0261536	0.47
375.2131348	0.26
383.2189941	0.04
411.1403198	3.18
437.2896118	1.97
439.0294189	0.23
455.2022095	100.00
463.4648438	0.07
472.2388306	0.29
481.3245850	2.27
499.2585449	74.04
515.2519531	0.29
516.1487427	0.35
523.1694336	0.09
531.4778442	0.22
532.2700806	0.12
538.7738647	0.12
545.3994751	0.05
547.2991943	0.14
596.7254028	1.51
597.3368530	0.04
609.8904419	0.07
632.1007080	0.18
634.2438354	0.57
660.3270874	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.79
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0442810	0.14
196.8938446	1.37
213.0838318	0.13
245.1939545	0.25
259.1374817	0.27
280.2077637	1.23
280.8596191	12.22
286.9921265	0.73
296.8358154	2.23
310.4942017	0.07
317.8213501	0.07
318.4551392	0.04
323.2666016	0.09
329.1788940	0.44
340.8676147	0.70
344.8298340	0.07
358.8223267	0.34
360.1840210	0.10
362.9937744	0.90
364.6973267	61.22
370.7201538	1.84
372.9826050	0.15
377.0755005	0.38
378.2373047	0.25
380.7777100	7.59
396.9519043	0.24
400.9010010	0.17
412.7469482	1.16
421.1228638	0.30
426.9678955	0.06
443.0185547	0.24
445.3992920	0.25
446.8154907	1.75
448.5908203	100.00
449.6035767	0.10
456.2597656	0.09
460.8865356	0.49
464.5297852	0.72
469.0717773	0.46
471.4208984	0.14
472.9473877	0.44
486.1233521	0.42
486.9436035	0.59
502.5830688	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	784.4042
Annotation	Fumonisin FP3
Peak:m/z	Relative Intensity
227.0135651	0.21
228.9687347	0.17
230.2266083	0.07
242.2459412	0.11
243.1326599	0.10
244.0960388	0.22
246.0722809	0.23
286.2522278	0.09
300.2908630	0.06
300.9582520	0.07
311.2277527	0.04
312.1030579	0.17
322.3890686	0.04
330.4891968	0.11
339.5738525	0.06
356.7478333	1.16
357.4334106	0.45
358.0884399	0.07
374.1808167	0.56
375.2179871	0.07
379.5059814	0.09
391.3696289	0.11
400.3734741	0.04
404.2735596	0.06
412.7569580	0.06
413.5428467	0.23
431.8347778	0.25
438.4081421	0.23
441.5465088	0.21
447.2159424	0.20
448.0413208	0.10
449.3842163	0.11
453.3104858	0.10
457.4926147	0.21
458.4979248	0.14
470.2693481	0.42
471.4100952	0.08
489.4777832	0.07
502.3604126	0.13
502.9931641	0.06
505.7153320	0.36
511.2222290	0.52
516.5156250	0.26
519.4622803	0.36
526.9968872	0.19
533.8286133	0.28
538.7982788	0.12
539.4483032	0.10
543.3233643	0.36
547.1598511	0.27
548.3151245	0.06
555.0048218	0.29
560.4176636	0.41
562.4281006	0.14
564.9853516	0.46
568.5150757	0.14
569.6539307	0.19
580.1373901	0.22
585.5513306	0.58
590.9363403	0.40
592.5917358	0.12
593.7738647	0.83
595.4677734	0.30
602.3448486	0.64
604.4413452	0.23
611.5302124	0.19
612.3391113	0.31
618.6581421	0.28
620.7390747	0.31
621.6764526	0.12
622.5924683	0.32
623.3629761	0.07
625.0313110	0.14
627.7157593	0.95
628.5244751	0.18
632.2194214	0.28
638.7164917	0.18
639.4022827	0.20
640.4974365	0.26
646.5173340	0.13
647.5051880	0.05
653.9526978	0.15
655.3255005	0.40
656.6631470	0.36
659.1881714	0.66
661.6398315	0.20
662.9288330	0.98
663.6464844	0.87
664.6934814	0.51
665.5646362	0.15
666.8555298	0.51
668.7652588	1.70
669.9114380	0.29
671.0606079	0.24
673.7451782	0.08
675.5634766	0.47
676.7705688	1.61
677.5402222	1.16
679.9758301	0.58
681.4708252	0.12
684.5360718	0.19
686.5311279	0.07
687.8063354	0.06
689.1130981	0.59
689.9872437	0.41
691.0892944	2.25
692.5487671	0.13
694.4011841	2.07
695.2559204	0.73
696.6354370	0.25
697.4197998	0.34
699.1420898	0.07
701.3015747	1.27
702.8517456	0.16
704.7200317	2.00
705.9022217	3.40
706.6234741	0.49
707.8973999	0.28
709.0949097	2.84
709.8818970	0.73
712.0134888	1.08
713.3284302	0.63
714.7246094	0.13
715.5809326	0.28
716.9111938	1.45
718.6865845	4.77
719.6889038	1.29
721.0789795	0.15
722.8513184	1.32
723.7670288	6.08
724.9382935	1.37
725.7523193	0.71
727.1278076	1.01
729.3986206	1.65
730.1972046	0.08
731.5052490	0.90
734.1107788	1.67
735.0117188	0.90
735.7010498	0.08
736.6800537	0.49
737.6441040	0.78
740.0752563	2.37
740.7669067	1.46
742.8589478	3.31
743.7861938	1.11
744.8527832	27.26
745.9041138	2.65
746.5651855	1.13
747.1926880	10.85
748.1483765	0.81
749.0620117	0.35
749.8250122	0.26
750.4286499	0.21
751.7734375	38.43
752.5858154	5.46
753.2887573	1.47
754.2040405	0.15
755.0892944	1.79
756.1473389	0.80
756.7584229	0.75
759.2022705	0.39
760.2973022	1.12
761.4160156	0.42
762.6738892	0.68
763.5147705	0.06
764.3392334	0.15
765.5059204	0.58
766.6725464	0.04
767.4706421	0.31
768.2849731	1.44
769.6854248	2.08
770.5086060	0.30
771.9112549	0.90
773.5738525	0.73
775.9165039	1.04
789.1201782	1.19
792.4077148	0.07
793.4451294	0.05
802.3276978	0.66
802.9511108	0.68
806.7472534	1.09
807.7886963	0.62
808.6605835	0.55
809.3547363	0.31
810.3934937	0.26
813.0586548	0.46
815.0048828	0.16
816.0036011	0.72
819.4855347	0.25
825.8616333	6.97
826.5001221	4.76
827.1840210	3.31
827.9967651	0.39
829.2643433	0.11
831.6084595	0.68
835.8810425	0.65
840.2420044	0.21
840.9485474	0.11
841.9403076	0.61
845.4933472	6.79
846.4393311	1.38
850.4110107	0.76
851.4680786	0.76
853.9221802	0.21
854.9161377	0.33
855.7194214	0.10
856.5789185	0.57
857.8264771	1.12
858.7229614	0.22
859.3526611	0.17
861.3519897	0.09
862.8447876	0.71
864.0419922	0.62
865.0134277	0.34
866.0424805	1.01
867.4672852	0.11
868.2564087	0.06
869.2376099	0.82
870.2161255	0.74
872.2930298	0.81
873.5512085	2.05
875.2024536	0.23
878.7304077	0.19
880.6313477	0.30
881.2674561	0.50
882.8961792	3.01
883.5299683	9.09
884.6237183	1.17
887.7034302	0.43
888.6233521	0.59
890.7050171	1.52
891.8588257	0.19
896.6190796	0.35
899.3674927	0.42
902.2197876	1.09
902.9113770	1.08
903.5309448	0.23
904.5761108	0.27
907.7311401	1.21
908.4072266	0.39
909.5177612	0.24
912.8742676	0.36
914.1858521	0.17
915.4631958	0.84
916.1303101	0.52
920.7910767	1.59
921.5411987	12.18
922.5690918	2.89
924.5347290	0.14
925.4563599	0.46
926.0947266	0.26
926.9583130	0.67
929.7316284	1.79
931.5625000	1.96
932.1958008	2.08
933.0999146	0.08
934.6323853	0.62
936.1271973	1.48
938.2479858	1.32
939.4353638	1.99
940.5322266	1.76
941.3120117	1.49
942.1919556	0.59
944.4999390	0.99
945.3241577	15.59
946.3127441	1.93
947.9609985	0.45
949.0761719	0.85
950.2175293	0.32
951.4522095	0.18
952.7992554	0.41
954.9037476	0.58
958.1040039	1.35
958.8396606	2.44
959.6588745	0.41
960.4852905	0.10
961.8889771	0.37
962.6040649	0.08
963.8442993	8.10
964.5410156	43.89
965.7890625	0.43
968.1738892	1.55
969.1495972	0.25
970.4417114	0.94
971.9346313	0.50
972.6521606	0.76
973.4133911	0.47
975.7875366	0.87
976.4177246	0.11
978.2792358	0.70
979.4536743	0.35
981.2565308	0.70
982.9792480	0.08
985.2728882	0.10
986.9597778	0.54
987.9758301	0.58
990.9083862	0.29
992.6459961	7.07
993.6635132	1.68
995.6679688	4.62
996.5287476	4.98
997.3507690	1.04
998.0530396	0.06
998.7719727	0.23
999.6255493	0.09
1000.5259400	0.16
1001.6387330	41.96
1002.2711790	100.00
1003.7004390	1.65
1004.8278810	3.21
1005.8496700	0.85
1007.0544430	0.05
1008.1659550	0.35
1008.9736330	0.38
1010.5556030	0.08
1011.2401730	0.50
1015.3349610	0.13
1019.4706420	3.57
1020.3745120	1.41
1021.3070680	0.47
1031.2008060	0.55
1033.1729740	0.28
1039.7517090	0.22
1040.7399900	0.34
1041.7956540	0.20
1043.8422850	0.46
1046.6120610	0.07
1052.8819580	0.55
1055.0898440	0.21
1056.7257080	0.54
1058.1127930	0.50
1062.2032470	0.34
1063.4987790	0.12
1065.6540530	0.10
1069.7731930	0.76
1076.3742680	0.24
1077.0142820	0.23
1081.1687010	0.06
1090.5125730	0.14
1091.7218020	0.93
1092.6474610	0.05
1093.9428710	0.06
1105.6335450	0.09
1106.2929690	0.15
1110.4343260	0.97
1111.3293460	0.58
1112.3100590	0.26
1113.0378420	0.10
1118.3457030	1.13
1119.5822750	0.28
1123.7209470	0.15
1124.5853270	0.18
1125.2335210	0.48
1126.4138180	0.08
1127.5380860	0.16
1129.8317870	0.05
1132.4654540	1.70
1133.9287110	1.38
1134.8134770	0.53
1138.7038570	0.13
1143.2888180	0.13
1144.9042970	0.08
1145.7143550	0.49
1149.9052730	0.18
1150.7362060	0.18
1151.7978520	0.33
1163.0917970	0.37
1173.8085940	0.48
1182.3045650	0.71
1183.6009520	0.12
1186.3811040	0.13
1211.2810060	0.18
1222.7891850	0.33
1223.5538330	0.24
1225.9021000	0.07
1237.4232180	0.15
1238.5458980	0.25
1240.0179440	0.17
1241.3028560	0.50
1244.0811770	0.10
1250.6706540	0.05
1260.6655270	0.55
1261.5877690	0.36
1262.3870850	0.07
1265.7095950	0.27
1267.6107180	0.57
1268.7054440	0.24
1277.4176030	0.12
1289.9455570	0.09
1304.5450440	0.06
1318.4854740	0.08
1324.1300050	0.18
1326.0411380	0.40
1331.5540770	0.12
1335.7291260	0.25
1352.5706790	0.56
1353.8472900	0.84
1354.5308840	0.35
1355.2044680	0.19
1356.6090090	0.25
1388.4106450	0.10
1402.1612550	0.21
1411.1614990	0.06
1438.8382570	0.17
1446.8328860	0.22
1463.9920650	0.32
1468.0096440	0.06
1473.1831050	0.23
1483.9974370	0.13
1513.3753660	0.09
1540.5177000	0.06
1563.7884520	0.06
1614.6301270	0.18
1630.9937740	0.06
1644.0242920	0.12
1651.8801270	0.14
1655.1247560	0.10
1724.8978270	0.20
1727.0748290	0.09
1755.6193850	4.67
1775.7615970	0.30
1852.9229740	0.10
1900.5467530	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.83
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9756317	0.32
143.2092285	0.09
196.9155273	2.29
212.6781006	0.72
229.0477905	0.05
236.9748840	0.09
256.8086548	0.19
270.9450378	0.06
274.7767334	0.31
278.6923523	0.11
280.7278442	31.62
281.4215393	0.05
282.9684448	0.08
286.9424438	4.18
293.1718750	0.24
294.0300903	0.18
296.8145752	1.73
304.8857117	0.13
313.0065918	0.09
316.9613037	0.13
328.8941040	0.86
332.8243408	0.17
340.9527893	2.35
342.9695435	0.38
355.1672974	0.07
358.8335571	1.18
362.1387024	1.32
364.7097168	100.00
372.9706421	0.36
380.9253845	0.76
382.8647156	0.12
384.8950500	0.19
388.7473450	0.50
403.2843323	0.34
404.2071838	0.22
430.9866333	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	507.157
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0220947	0.97
162.8982697	0.08
163.8625488	0.09
164.9781036	100.00
326.1546021	0.19
327.2418823	0.21
341.3155212	0.44
342.0652161	0.28
489.1231995	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	308.0988
Annotation	O-Acetylneuraminic acid
Peak:m/z	Relative Intensity
100.8760071	0.04
105.2399979	0.13
110.9265823	0.04
112.9816437	0.10
118.9434433	0.17
125.0572662	0.03
127.9430389	100.00
128.6737518	0.03
131.0961609	0.06
143.0431519	0.19
148.9992065	0.07
161.1662903	0.03
162.1012115	0.08
179.0451355	2.89
218.1902466	0.03
220.2363281	0.13
223.9798584	0.08
226.1282959	0.11
228.0875244	0.05
246.0917358	0.04
254.1933289	0.25
255.2208557	0.19
256.2528687	0.10
262.3641357	0.03
264.2645264	0.08
272.3878784	0.37
274.1444092	0.05
275.8872375	0.03
283.2182312	0.03
290.2277527	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.1505
Annotation	Benzyl beta-primeveroside
Peak:m/z	Relative Intensity
158.9419250	0.12
211.1770782	0.08
239.3717957	0.07
245.1186829	0.03
257.1619568	0.05
269.1044312	0.05
287.0305786	0.03
323.0281982	0.04
339.2411499	0.18
341.0458984	0.04
375.2820740	0.04
383.3645325	0.04
387.2505188	0.36
388.0991211	0.08
401.1856384	100.00
402.9891663	0.13
405.4562378	0.05
417.1999817	0.08
429.2635193	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	663.1989
Annotation	Unknow
Peak:m/z	Relative Intensity
217.0779724	1.03
229.0234375	0.23
239.1490326	0.16
258.9667969	0.07
303.0949707	34.35
319.0736694	0.08
321.1109619	100.00
338.2103882	0.17
341.4870605	0.28
364.9592896	0.14
380.1381836	0.07
381.3481445	0.13
395.3318481	0.14
452.1967773	0.13
464.4152222	0.27
483.4526367	0.14
486.9664307	0.08
501.2936401	0.48
511.9215698	0.14
516.2023315	0.10
518.9911499	0.08
534.0777588	0.06
546.3610840	0.29
548.3803101	0.08
551.1348267	0.06
558.2234497	0.16
575.9899902	0.06
591.1268921	0.05
602.9704590	0.10
603.6428833	0.14
618.0492554	0.07
618.9350586	0.23
640.5196533	0.27
644.5071411	0.36
645.2489624	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	fagopyritol B1
Peak:m/z	Relative Intensity
100.9370651	9.54
112.9587326	25.67
114.8924866	1.96
118.97789	14.72
125.0296936	3.96
130.9393158	4.53
142.9205627	22.15
148.9150696	4.21
160.9419861	29.67
179.0492249	100.00
246.9848938	1.23
248.9176941	2.29
251.0839844	1.09
252.0900269	0.44
253.0471191	3.00
256.8824768	1.45
268.1845093	0.90
281.1107788	7.04
295.1738281	11.95
297.052002	2.82
303.1376343	1.49
312.3959656	1.50
314.1724854	1.41
321.3009338	4.39
323.2629089	1.79
324.148468	8.13
325.0674438	1.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	258.0787
Annotation	2-(Ethylsulfonylmethyl)phenyl methylcarbamate
Peak:m/z	Relative Intensity
76.1221237	0.01
99.9873886	0.01
104.9777832	0.01
122.0552826	0.17
128.1316986	0.01
130.3543243	0.00
132.1699066	0.00
136.9611053	100.00
137.9296570	0.05
139.9545288	0.01
143.0893860	0.01
151.8219299	0.01
153.5630493	0.03
155.0345917	0.02
157.2125397	0.01
159.9347839	0.02
172.1580048	0.01
173.7561646	0.01
175.3366852	0.04
176.1554108	0.01
187.3038483	0.01
188.9876709	0.00
190.1820526	0.01
196.8587952	0.02
199.9445953	0.01
200.9675598	0.02
210.0619812	0.01
212.0889435	0.06
213.9842377	0.04
216.5115509	0.01
217.1473236	0.05
221.7125549	0.00
222.8135223	0.01
225.8022614	0.02
227.3102722	0.01
229.5625916	0.04
230.3400726	0.03
237.0250244	0.01
240.0397797	0.29
241.1530762	0.04
247.6380768	0.04
249.6207886	0.02
251.8672943	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	382.1695
Annotation	Thr Phe Asp
Peak:m/z	Relative Intensity
112.9781036	0.23
137.0326538	0.38
150.2140503	0.35
166.1267548	0.98
174.1558075	0.18
183.8403931	0.53
185.0622253	0.96
202.1472168	3.39
203.1315308	2.78
220.0985718	73.41
221.1313477	100.00
225.2828369	0.09
226.2713928	0.56
228.9845581	0.29
233.0687561	0.89
242.2271118	0.47
250.8864136	0.19
252.1001282	0.85
264.1826172	0.13
267.0742493	0.47
271.2625732	0.51
280.1393433	0.20
293.8266602	0.25
296.8802185	0.32
301.2147217	0.80
302.4157715	0.23
308.0822449	0.29
314.9967346	0.71
318.1172791	0.40
327.7327271	0.10
332.308075	0.43
333.3674927	0.14
337.2026978	2.53
341.9175415	0.40
355.1330261	0.39
360.1654053	0.32
363.000885	0.62
365.1861572	3.55
365.9826355	0.59
370.4244385	0.74
371.1272583	0.31
373.6932068	0.75
374.3247986	2.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0965
Annotation	Ethotoin
Peak:m/z	Relative Intensity
108.7672119	0.03
132.1020355	0.05
159.1042480	0.26
188.0025330	100.00
196.1803436	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	156.08
Annotation	L-Histidine
Peak:m/z	Relative Intensity
71.9274750	0.04
82.8942413	0.34
84.8793793	0.11
93.0456238	0.02
94.9113617	2.95
109.9431305	100.00
110.8650818	0.06
111.8910828	0.49
114.8188934	0.07
137.8330994	0.65
138.6024628	0.03
155.6609192	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
92.95618439	0.28
97.03559875	0.07
109.126236	0.13
111.0455627	0.10
127.0725708	0.03
128.9967346	0.12
146.0602264	0.06
161.1447906	0.07
170.3105621	0.08
175.1049805	0.09
181.4705048	0.04
187.086319	0.06
189.1369781	0.08
200.9271698	0.22
202.2195282	0.07
203.1416321	0.06
205.487793	0.10
211.1370087	0.19
215.1523132	0.13
217.1374969	0.58
224.4663391	0.25
225.2277985	0.13
233.1831512	0.07
241.3098907	0.10
243.1376495	100.00
245.1656952	3.47
260.9657898	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	176.1
Annotation	Unknow
Peak:m/z	Relative Intensity
70.0610580	0.01
113.0668640	0.04
115.0425415	0.24
116.1578979	0.03
130.0419769	0.37
133.0586395	0.44
139.4869537	0.01
158.9593353	100.00
159.8246002	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	166.0857
Annotation	Unknow
Peak:m/z	Relative Intensity
119.9647369	100.00
131.0945435	0.28
137.9606628	0.02
147.9078217	0.77
148.8961182	4.34
152.2206268	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	386.21
Annotation	Scopoloside II
Peak:m/z	Relative Intensity
127.0050583	2.50
128.9087524	20.76
129.9849396	1.34
133.1567078	0.15
141.0008240	0.13
154.9142303	14.46
155.9752350	6.21
157.0511169	0.14
168.0929260	0.20
171.8029785	0.62
186.0730591	0.82
200.0139771	22.74
201.0932922	2.32
212.0712280	0.94
212.8618774	0.11
214.0120087	0.11
229.1360168	7.40
229.9815979	0.96
239.0650330	0.18
247.0074768	0.10
251.1598816	0.26
257.0043030	23.11
258.1457825	1.43
269.1574707	7.16
270.2008057	0.66
274.6217957	0.17
276.3857727	0.27
284.2482300	0.13
297.3779907	0.08
302.2523804	0.78
303.3598633	0.07
308.4291382	0.18
313.1757202	0.24
315.3569336	0.50
322.3277283	62.92
323.6344604	1.43
324.3168030	1.12
325.4812012	0.22
327.9929810	0.18
333.3630066	0.36
350.3909302	0.34
351.2831116	0.24
352.2413635	0.21
357.8706970	2.78
359.1365662	0.99
360.2394714	0.31
363.5909424	1.12
368.2170410	34.33
369.3286133	6.29
370.1823120	0.08
374.8168640	0.45
376.2681580	3.60
377.3399353	49.20
378.3742981	0.77
404.2635193	34.38
405.2914429	5.82
418.0967712	0.61
437.4826050	0.22
466.0983582	0.69
474.9830017	0.41
477.2041626	0.49
478.3299255	0.50
480.1427612	0.09
485.2807922	1.43
486.4098511	0.71
488.1667786	0.57
503.2728882	8.42
504.3325806	2.06
505.3469543	0.12
515.3305054	27.47
516.3500366	6.72
517.2564697	1.60
526.4168091	0.16
572.3578491	67.29
573.3673706	17.19
574.3497925	0.97
598.4173584	0.22
599.2769165	0.74
616.4075928	6.39
617.2467651	2.13
618.3639526	0.15
626.5859375	0.58
633.6112671	0.11
643.3677979	100.00
644.3958740	36.17
645.4379272	2.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.88032532	0.35
105.0631714	0.80
106.9056931	1.66
108.0444794	0.15
109.0424271	1.74
111.7944717	0.14
112.7777939	0.16
116.8968887	1.09
121.0382767	4.68
123.1081314	1.26
124.9668503	0.35
127.013649	0.30
128.7277527	0.50
130.9549866	0.53
132.9815674	1.95
135.0482788	2.68
137.0235596	0.43
138.4242249	0.30
139.068222	0.39
141.0109558	0.69
143.0587311	7.50
145.0332336	0.55
147.0150146	2.38
148.9022217	2.95
150.8863831	1.65
151.8822937	0.57
152.8359375	1.12
154.1378174	0.19
154.9426575	0.93
157.0560913	3.97
158.9706726	2.61
161.2770386	0.20
163.1843872	0.89
165.1092072	2.05
165.8804321	0.68
167.1151733	0.73
168.8240967	5.03
169.4300232	0.09
171.0794678	1.80
173.0381622	3.01
175.0940399	0.88
177.2555084	1.40
179.0520477	1.01
183.1508026	1.58
184.0981598	0.27
185.14505	0.67
187.0608521	1.57
188.9805298	1.03
191.1242371	0.21
192.5704346	0.13
193.2438507	0.15
195.0606842	0.38
197.0584717	1.65
198.8733673	0.43
201.0221252	0.70
203.0149384	1.25
205.2013092	0.75
207.2167664	0.73
209.2262268	0.58
211.1060791	2.89
214.223938	0.16
215.0384216	1.34
217.3863525	0.85
221.1524963	0.25
223.2051697	1.01
224.9915771	0.28
227.3809814	0.44
228.046875	5.16
229.1309509	5.84
231.3329163	0.64
233.0446472	1.13
235.1925659	0.70
237.2232361	0.67
238.2893066	0.12
241.2015991	1.09
242.6058655	0.68
243.2815857	0.21
244.0666809	0.39
245.3345032	1.60
247.1824036	9.38
248.1693115	0.29
251.2857056	1.67
251.9392395	0.17
253.3091125	0.26
255.2877197	1.50
257.1268311	1.65
259.1742859	1.12
261.1839294	0.44
263.0112305	0.33
264.7887573	0.72
265.9804993	0.31
267.3354187	0.93
271.0819092	0.48
272.1715698	0.12
272.7958679	0.35
277.2897949	0.64
279.1994019	0.33
281.1765747	0.65
283.0461731	0.21
285.3262939	0.33
286.9417725	0.28
287.5500183	0.35
288.6635742	0.50
292.1112976	0.11
295.3158875	2.02
297.1954651	1.05
299.3187256	2.03
301.057373	0.09
303.4579468	0.62
305.2038879	6.48
307.396759	0.38
309.0109863	0.12
309.7563782	0.10
310.3611755	0.28
313.3457642	1.55
314.1907654	0.12
321.367157	0.40
323.2436523	100.00
324.3754272	1.73
332.489502	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
84.82327271	0.05
91.01815033	0.22
92.93650818	0.34
94.85171509	2.16
96.95368958	1.13
99.05836487	0.26
101.039856	0.09
102.9529037	0.10
105.1358032	0.07
107.0243835	0.26
109.0847321	2.61
110.8907013	0.25
113.0362244	0.73
117.2771912	0.04
119.0256882	0.12
121.0566864	1.24
122.9836731	0.91
125.0480499	0.57
127.0626831	1.06
128.7631226	0.18
129.7760925	0.18
132.963623	0.96
135.0669098	1.39
136.9537354	0.94
139.0652466	3.21
141.0553284	0.28
142.1548157	0.07
145.0764771	0.25
146.9693604	0.86
149.1134949	0.60
150.9820862	0.37
152.9878998	1.86
155.0702515	0.68
156.0679016	0.06
157.0286713	0.72
158.9270172	0.24
160.1757202	0.13
161.1666412	0.68
162.8497925	0.26
165.1287842	0.66
167.1549683	1.21
169.0499268	1.65
171.0810242	0.85
172.4118347	0.29
173.1940308	0.26
175.0270386	0.73
176.9241791	0.18
178.9728394	0.32
179.9884796	0.10
181.1617889	0.29
183.104599	2.30
185.1289062	1.04
187.1924438	0.13
189.2965546	0.77
191.1319733	0.53
193.0469055	0.70
195.1921082	0.33
197.0046692	5.24
199.1534424	1.36
201.0285645	0.39
203.3340149	1.50
205.0810547	0.27
207.2095032	0.42
209.1642456	0.92
211.1149597	2.49
213.1999207	1.10
214.8779602	0.09
219.2010498	0.99
221.1860046	3.31
223.156189	1.01
225.1186523	3.16
225.9547119	0.08
227.2424011	1.00
228.7614441	0.13
233.2687378	2.51
234.0024414	0.03
235.2345276	1.00
237.2652893	4.50
239.1115723	11.99
241.186615	0.33
243.2643433	2.55
251.2312622	2.94
252.9526978	1.10
253.8360596	0.06
254.574707	0.27
255.3139954	1.36
256.241394	0.12
257.1999512	0.60
259.4657288	0.22
261.1779785	3.38
263.4660645	0.18
265.1716003	0.05
266.9607849	0.31
268.9355164	0.39
279.229187	100.00
280.3323364	0.64
281.0869141	0.05
281.9847107	0.12
297.2566528	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2498
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
102.8579559	0.08
105.1265869	0.12
106.3452988	0.12
107.0348282	0.79
109.0556793	2.22
110.9188843	0.09
116.8723297	0.19
118.9313507	0.27
120.9543457	3.94
123.021431	1.46
125.0725479	0.23
127.2059402	0.02
129.0359955	0.27
131.0099792	0.06
132.880661	0.74
135.0561218	4.02
137.0466156	0.67
140.0446472	0.02
141.2342224	0.11
142.9865112	0.38
143.8790283	0.02
145.0739441	0.28
146.9171448	2.47
149.0627747	2.11
151.1608887	0.76
153.2092896	0.02
155.0840454	0.09
157.0298767	1.11
159.0553589	0.66
160.9497375	2.41
163.0618896	1.13
165.1846924	0.74
167.1195374	0.16
169.0101013	0.81
171.0126495	0.38
173.0326843	1.05
175.119873	1.93
177.0928345	0.45
179.2275543	0.10
180.4958191	0.03
181.9413605	0.11
183.0641022	0.52
184.978653	0.23
187.2066193	1.49
189.1091919	1.21
191.0986633	0.27
193.0284882	0.02
195.2260895	0.10
196.9665375	0.44
199.1941528	0.34
201.005722	0.22
203.1138	0.78
205.2045746	0.90
209.1348572	0.16
211.054718	0.43
212.0724792	0.03
213.1935425	0.33
214.9916382	0.14
217.1747131	2.13
219.1689453	0.02
220.2075806	0.03
221.0552979	0.04
223.1611023	0.78
225.0921021	0.12
226.2846069	0.09
227.1771545	0.49
228.1200256	0.02
229.1662292	0.37
231.20578	1.95
233.2601318	0.13
235.2497253	0.04
237.8835449	0.02
239.0836792	0.19
241.0054321	0.17
242.0248108	0.02
243.2761536	0.29
245.1932678	2.03
247.2853088	5.89
251.0363159	0.24
251.7110596	0.08
253.0625916	0.15
253.6812744	0.01
255.1640625	0.34
257.1487427	0.39
258.2741699	0.25
259.3638306	0.54
260.1454468	0.04
265.1727905	0.06
267.2098694	0.20
269.3720093	0.05
271.1184998	0.32
273.8055725	0.02
277.3052979	0.24
278.1921997	0.03
278.9710083	0.02
281.1917419	0.21
283.1776123	0.20
285.2244263	0.38
287.3204041	0.36
290.6044312	0.01
292.1017456	0.05
295.2832947	0.66
296.9402466	0.36
298.2710571	0.03
299.2038574	1.60
299.8981628	0.02
301.010376	0.16
303.4354858	0.09
304.1221008	0.06
305.2568665	2.19
306.1930237	0.05
307.47052	0.02
309.3015747	0.09
309.9389648	0.38
312.1504517	0.05
313.2746277	0.35
313.9554443	0.09
314.5978699	0.02
323.232605	100.00
324.3102112	0.27
325.1773682	0.09
331.9133911	0.22
341.1646423	0.95
342.1020508	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	303.02
Annotation	Unknow
Peak:m/z	Relative Intensity
87.9237900	0.88
113.9413376	0.87
114.9792938	2.93
128.0668945	0.14
131.9357452	100.00
132.9437408	0.22
147.8508606	0.07
166.9101868	0.03
171.0086670	0.04
201.1571960	0.23
213.1202393	0.02
219.1505432	0.04
249.2049255	0.07
265.0321655	0.24
266.1370850	0.07
267.0135498	0.05
285.1912842	3.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	722.95
Annotation	Unknow
Peak:m/z	Relative Intensity
211.1206665	0.16
225.2072144	0.03
232.8967285	0.03
236.9508667	0.06
241.0978394	0.40
255.1392670	0.02
259.1838379	0.06
280.2143250	0.12
310.7615356	0.01
313.2922363	0.03
318.8529358	0.03
323.0474548	12.98
323.6859741	0.01
324.7577515	0.05
329.2631836	0.04
343.0684509	2.10
345.1765137	0.02
347.2117004	0.03
350.1431580	0.04
351.3912964	0.03
360.9859619	1.31
369.2168579	0.07
377.2417603	0.01
379.1589355	0.03
382.3934326	0.03
407.2134399	0.04
411.0303955	0.09
424.1837769	0.04
425.1651611	0.77
440.9972534	0.20
443.1156616	5.79
444.9429321	0.02
446.9625854	0.02
450.7015381	1.20
451.3248291	0.09
452.1348267	0.01
453.0911255	0.04
453.8217163	0.04
454.7798462	0.05
458.9773560	1.40
463.3511353	0.02
467.0866699	0.60
470.6180420	0.16
475.2246094	0.02
478.9126587	2.78
479.5147705	0.02
481.0914307	0.97
482.9940796	0.40
497.2092285	0.15
507.0490723	0.03
509.2568359	0.02
524.0567017	0.01
526.6701050	0.02
534.5097656	0.14
543.0379028	0.10
543.9119263	0.41
546.2799683	0.02
548.8024292	8.33
549.8732300	0.03
551.1331177	0.03
552.6630249	0.29
554.7136230	0.92
561.1578369	0.21
563.0082397	0.06
564.9464722	0.04
566.7487183	0.03
567.7102661	0.03
569.1841431	1.56
577.0680542	0.25
582.7752075	0.07
584.5795288	0.20
585.1801147	0.08
586.9738770	100.00
587.7739868	0.62
595.4219360	0.04
602.9711304	1.98
606.0015869	0.06
608.9310303	0.05
610.8599243	0.06
618.9580688	0.13
624.7586060	0.79
625.8765259	0.06
635.7149048	0.37
636.6336060	1.39
638.6130371	6.18
640.5635376	0.08
641.6775513	0.12
642.5766602	0.02
654.7128906	0.15
662.9480591	0.10
672.1663818	0.05
676.1156616	0.05
676.9865112	0.30
680.0815430	0.24
680.9976807	0.37
687.7732544	0.04
702.7938232	0.03
704.9700317	3.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	310.1121
Annotation	O-Acetylneuraminic acid
Peak:m/z	Relative Intensity
98.0065155	0.58
103.9639587	0.10
115.9775696	2.32
117.0713348	0.08
118.0600510	0.96
125.9640656	2.57
129.9539185	69.89
130.8956604	0.11
131.8820648	0.29
133.1693115	0.56
138.0310669	0.31
141.9836426	0.10
144.1871643	0.06
145.2875366	0.22
146.0585938	0.55
148.1740417	0.23
149.1091309	0.27
156.0175629	0.07
162.1040344	0.76
162.9129944	0.98
163.9067078	4.79
167.0401001	1.05
171.1815491	0.22
172.1150360	0.04
175.3535004	0.48
176.1739349	0.11
179.0513916	3.56
179.9194946	1.88
181.0768433	13.85
185.1608429	0.28
192.2155914	0.20
193.1576233	0.33
195.0412598	3.21
197.3096771	0.53
198.1005249	0.12
206.0343933	0.28
207.0429993	0.06
213.1726685	14.48
216.0970154	0.09
217.0832214	0.41
221.0583496	0.45
225.8450623	0.09
233.3413086	0.16
235.0376587	2.26
245.1741943	0.83
248.1723328	0.44
252.1942749	0.10
254.1723328	0.09
255.2449341	0.13
256.2158203	0.09
264.4953613	0.56
265.1525574	0.28
266.4008789	0.40
267.2730713	0.46
268.5033875	0.08
269.1129150	0.16
274.1157227	0.56
275.1109619	0.21
278.6035156	0.14
282.2011719	0.25
291.9848022	100.00
293.0531311	1.64
295.2961121	0.10
301.0843506	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2875
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
127.1786041	5.73
132.8206329	18.58
135.0111389	2.41
139.1246948	4.46
144.919632	2.64
152.9251709	3.65
160.9406891	2.12
173.2414856	1.70
179.3120117	6.37
180.7073364	1.68
183.094635	9.51
189.1289673	2.87
191.0801697	3.64
193.0497131	2.87
195.1789246	2.98
213.8216248	2.40
221.1365509	5.33
229.3347168	1.83
235.3449707	4.65
241.0467834	7.78
247.3535767	18.88
248.1808167	2.32
257.0431824	4.89
263.396698	7.85
267.2514648	9.72
275.1375732	2.55
280.545166	4.60
281.3389282	5.29
294.3177185	1.54
313.7973633	1.68
314.4596558	6.33
326.2424927	2.26
328.1658325	3.04
333.2398071	2.69
339.3039551	11.33
341.0215454	4.49
342.0727539	14.68
352.0012817	1.40
356.8111267	8.89
358.8440552	6.10
365.4293823	6.33
366.2576599	23.88
367.4725647	15.51
369.249176	2.12
373.1885071	1.11
377.1535645	13.44
378.9761658	2.94
380.2605591	9.19
384.2437134	2.98
385.066864	6.11
389.5418396	1.39
391.243866	9.37
395.2843933	11.56
408.2765503	100.00
409.2603149	3.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	492.1877
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0151978	0.45
146.9138489	13.14
149.0376587	0.71
166.0567932	100.00
166.8807983	0.17
169.3973236	0.17
172.2491760	0.70
172.8885956	0.21
177.0460205	0.11
178.8658752	0.08
180.2984314	0.45
183.0311890	0.60
195.1169434	1.71
197.1011658	0.24
209.0989685	0.31
225.0066528	1.17
228.1611023	0.11
243.0324097	6.68
246.4202881	0.10
252.3788757	0.07
260.3690491	1.90
261.0244751	15.55
273.1016846	0.68
290.9926453	1.32
307.9233398	0.56
309.0008240	1.37
313.4185791	0.07
314.1607666	0.14
327.4573975	0.06
330.5383606	0.11
346.0159302	0.22
426.2051697	21.35
444.4804077	0.06
447.3169556	0.11
473.4197388	6.58
474.0939331	60.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.1812
Annotation	Unknow
Peak:m/z	Relative Intensity
203.4002991	0.06
259.0253906	0.04
284.0140686	0.26
323.0644531	0.07
330.1463013	0.31
376.1463623	0.05
384.3681030	0.08
417.3672485	0.04
421.2943115	0.10
432.1196289	0.05
461.1644897	100.00
462.1908569	0.33
463.2135620	0.56
467.1360474	0.07
487.4072876	0.03
503.2786255	0.05
519.5587158	0.04
534.9608154	0.08
540.5911255	0.05
545.2650757	0.08
550.3937988	0.03
558.7824097	0.05
567.3958740	0.07
569.0839844	0.07
575.6204834	0.10
618.9209595	0.12
621.1577148	0.47
623.5732422	0.04
633.5164795	0.04
642.6406860	0.34
648.4110107	0.24
655.3663940	0.12
656.3848267	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.1143
Annotation	Tyrosyl-Threonine
Peak:m/z	Relative Intensity
81.9271774	0.03
84.1220169	0.02
92.8328476	0.05
100.7775879	0.04
108.9922180	1.78
113.2629318	0.03
117.1847458	0.12
119.0527496	0.25
121.0182877	1.20
122.0088501	0.03
126.0009460	0.10
127.0237350	10.22
128.0158081	1.66
144.9905701	100.00
152.0493774	0.04
156.7852020	0.09
176.9905396	0.06
179.2335205	0.07
191.1807556	0.04
203.1932678	0.02
218.0123901	0.04
220.9420166	0.03
235.1355286	0.21
237.0414734	0.03
239.9372253	0.03
245.0284424	0.07
249.2828369	0.14
253.3917847	0.06
263.1394958	3.09
264.9724426	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.2499
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0559464	0.10
106.9736023	2.21
108.9521408	1.91
109.8842316	0.04
110.9797668	0.28
112.9828568	0.05
113.8686981	0.27
114.893837	0.26
117.0177917	0.56
119.2087021	0.18
120.9303894	3.74
122.8925476	0.54
123.7812881	0.05
125.0178375	0.42
129.1236267	0.14
130.9842529	0.71
133.0812378	0.56
135.0523071	3.40
137.0475464	0.24
139.0231934	0.12
141.0519257	0.10
142.9541626	2.62
144.8510132	0.23
146.9636383	0.84
149.028244	1.80
151.1894226	0.46
151.9571838	1.36
153.0058289	0.10
154.9567566	0.22
157.040863	3.57
158.9937439	1.28
161.1152191	0.52
163.0823975	0.05
163.874176	0.05
165.0535431	2.25
166.0678101	0.31
167.0409546	1.67
168.9989014	3.81
171.043808	0.26
173.043396	5.24
173.9532623	0.03
175.005127	0.73
177.0812073	0.58
179.1269836	0.54
181.2180176	0.29
183.0667725	1.93
184.0605164	0.12
184.9950256	0.76
187.094986	2.38
188.8745728	0.31
191.1933136	0.14
193.1889801	0.93
197.0499878	1.35
199.0615692	0.12
200.9899292	0.29
202.2165833	0.30
203.2796936	0.35
205.1622009	1.00
207.2982178	0.21
209.111969	0.34
210.9217529	1.75
215.0946655	1.25
216.1680908	0.12
217.2236938	0.69
218.1642456	0.17
219.0565186	0.15
221.3742371	0.03
222.1003723	0.03
223.1904297	1.67
224.9611206	0.12
228.0130005	4.40
229.1027832	7.94
230.0975342	1.00
231.3146667	0.20
233.1022949	0.98
234.2146606	0.05
234.98349	0.17
235.5893555	0.11
241.09552	0.32
243.1790161	0.90
244.4044189	0.42
245.1730042	1.41
247.1597595	7.91
248.0684509	1.01
249.3097534	0.18
251.2133179	0.88
253.1265869	0.26
255.0510254	0.33
257.2611389	0.15
258.1835632	0.05
259.0822144	0.46
261.0439453	0.12
262.0688477	0.12
263.1578369	0.21
265.2038574	0.99
265.9673462	0.30
267.1236877	0.42
268.7040405	0.12
271.3321533	0.25
273.2731628	0.29
277.4650269	0.75
279.1660156	0.09
282.6430359	0.15
285.2367249	0.30
287.326416	0.14
288.3096313	0.12
292.5172729	0.06
293.4271851	0.13
295.2200623	2.54
296.2644958	0.56
297.1508789	0.65
298.1788635	0.20
299.3024292	1.64
300.2271118	0.51
301.3637085	0.18
303.2043152	0.42
305.3347473	5.16
306.2124634	0.05
313.2984619	1.38
323.2287292	100.00
324.334198	1.29
325.189209	0.25
326.2886963	0.18
341.0326233	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
84.8728714	0.24
90.7335968	0.41
93.0483551	0.29
94.96535492	2.01
97.06785583	0.54
99.02764893	0.34
102.8322601	0.12
104.984024	0.29
107.0000687	0.63
109.0561829	2.05
111.0014877	0.50
113.0586472	0.51
114.9974823	0.17
118.9801483	0.21
119.8889923	0.11
121.1438904	1.57
123.0686798	2.27
124.0783234	0.08
124.9260025	0.68
126.5232697	0.21
128.9088593	0.04
130.8820801	0.09
132.7524872	0.54
133.4727783	0.19
135.0218506	1.19
137.0717621	1.58
138.9119568	3.21
140.8771057	0.36
143.3528748	0.27
145.0999451	0.08
146.2913361	0.06
147.059906	1.10
149.0386963	1.34
150.9680939	0.31
153.0266876	2.05
155.0089111	1.19
157.2608337	0.05
159.1433868	0.15
160.9966888	0.87
162.9752655	0.60
165.0772095	0.23
167.125	0.48
169.0614929	0.85
171.1338501	0.24
173.0906372	0.92
175.2246094	0.60
176.6257629	0.19
177.2585297	0.34
179.2162781	1.00
181.173111	0.77
181.9331818	0.10
183.0858002	3.19
185.0208435	0.55
187.2739868	0.41
189.0546722	0.88
191.3920898	0.10
193.092041	0.81
194.5117645	0.05
195.1569824	0.47
197.1204224	4.67
199.020874	1.24
201.1716309	0.26
203.1627808	2.11
205.1214294	0.09
207.0803223	0.62
209.3210754	1.17
211.057251	2.72
213.1965332	0.66
215.0366516	0.35
219.1743469	1.19
221.1757202	3.45
223.2121277	1.07
225.1724548	2.72
225.9804077	0.10
227.2141113	1.00
228.9416199	0.42
233.2088318	0.94
234.9784546	0.85
237.2259827	4.65
239.1680298	9.72
241.3500671	1.20
243.1246643	2.02
251.2939758	2.69
252.1538086	0.19
253.2985229	0.41
255.1499634	1.34
255.9475708	0.58
257.0083008	0.81
261.1749878	4.44
261.8950195	0.13
263.4845581	0.13
265.2938843	0.14
267.9391479	0.15
276.184906	0.23
277.2244263	0.23
279.229248	100.00
280.2424927	0.55
281.1951599	0.05
287.3746338	0.11
288.3310547	0.40
297.2059937	0.24
298.3916016	0.06
END