vgo_51_formula

id	C	H	O	N	S	DBE	molecular_weight	mass fraction_wtpct	compound type
1	17	36	0	0	0	0	240.288	0.041163	Saturates
2	18	38	0	0	0	0	254.304	0.080223	Saturates
3	19	40	0	0	0	0	268.32	0.134466	Saturates
4	20	42	0	0	0	0	282.336	0.189034	Saturates
5	21	44	0	0	0	0	296.352	0.281913	Saturates
6	22	46	0	0	0	0	310.368	0.371914	Saturates
7	23	48	0	0	0	0	324.384	0.4753	Saturates
8	24	50	0	0	0	0	338.4	0.588255	Saturates
9	25	52	0	0	0	0	352.416	0.606193	Saturates
10	26	54	0	0	0	0	366.432	0.612822	Saturates
11	27	56	0	0	0	0	380.448	0.641288	Saturates
12	28	58	0	0	0	0	394.464	0.675184	Saturates
13	29	60	0	0	0	0	408.48	0.61719	Saturates
14	30	62	0	0	0	0	422.496	0.660607	Saturates
15	31	64	0	0	0	0	436.512	0.703752	Saturates
16	32	66	0	0	0	0	450.528	0.644202	Saturates
17	33	68	0	0	0	0	464.544	0.622658	Saturates
18	34	70	0	0	0	0	478.56	0.627756	Saturates
19	35	72	0	0	0	0	492.576	0.6185	Saturates
20	36	74	0	0	0	0	506.592	0.605932	Saturates
21	37	76	0	0	0	0	520.608	0.623537	Saturates
22	38	78	0	0	0	0	534.624	0.569648	Saturates
23	39	80	0	0	0	0	548.64	0.471074	Saturates
24	40	82	0	0	0	0	562.656	0.385174	Saturates
25	41	84	0	0	0	0	576.672	0.35656	Saturates
26	42	86	0	0	0	0	590.688	0.401758	Saturates
27	43	88	0	0	0	0	604.704	0.308994	Saturates
28	44	90	0	0	0	0	618.72	0.354717	Saturates
29	45	92	0	0	0	0	632.736	0.290185	Saturates
30	46	94	0	0	0	0	646.752	0.234643	Saturates
31	47	96	0	0	0	0	660.768	0.228971	Saturates
32	17	34	0	0	0	1	238.272	0.01896	Saturates
33	18	36	0	0	0	1	252.288	0.03419	Saturates
34	19	38	0	0	0	1	266.304	0.059168	Saturates
35	20	40	0	0	0	1	280.32	0.072379	Saturates
36	21	42	0	0	0	1	294.336	0.087299	Saturates
37	22	44	0	0	0	1	308.352	0.121102	Saturates
38	23	46	0	0	0	1	322.368	0.146311	Saturates
39	24	48	0	0	0	1	336.384	0.169923	Saturates
40	25	50	0	0	0	1	350.4	0.194518	Saturates
41	26	52	0	0	0	1	364.416	0.198271	Saturates
42	27	54	0	0	0	1	378.432	0.213572	Saturates
43	28	56	0	0	0	1	392.448	0.225904	Saturates
44	29	58	0	0	0	1	406.464	0.236115	Saturates
45	30	60	0	0	0	1	420.48	0.248129	Saturates
46	31	62	0	0	0	1	434.496	0.24892	Saturates
47	32	64	0	0	0	1	448.512	0.262363	Saturates
48	33	66	0	0	0	1	462.528	0.274703	Saturates
49	34	68	0	0	0	1	476.544	0.271492	Saturates
50	35	70	0	0	0	1	490.56	0.275223	Saturates
51	36	72	0	0	0	1	504.576	0.273253	Saturates
52	37	74	0	0	0	1	518.592	0.286894	Saturates
53	38	76	0	0	0	1	532.608	0.270694	Saturates
54	39	78	0	0	0	1	546.624	0.288423	Saturates
55	40	80	0	0	0	1	560.64	0.280841	Saturates
56	41	82	0	0	0	1	574.656	0.284046	Saturates
57	42	84	0	0	0	1	588.672	0.269637	Saturates
58	43	86	0	0	0	1	602.688	0.241866	Saturates
59	44	88	0	0	0	1	616.704	0.245274	Saturates
60	45	90	0	0	0	1	630.72	0.236246	Saturates
61	46	92	0	0	0	1	644.736	0.218725	Saturates
62	47	94	0	0	0	1	658.752	9.04684	Saturates
63	48	96	0	0	0	1	672.768	0.168212	Saturates
64	49	98	0	0	0	1	686.784	0.136597	Saturates
65	20	38	0	0	0	2	278.304	0.06264	Saturates
66	21	40	0	0	0	2	292.32	0.054997	Saturates
67	22	42	0	0	0	2	306.336	0.097645	Saturates
68	23	44	0	0	0	2	320.352	0.137917	Saturates
69	24	46	0	0	0	2	334.368	0.179442	Saturates
70	25	48	0	0	0	2	348.384	0.192936	Saturates
71	26	50	0	0	0	2	362.4	0.189402	Saturates
72	27	52	0	0	0	2	376.416	0.230891	Saturates
73	28	54	0	0	0	2	390.432	0.266277	Saturates
74	29	56	0	0	0	2	404.448	0.218648	Saturates
75	30	58	0	0	0	2	418.464	0.244487	Saturates
76	31	60	0	0	0	2	432.48	0.272156	Saturates
77	32	62	0	0	0	2	446.496	0.296758	Saturates
78	33	64	0	0	0	2	460.512	0.262203	Saturates
79	34	66	0	0	0	2	474.528	0.292774	Saturates
80	35	68	0	0	0	2	488.544	0.281564	Saturates
81	36	70	0	0	0	2	502.56	0.327971	Saturates
82	37	72	0	0	0	2	516.576	0.281215	Saturates
83	38	74	0	0	0	2	530.592	0.272737	Saturates
84	39	76	0	0	0	2	544.608	0.269171	Saturates
85	40	78	0	0	0	2	558.624	0.32415	Saturates
86	41	80	0	0	0	2	572.64	0.321384	Saturates
87	42	82	0	0	0	2	586.656	0.355919	Saturates
88	43	84	0	0	0	2	600.672	0.307335	Saturates
89	44	86	0	0	0	2	614.688	0.373224	Saturates
90	45	88	0	0	0	2	628.704	0.336681	Saturates
91	46	90	0	0	0	2	642.72	0.308781	Saturates
92	47	92	0	0	0	2	656.736	0.318915	Saturates
93	48	94	0	0	0	2	670.752	0.325721	Saturates
94	49	96	0	0	0	2	684.768	0.265479	Saturates
95	50	98	0	0	0	2	698.784	0.252374	Saturates
96	23	42	0	0	0	3	318.336	0.071811	Saturates
97	24	44	0	0	0	3	332.352	0.069182	Saturates
98	25	46	0	0	0	3	346.368	0.074527	Saturates
99	26	48	0	0	0	3	360.384	0.099952	Saturates
100	27	50	0	0	0	3	374.4	0.092989	Saturates
101	28	52	0	0	0	3	388.416	0.099192	Saturates
102	29	54	0	0	0	3	402.432	0.121859	Saturates
103	30	56	0	0	0	3	416.448	0.14607	Saturates
104	31	58	0	0	0	3	430.464	0.169931	Saturates
105	32	60	0	0	0	3	444.48	0.154035	Saturates
106	33	62	0	0	0	3	458.496	0.189914	Saturates
107	34	64	0	0	0	3	472.512	0.178393	Saturates
108	35	66	0	0	0	3	486.528	0.182028	Saturates
109	36	68	0	0	0	3	500.544	0.168402	Saturates
110	37	70	0	0	0	3	514.56	0.162726	Saturates
111	38	72	0	0	0	3	528.576	0.176112	Saturates
112	39	74	0	0	0	3	542.592	0.197291	Saturates
113	40	76	0	0	0	3	556.608	0.147635	Saturates
114	41	78	0	0	0	3	570.624	0.15773	Saturates
115	42	80	0	0	0	3	584.64	0.177839	Saturates
116	43	82	0	0	0	3	598.656	0.184578	Saturates
117	44	84	0	0	0	3	612.672	0.216698	Saturates
118	45	86	0	0	0	3	626.688	0.210945	Saturates
119	46	88	0	0	0	3	640.704	0.230922	Saturates
120	47	90	0	0	0	3	654.72	0.197938	Saturates
121	48	92	0	0	0	3	668.736	0.207329	Saturates
122	49	94	0	0	0	3	682.752	0.181706	Saturates
123	50	96	0	0	0	3	696.768	0.195573	Saturates
124	27	48	0	0	0	4	372.384	0.022964	Saturates
125	28	50	0	0	0	4	386.4	0.038168	Saturates
126	29	52	0	0	0	4	400.416	0.040433	Saturates
127	30	54	0	0	0	4	414.432	0.048378	Saturates
128	31	56	0	0	0	4	428.448	0.087548	Saturates
129	32	58	0	0	0	4	442.464	0.102243	Saturates
130	33	60	0	0	0	4	456.48	0.131899	Saturates
131	34	62	0	0	0	4	470.496	0.118186	Saturates
132	35	64	0	0	0	4	484.512	0.091905	Saturates
133	36	66	0	0	0	4	498.528	0.062137	Saturates
134	37	68	0	0	0	4	512.544	0.062063	Saturates
135	38	70	0	0	0	4	526.56	0.067761	Saturates
136	39	72	0	0	0	4	540.576	0.069614	Saturates
137	40	74	0	0	0	4	554.592	0.057503	Saturates
138	41	76	0	0	0	4	568.608	0.058956	Saturates
139	42	78	0	0	0	4	582.624	0.053923	Saturates
140	43	80	0	0	0	4	596.64	0.056452	Saturates
141	44	82	0	0	0	4	610.656	0.073744	Saturates
142	45	84	0	0	0	4	624.672	0.075436	Saturates
143	46	86	0	0	0	4	638.688	0.08574	Saturates
144	47	88	0	0	0	4	652.704	1.6921	Saturates
145	48	90	0	0	0	4	666.72	0.056206	Saturates
146	49	92	0	0	0	4	680.736	0.07423	Saturates
147	31	54	0	0	0	5	426.432	0.004718	Saturates
148	32	56	0	0	0	5	440.448	0.003343	Saturates
149	33	58	0	0	0	5	454.464	0.008552	Saturates
150	34	60	0	0	0	5	468.48	0.008683	Saturates
151	35	62	0	0	0	5	482.496	0.008332	Saturates
152	36	64	0	0	0	5	496.512	0.006308	Saturates
153	37	66	0	0	0	5	510.528	0.007751	Saturates
154	38	68	0	0	0	5	524.544	0.007204	Saturates
155	16	26	0	0	0	4	218.208	0.034563	Aromatics
156	17	28	0	0	0	4	232.224	0.064577	Aromatics
157	18	30	0	0	0	4	246.24	0.093011	Aromatics
158	19	32	0	0	0	4	260.256	0.120452	Aromatics
159	20	34	0	0	0	4	274.272	0.148665	Aromatics
160	21	36	0	0	0	4	288.288	0.208795	Aromatics
161	22	38	0	0	0	4	302.304	0.245385	Aromatics
162	23	40	0	0	0	4	316.32	0.302918	Aromatics
163	24	42	0	0	0	4	330.336	0.328205	Aromatics
164	25	44	0	0	0	4	344.352	0.370819	Aromatics
165	26	46	0	0	0	4	358.368	0.421427	Aromatics
166	27	48	0	0	0	4	372.384	0.412583	Aromatics
167	28	50	0	0	0	4	386.4	0.450431	Aromatics
168	29	52	0	0	0	4	400.416	0.437127	Aromatics
169	30	54	0	0	0	4	414.432	0.443158	Aromatics
170	31	56	0	0	0	4	428.448	0.462042	Aromatics
171	32	58	0	0	0	4	442.464	0.4448	Aromatics
172	33	60	0	0	0	4	456.48	0.373233	Aromatics
173	34	62	0	0	0	4	470.496	0.356956	Aromatics
174	35	64	0	0	0	4	484.512	0.354338	Aromatics
175	36	66	0	0	0	4	498.528	0.27677	Aromatics
176	37	68	0	0	0	4	512.544	0.287731	Aromatics
177	38	70	0	0	0	4	526.56	0.30549	Aromatics
178	39	72	0	0	0	4	540.576	0.262163	Aromatics
179	40	74	0	0	0	4	554.592	0.248899	Aromatics
180	41	76	0	0	0	4	568.608	0.210573	Aromatics
181	42	78	0	0	0	4	582.624	0.185498	Aromatics
182	43	80	0	0	0	4	596.64	0.181167	Aromatics
183	44	82	0	0	0	4	610.656	0.160739	Aromatics
184	16	24	0	0	0	5	216.192	0.030106	Aromatics
185	17	26	0	0	0	5	230.208	0.068342	Aromatics
186	18	28	0	0	0	5	244.224	0.072699	Aromatics
187	19	30	0	0	0	5	258.24	0.103926	Aromatics
188	20	32	0	0	0	5	272.256	0.106925	Aromatics
189	21	34	0	0	0	5	286.272	0.10817	Aromatics
190	22	36	0	0	0	5	300.288	0.128067	Aromatics
191	23	38	0	0	0	5	314.304	0.173714	Aromatics
192	24	40	0	0	0	5	328.32	0.212454	Aromatics
193	25	42	0	0	0	5	342.336	0.216711	Aromatics
194	26	44	0	0	0	5	356.352	0.223322	Aromatics
195	27	46	0	0	0	5	370.368	0.256206	Aromatics
196	28	48	0	0	0	5	384.384	0.265096	Aromatics
197	29	50	0	0	0	5	398.4	0.263059	Aromatics
198	30	52	0	0	0	5	412.416	0.289984	Aromatics
199	31	54	0	0	0	5	426.432	0.281362	Aromatics
200	32	56	0	0	0	5	440.448	0.273003	Aromatics
201	33	58	0	0	0	5	454.464	0.271817	Aromatics
202	34	60	0	0	0	5	468.48	0.259798	Aromatics
203	35	62	0	0	0	5	482.496	0.239265	Aromatics
204	36	64	0	0	0	5	496.512	0.221317	Aromatics
205	37	66	0	0	0	5	510.528	0.208937	Aromatics
206	38	68	0	0	0	5	524.544	0.210183	Aromatics
207	39	70	0	0	0	5	538.56	0.177044	Aromatics
208	40	72	0	0	0	5	552.576	0.196167	Aromatics
209	41	74	0	0	0	5	566.592	0.175662	Aromatics
210	42	76	0	0	0	5	580.608	0.165904	Aromatics
211	43	78	0	0	0	5	594.624	0.163512	Aromatics
212	18	26	0	0	0	6	242.208	0.041716	Aromatics
213	19	28	0	0	0	6	256.224	0.061777	Aromatics
214	20	30	0	0	0	6	270.24	0.098557	Aromatics
215	21	32	0	0	0	6	284.256	0.119396	Aromatics
216	22	34	0	0	0	6	298.272	0.147523	Aromatics
217	23	36	0	0	0	6	312.288	0.148352	Aromatics
218	24	38	0	0	0	6	326.304	0.141762	Aromatics
219	25	40	0	0	0	6	340.32	0.169462	Aromatics
220	26	42	0	0	0	6	354.336	0.183754	Aromatics
221	27	44	0	0	0	6	368.352	0.188006	Aromatics
222	28	46	0	0	0	6	382.368	0.209993	Aromatics
223	29	48	0	0	0	6	396.384	0.25187	Aromatics
224	30	50	0	0	0	6	410.4	0.246054	Aromatics
225	31	52	0	0	0	6	424.416	0.267557	Aromatics
226	32	54	0	0	0	6	438.432	0.25972	Aromatics
227	33	56	0	0	0	6	452.448	0.268267	Aromatics
228	34	58	0	0	0	6	466.464	0.230344	Aromatics
229	35	60	0	0	0	6	480.48	0.21231	Aromatics
230	36	62	0	0	0	6	494.496	0.196741	Aromatics
231	37	64	0	0	0	6	508.512	0.180221	Aromatics
232	38	66	0	0	0	6	522.528	0.185188	Aromatics
233	39	68	0	0	0	6	536.544	0.168968	Aromatics
234	40	70	0	0	0	6	550.56	0.122385	Aromatics
235	41	72	0	0	0	6	564.576	0.132716	Aromatics
236	15	18	0	0	0	7	198.144	0.02445	Aromatics
237	16	20	0	0	0	7	212.16	0.097845	Aromatics
238	17	22	0	0	0	7	226.176	0.163568	Aromatics
239	18	24	0	0	0	7	240.192	0.155206	Aromatics
240	19	26	0	0	0	7	254.208	0.123058	Aromatics
241	20	28	0	0	0	7	268.224	0.102261	Aromatics
242	21	30	0	0	0	7	282.24	0.107934	Aromatics
243	22	32	0	0	0	7	296.256	0.094705	Aromatics
244	23	34	0	0	0	7	310.272	0.102354	Aromatics
245	24	36	0	0	0	7	324.288	0.103081	Aromatics
246	25	38	0	0	0	7	338.304	0.113211	Aromatics
247	26	40	0	0	0	7	352.32	0.126094	Aromatics
248	27	42	0	0	0	7	366.336	0.135714	Aromatics
249	28	44	0	0	0	7	380.352	0.13747	Aromatics
250	29	46	0	0	0	7	394.368	0.140348	Aromatics
251	30	48	0	0	0	7	408.384	0.149204	Aromatics
252	31	50	0	0	0	7	422.4	0.152692	Aromatics
253	32	52	0	0	0	7	436.416	0.178671	Aromatics
254	33	54	0	0	0	7	450.432	0.1853	Aromatics
255	34	56	0	0	0	7	464.448	0.142059	Aromatics
256	35	58	0	0	0	7	478.464	0.113512	Aromatics
257	36	60	0	0	0	7	492.48	0.092618	Aromatics
258	37	62	0	0	0	7	506.496	0.107013	Aromatics
259	38	64	0	0	0	7	520.512	0.08079	Aromatics
260	39	66	0	0	0	7	534.528	0.082965	Aromatics
261	40	68	0	0	0	7	548.544	0.092345	Aromatics
262	41	70	0	0	0	7	562.56	0.087873	Aromatics
263	18	22	0	0	0	8	238.176	0.032864	Aromatics
264	19	24	0	0	0	8	252.192	0.072178	Aromatics
265	20	26	0	0	0	8	266.208	0.103185	Aromatics
266	21	28	0	0	0	8	280.224	0.137316	Aromatics
267	22	30	0	0	0	8	294.24	0.116317	Aromatics
268	23	32	0	0	0	8	308.256	0.091564	Aromatics
269	24	34	0	0	0	8	322.272	0.098651	Aromatics
270	25	36	0	0	0	8	336.288	0.090765	Aromatics
271	26	38	0	0	0	8	350.304	0.099252	Aromatics
272	27	40	0	0	0	8	364.32	0.085219	Aromatics
273	28	42	0	0	0	8	378.336	0.127719	Aromatics
274	29	44	0	0	0	8	392.352	0.111938	Aromatics
275	30	46	0	0	0	8	406.368	0.117653	Aromatics
276	31	48	0	0	0	8	420.384	0.108935	Aromatics
277	32	50	0	0	0	8	434.4	0.110264	Aromatics
278	33	52	0	0	0	8	448.416	0.10117	Aromatics
279	34	54	0	0	0	8	462.432	0.09664	Aromatics
280	35	56	0	0	0	8	476.448	0.096162	Aromatics
281	36	58	0	0	0	8	490.464	0.098991	Aromatics
282	37	60	0	0	0	8	504.48	0.063811	Aromatics
283	38	62	0	0	0	8	518.496	0.054395	Aromatics
284	39	64	0	0	0	8	532.512	0.049295	Aromatics
285	18	20	0	0	0	9	236.16	0.018526	Aromatics
286	19	22	0	0	0	9	250.176	0.041848	Aromatics
287	20	24	0	0	0	9	264.192	0.074432	Aromatics
288	21	26	0	0	0	9	278.208	0.08577	Aromatics
289	22	28	0	0	0	9	292.224	0.088685	Aromatics
290	23	30	0	0	0	9	306.24	0.087639	Aromatics
291	24	32	0	0	0	9	320.256	0.105594	Aromatics
292	25	34	0	0	0	9	334.272	0.120515	Aromatics
293	26	36	0	0	0	9	348.288	0.103713	Aromatics
294	27	38	0	0	0	9	362.304	0.109082	Aromatics
295	28	40	0	0	0	9	376.32	0.099035	Aromatics
296	29	42	0	0	0	9	390.336	0.088437	Aromatics
297	30	44	0	0	0	9	404.352	0.104463	Aromatics
298	31	46	0	0	0	9	418.368	0.084712	Aromatics
299	32	48	0	0	0	9	432.384	0.106375	Aromatics
300	33	50	0	0	0	9	446.4	0.087681	Aromatics
301	34	52	0	0	0	9	460.416	0.048224	Aromatics
302	35	54	0	0	0	9	474.432	0.066099	Aromatics
303	36	56	0	0	0	9	488.448	0.089512	Aromatics
304	37	58	0	0	0	9	502.464	0.057508	Aromatics
305	38	60	0	0	0	9	516.48	0.059112	Aromatics
306	39	62	0	0	0	9	530.496	0.052026	Aromatics
307	40	64	0	0	0	9	544.512	0.06409	Aromatics
308	19	20	0	0	0	10	248.16	0.032449	Aromatics
309	20	22	0	0	0	10	262.176	0.076511	Aromatics
310	21	24	0	0	0	10	276.192	0.086793	Aromatics
311	22	26	0	0	0	10	290.208	0.071827	Aromatics
312	23	28	0	0	0	10	304.224	0.05894	Aromatics
313	24	30	0	0	0	10	318.24	0.057663	Aromatics
314	25	32	0	0	0	10	332.256	0.061195	Aromatics
315	26	34	0	0	0	10	346.272	0.061407	Aromatics
316	27	36	0	0	0	10	360.288	0.060264	Aromatics
317	28	38	0	0	0	10	374.304	0.079259	Aromatics
318	29	40	0	0	0	10	388.32	0.067979	Aromatics
319	30	42	0	0	0	10	402.336	0.071474	Aromatics
320	31	44	0	0	0	10	416.352	0.063668	Aromatics
321	32	46	0	0	0	10	430.368	0.069491	Aromatics
322	33	48	0	0	0	10	444.384	0.054389	Aromatics
323	34	50	0	0	0	10	458.4	0.063265	Aromatics
324	35	52	0	0	0	10	472.416	0.063952	Aromatics
325	36	54	0	0	0	10	486.432	0.039254	Aromatics
326	17	14	0	0	0	11	218.112	0.01472	Aromatics
327	18	16	0	0	0	11	232.128	0.037844	Aromatics
328	19	18	0	0	0	11	246.144	0.058129	Aromatics
329	20	20	0	0	0	11	260.16	0.064303	Aromatics
330	21	22	0	0	0	11	274.176	0.085435	Aromatics
331	22	24	0	0	0	11	288.192	0.125739	Aromatics
332	23	26	0	0	0	11	302.208	0.143864	Aromatics
333	24	28	0	0	0	11	316.224	0.175008	Aromatics
334	25	30	0	0	0	11	330.24	0.182789	Aromatics
335	26	32	0	0	0	11	344.256	0.186555	Aromatics
336	27	34	0	0	0	11	358.272	0.202091	Aromatics
337	28	36	0	0	0	11	372.288	0.204743	Aromatics
338	29	38	0	0	0	11	386.304	0.20773	Aromatics
339	30	40	0	0	0	11	400.32	0.203329	Aromatics
340	31	42	0	0	0	11	414.336	0.216112	Aromatics
341	32	44	0	0	0	11	428.352	0.202385	Aromatics
342	33	46	0	0	0	11	442.368	0.207425	Aromatics
343	34	48	0	0	0	11	456.384	0.157128	Aromatics
344	35	50	0	0	0	11	470.4	0.152695	Aromatics
345	36	52	0	0	0	11	484.416	0.122914	Aromatics
346	37	54	0	0	0	11	498.432	0.139768	Aromatics
347	38	56	0	0	0	11	512.448	0.121839	Aromatics
348	39	58	0	0	0	11	526.464	0.127751	Aromatics
349	40	60	0	0	0	11	540.48	0.09312	Aromatics
350	41	62	0	0	0	11	554.496	0.08923	Aromatics
351	42	64	0	0	0	11	568.512	0.071276	Aromatics
352	43	66	0	0	0	11	582.528	0.055171	Aromatics
353	44	68	0	0	0	11	596.544	0.048541	Aromatics
354	21	20	0	0	0	12	272.16	0.005714	Aromatics
355	22	22	0	0	0	12	286.176	0.011439	Aromatics
356	23	24	0	0	0	12	300.192	0.019221	Aromatics
357	24	26	0	0	0	12	314.208	0.02159	Aromatics
358	25	28	0	0	0	12	328.224	0.020807	Aromatics
359	26	30	0	0	0	12	342.24	0.022501	Aromatics
360	27	32	0	0	0	12	356.256	0.023374	Aromatics
361	28	34	0	0	0	12	370.272	0.02493	Aromatics
362	29	36	0	0	0	12	384.288	0.0226	Aromatics
363	30	38	0	0	0	12	398.304	0.025353	Aromatics
364	31	40	0	0	0	12	412.32	0.023866	Aromatics
365	32	42	0	0	0	12	426.336	0.022191	Aromatics
366	33	44	0	0	0	12	440.352	0.023977	Aromatics
367	34	46	0	0	0	12	454.368	0.018734	Aromatics
368	35	48	0	0	0	12	468.384	0.018364	Aromatics
369	36	50	0	0	0	12	482.4	0.018836	Aromatics
370	37	52	0	0	0	12	496.416	0.017084	Aromatics
371	38	54	0	0	0	12	510.432	0.013263	Aromatics
372	39	56	0	0	0	12	524.448	0.012554	Aromatics
373	40	58	0	0	0	12	538.464	0.014564	Aromatics
374	41	60	0	0	0	12	552.48	0.011555	Aromatics
375	42	62	0	0	0	12	566.496	0.010844	Aromatics
376	22	20	0	0	0	13	284.16	0.001768	Aromatics
377	23	22	0	0	0	13	298.176	0.003487	Aromatics
378	24	24	0	0	0	13	312.192	0.003576	Aromatics
379	25	26	0	0	0	13	326.208	0.005027	Aromatics
380	26	28	0	0	0	13	340.224	0.004893	Aromatics
381	27	30	0	0	0	13	354.24	0.006047	Aromatics
382	28	32	0	0	0	13	368.256	0.007736	Aromatics
383	29	34	0	0	0	13	382.272	0.006931	Aromatics
384	30	36	0	0	0	13	396.288	0.006685	Aromatics
385	31	38	0	0	0	13	410.304	0.005899	Aromatics
386	32	40	0	0	0	13	424.32	0.006101	Aromatics
387	33	42	0	0	0	13	438.336	0.005827	Aromatics
388	34	44	0	0	0	13	452.352	0.005521	Aromatics
389	35	46	0	0	0	13	466.368	0.003866	Aromatics
390	36	48	0	0	0	13	480.384	0.005533	Aromatics
391	37	50	0	0	0	13	494.4	0.005335	Aromatics
392	20	14	0	0	0	14	254.112	0.0794	Aromatics
393	21	16	0	0	0	14	268.128	0.167772	Aromatics
394	22	18	0	0	0	14	282.144	0.212552	Aromatics
395	23	20	0	0	0	14	296.16	0.189068	Aromatics
396	24	22	0	0	0	14	310.176	0.141356	Aromatics
397	25	24	0	0	0	14	324.192	0.118763	Aromatics
398	26	26	0	0	0	14	338.208	0.111907	Aromatics
399	27	28	0	0	0	14	352.224	0.10122	Aromatics
400	28	30	0	0	0	14	366.24	0.104143	Aromatics
401	29	32	0	0	0	14	380.256	0.103729	Aromatics
402	30	34	0	0	0	14	394.272	0.090488	Aromatics
403	31	36	0	0	0	14	408.288	0.080416	Aromatics
404	32	38	0	0	0	14	422.304	0.094248	Aromatics
405	33	40	0	0	0	14	436.32	0.063277	Aromatics
406	34	42	0	0	0	14	450.336	0.057944	Aromatics
407	35	44	0	0	0	14	464.352	0.060395	Aromatics
408	36	46	0	0	0	14	478.368	0.058489	Aromatics
409	37	48	0	0	0	14	492.384	0.047378	Aromatics
410	38	50	0	0	0	14	506.4	0.03881	Aromatics
411	36	69	1	1	0	3	531.562	2.8e-05	Neutral nitrogen compounds
412	34	65	1	1	0	3	503.53	3.8e-05	Neutral nitrogen compounds
413	33	63	1	1	0	3	489.514	3.4e-05	Neutral nitrogen compounds
414	32	61	1	1	0	3	475.498	5.5e-05	Neutral nitrogen compounds
415	31	59	1	1	0	3	461.482	4.6e-05	Neutral nitrogen compounds
416	30	57	1	1	0	3	447.466	4.8e-05	Neutral nitrogen compounds
417	29	55	1	1	0	3	433.45	4.7e-05	Neutral nitrogen compounds
418	28	53	1	1	0	3	419.434	4.3e-05	Neutral nitrogen compounds
419	27	51	1	1	0	3	405.418	5.2e-05	Neutral nitrogen compounds
420	26	49	1	1	0	3	391.402	4e-05	Neutral nitrogen compounds
421	25	47	1	1	0	3	377.386	4.9e-05	Neutral nitrogen compounds
422	24	45	1	1	0	3	363.37	2.9e-05	Neutral nitrogen compounds
423	23	43	1	1	0	3	349.354	2.8e-05	Neutral nitrogen compounds
424	22	41	1	1	0	3	335.338	2.5e-05	Neutral nitrogen compounds
425	21	39	1	1	0	3	321.322	2e-05	Neutral nitrogen compounds
426	19	35	1	1	0	3	293.29	1.7e-05	Neutral nitrogen compounds
427	18	33	1	1	0	3	279.274	1.2e-05	Neutral nitrogen compounds
428	17	31	1	1	0	3	265.258	9e-06	Neutral nitrogen compounds
429	15	27	1	1	0	3	237.226	6e-06	Neutral nitrogen compounds
430	45	85	0	1	0	4	639.69	2.8e-05	Neutral nitrogen compounds
431	42	79	0	1	0	4	597.642	3e-05	Neutral nitrogen compounds
432	41	77	0	1	0	4	583.626	4e-05	Neutral nitrogen compounds
433	41	77	1	1	0	4	599.626	2.5e-05	Neutral nitrogen compounds
434	40	75	0	1	0	4	569.61	0.000102	Neutral nitrogen compounds
435	40	75	1	1	0	4	585.61	3.1e-05	Neutral nitrogen compounds
436	39	73	0	1	0	4	555.594	0.000119	Neutral nitrogen compounds
437	39	73	1	1	0	4	571.594	4.5e-05	Neutral nitrogen compounds
438	38	71	0	1	0	4	541.578	0.000135	Neutral nitrogen compounds
439	38	71	1	1	0	4	557.578	4.4e-05	Neutral nitrogen compounds
440	37	69	0	1	0	4	527.562	0.000116	Neutral nitrogen compounds
441	37	69	1	1	0	4	543.562	8.2e-05	Neutral nitrogen compounds
442	36	67	0	1	0	4	513.546	0.000178	Neutral nitrogen compounds
443	36	67	1	1	0	4	529.546	0.00011	Neutral nitrogen compounds
444	35	65	0	1	0	4	499.53	0.000242	Neutral nitrogen compounds
445	35	65	1	1	0	4	515.53	0.000117	Neutral nitrogen compounds
446	34	63	0	1	0	4	485.514	0.000236	Neutral nitrogen compounds
447	34	63	1	1	0	4	501.514	0.000215	Neutral nitrogen compounds
448	33	61	0	1	0	4	471.498	0.000312	Neutral nitrogen compounds
449	33	61	1	1	0	4	487.498	0.000196	Neutral nitrogen compounds
450	32	59	0	1	0	4	457.482	0.000258	Neutral nitrogen compounds
451	32	59	1	1	0	4	473.482	0.000182	Neutral nitrogen compounds
452	31	57	0	1	0	4	443.466	0.000297	Neutral nitrogen compounds
453	31	57	1	1	0	4	459.466	0.000238	Neutral nitrogen compounds
454	30	55	0	1	0	4	429.45	0.000377	Neutral nitrogen compounds
455	30	55	1	1	0	4	445.45	0.000244	Neutral nitrogen compounds
456	29	53	0	1	0	4	415.434	0.000307	Neutral nitrogen compounds
457	29	53	1	1	0	4	431.434	0.000242	Neutral nitrogen compounds
458	28	51	0	1	0	4	401.418	0.000325	Neutral nitrogen compounds
459	28	51	1	1	0	4	417.418	0.000218	Neutral nitrogen compounds
460	27	49	0	1	0	4	387.402	0.000378	Neutral nitrogen compounds
461	27	49	1	1	0	4	403.402	0.000263	Neutral nitrogen compounds
462	26	47	0	1	0	4	373.386	0.0003	Neutral nitrogen compounds
463	26	47	1	1	0	4	389.386	0.000247	Neutral nitrogen compounds
464	25	45	0	1	0	4	359.37	0.000324	Neutral nitrogen compounds
465	25	45	1	1	0	4	375.37	0.000187	Neutral nitrogen compounds
466	24	43	0	1	0	4	345.354	0.000278	Neutral nitrogen compounds
467	24	43	1	1	0	4	361.354	0.000167	Neutral nitrogen compounds
468	23	41	0	1	0	4	331.338	0.000241	Neutral nitrogen compounds
469	23	41	1	1	0	4	347.338	0.000141	Neutral nitrogen compounds
470	22	39	0	1	0	4	317.322	0.000241	Neutral nitrogen compounds
471	22	39	1	1	0	4	333.322	0.000126	Neutral nitrogen compounds
472	21	37	0	1	0	4	303.306	0.00022	Neutral nitrogen compounds
473	21	37	1	1	0	4	319.306	9e-05	Neutral nitrogen compounds
474	20	35	0	1	0	4	289.29	0.000183	Neutral nitrogen compounds
475	20	35	1	1	0	4	305.29	7e-05	Neutral nitrogen compounds
476	19	33	0	1	0	4	275.274	0.000103	Neutral nitrogen compounds
477	19	33	1	1	0	4	291.274	6.1e-05	Neutral nitrogen compounds
478	18	31	0	1	0	4	261.258	6.2e-05	Neutral nitrogen compounds
479	18	31	1	1	0	4	277.258	4.1e-05	Neutral nitrogen compounds
480	17	29	0	1	0	4	247.242	4.4e-05	Neutral nitrogen compounds
481	17	29	1	1	0	4	263.242	2.6e-05	Neutral nitrogen compounds
482	16	27	0	1	0	4	233.226	2.4e-05	Neutral nitrogen compounds
483	16	27	1	1	0	4	249.226	1.9e-05	Neutral nitrogen compounds
484	15	25	0	1	0	4	219.21	1.6e-05	Neutral nitrogen compounds
485	15	25	1	1	0	4	235.21	8e-06	Neutral nitrogen compounds
486	45	83	0	1	0	5	637.674	4.8e-05	Neutral nitrogen compounds
487	45	83	1	1	0	5	653.674	2.9e-05	Neutral nitrogen compounds
488	44	81	0	1	0	5	623.658	5.9e-05	Neutral nitrogen compounds
489	44	81	1	1	0	5	639.658	2.5e-05	Neutral nitrogen compounds
490	43	79	0	1	0	5	609.642	0.000119	Neutral nitrogen compounds
491	42	77	0	1	0	5	595.626	0.000136	Neutral nitrogen compounds
492	42	77	1	1	0	5	611.626	2.9e-05	Neutral nitrogen compounds
493	41	75	0	1	0	5	581.61	0.000169	Neutral nitrogen compounds
494	41	75	1	1	0	5	597.61	4.7e-05	Neutral nitrogen compounds
495	40	73	0	1	0	5	567.594	0.000277	Neutral nitrogen compounds
496	40	73	1	1	0	5	583.594	5.5e-05	Neutral nitrogen compounds
497	39	71	0	1	0	5	553.578	0.000336	Neutral nitrogen compounds
498	39	71	1	1	0	5	569.578	0.000124	Neutral nitrogen compounds
499	38	69	0	1	0	5	539.562	0.000467	Neutral nitrogen compounds
500	38	69	1	1	0	5	555.562	0.000144	Neutral nitrogen compounds
501	37	67	0	1	0	5	525.546	0.000716	Neutral nitrogen compounds
502	37	67	1	1	0	5	541.546	0.000188	Neutral nitrogen compounds
503	36	65	0	1	0	5	511.53	0.000757	Neutral nitrogen compounds
504	36	65	1	1	0	5	527.53	0.000168	Neutral nitrogen compounds
505	35	63	0	1	0	5	497.514	0.000827	Neutral nitrogen compounds
506	35	63	1	1	0	5	513.514	0.00027	Neutral nitrogen compounds
507	34	61	0	1	0	5	483.498	0.001077	Neutral nitrogen compounds
508	34	61	1	1	0	5	499.498	0.000305	Neutral nitrogen compounds
509	33	59	0	1	0	5	469.482	0.001466	Neutral nitrogen compounds
510	33	59	1	1	0	5	485.482	0.000315	Neutral nitrogen compounds
511	32	57	0	1	0	5	455.466	0.001281	Neutral nitrogen compounds
512	32	57	1	1	0	5	471.466	0.000443	Neutral nitrogen compounds
513	31	55	0	1	0	5	441.45	0.001413	Neutral nitrogen compounds
514	31	55	1	1	0	5	457.45	0.000399	Neutral nitrogen compounds
515	30	53	0	1	0	5	427.434	0.001578	Neutral nitrogen compounds
516	30	53	1	1	0	5	443.434	0.000496	Neutral nitrogen compounds
517	29	51	0	1	0	5	413.418	0.001546	Neutral nitrogen compounds
518	29	51	1	1	0	5	429.418	0.000495	Neutral nitrogen compounds
519	29	51	0	1	1	5	445.478	0.000594	Neutral nitrogen compounds
520	28	49	0	1	0	5	399.402	0.001579	Neutral nitrogen compounds
521	28	49	1	1	0	5	415.402	0.000452	Neutral nitrogen compounds
522	28	49	0	1	1	5	431.462	0.000556	Neutral nitrogen compounds
523	27	47	0	1	0	5	385.386	0.001524	Neutral nitrogen compounds
524	27	47	1	1	0	5	401.386	0.000451	Neutral nitrogen compounds
525	27	47	0	1	1	5	417.446	0.000594	Neutral nitrogen compounds
526	26	45	0	1	0	5	371.37	0.001592	Neutral nitrogen compounds
527	26	45	1	1	0	5	387.37	0.000503	Neutral nitrogen compounds
528	26	45	0	1	1	5	403.43	0.000583	Neutral nitrogen compounds
529	25	43	0	1	0	5	357.354	0.001367	Neutral nitrogen compounds
530	25	43	1	1	0	5	373.354	0.000388	Neutral nitrogen compounds
531	25	43	0	1	1	5	389.414	0.000585	Neutral nitrogen compounds
532	24	41	0	1	0	5	343.338	0.001097	Neutral nitrogen compounds
533	24	41	1	1	0	5	359.338	0.000354	Neutral nitrogen compounds
534	24	41	0	1	1	5	375.398	0.000676	Neutral nitrogen compounds
535	23	39	0	1	0	5	329.322	0.001093	Neutral nitrogen compounds
536	23	39	1	1	0	5	345.322	0.000282	Neutral nitrogen compounds
537	23	39	0	1	1	5	361.382	0.000632	Neutral nitrogen compounds
538	22	37	0	1	0	5	315.306	0.000968	Neutral nitrogen compounds
539	22	37	1	1	0	5	331.306	0.000214	Neutral nitrogen compounds
540	22	37	0	1	1	5	347.366	0.000568	Neutral nitrogen compounds
541	21	35	0	1	0	5	301.29	0.000814	Neutral nitrogen compounds
542	21	35	1	1	0	5	317.29	0.000178	Neutral nitrogen compounds
543	21	35	0	1	1	5	333.35	0.000482	Neutral nitrogen compounds
544	20	33	0	1	0	5	287.274	0.000568	Neutral nitrogen compounds
545	20	33	1	1	0	5	303.274	0.000164	Neutral nitrogen compounds
546	20	33	0	1	1	5	319.334	0.000209	Neutral nitrogen compounds
547	19	31	0	1	0	5	273.258	0.00046	Neutral nitrogen compounds
548	19	31	1	1	0	5	289.258	0.000103	Neutral nitrogen compounds
549	19	31	0	1	1	5	305.318	0.000143	Neutral nitrogen compounds
550	18	29	0	1	0	5	259.242	0.000309	Neutral nitrogen compounds
551	18	29	1	1	0	5	275.242	6.8e-05	Neutral nitrogen compounds
552	18	29	0	1	1	5	291.302	0.0001	Neutral nitrogen compounds
553	17	27	0	1	0	5	245.226	0.000233	Neutral nitrogen compounds
554	17	27	1	1	0	5	261.226	3.5e-05	Neutral nitrogen compounds
555	17	27	0	1	1	5	277.286	1.5e-05	Neutral nitrogen compounds
556	16	25	0	1	0	5	231.21	0.00017	Neutral nitrogen compounds
557	16	25	1	1	0	5	247.21	2.3e-05	Neutral nitrogen compounds
558	16	25	0	1	1	5	263.27	1.8e-05	Neutral nitrogen compounds
559	15	23	0	1	0	5	217.194	7.3e-05	Neutral nitrogen compounds
560	15	23	0	1	1	5	249.254	2e-05	Neutral nitrogen compounds
561	14	21	0	1	0	5	203.178	2.4e-05	Neutral nitrogen compounds
562	14	21	1	1	0	5	219.178	7e-06	Neutral nitrogen compounds
563	14	21	0	1	1	5	235.238	1e-05	Neutral nitrogen compounds
564	47	85	0	1	0	6	663.69	4.7e-05	Neutral nitrogen compounds
565	46	83	0	1	0	6	649.674	6.9e-05	Neutral nitrogen compounds
566	46	83	0	1	1	6	681.734	3.1e-05	Neutral nitrogen compounds
567	45	81	0	1	0	6	635.658	0.000148	Neutral nitrogen compounds
568	44	79	0	1	0	6	621.642	0.000216	Neutral nitrogen compounds
569	43	77	0	1	0	6	607.626	0.000256	Neutral nitrogen compounds
570	43	77	0	1	1	6	639.686	3.8e-05	Neutral nitrogen compounds
571	42	75	0	1	0	6	593.61	0.000276	Neutral nitrogen compounds
572	42	75	1	1	0	6	609.61	4.2e-05	Neutral nitrogen compounds
573	42	75	0	1	1	6	625.67	4.1e-05	Neutral nitrogen compounds
574	41	73	0	1	0	6	579.594	0.000441	Neutral nitrogen compounds
575	41	73	1	1	0	6	595.594	3.6e-05	Neutral nitrogen compounds
576	41	73	0	1	1	6	611.654	6.1e-05	Neutral nitrogen compounds
577	40	71	0	1	0	6	565.578	0.000808	Neutral nitrogen compounds
578	40	71	1	1	0	6	581.578	5.6e-05	Neutral nitrogen compounds
579	40	71	0	1	1	6	597.638	0.000441	Neutral nitrogen compounds
580	39	69	0	1	0	6	551.562	0.001071	Neutral nitrogen compounds
581	39	69	1	1	0	6	567.562	0.000118	Neutral nitrogen compounds
582	39	69	0	1	1	6	583.622	0.000127	Neutral nitrogen compounds
583	38	67	0	1	0	6	537.546	0.001217	Neutral nitrogen compounds
584	38	67	1	1	0	6	553.546	0.000163	Neutral nitrogen compounds
585	38	67	0	1	1	6	569.606	0.000188	Neutral nitrogen compounds
586	37	65	1	1	0	6	539.53	0.000174	Neutral nitrogen compounds
587	37	65	0	1	1	6	555.59	0.000222	Neutral nitrogen compounds
588	36	63	0	1	0	6	509.514	0.00184	Neutral nitrogen compounds
589	36	63	1	1	0	6	525.514	0.000289	Neutral nitrogen compounds
590	36	63	0	1	1	6	541.574	0.000314	Neutral nitrogen compounds
591	35	61	0	1	0	6	495.498	0.002779	Neutral nitrogen compounds
592	35	61	1	1	0	6	511.498	0.000289	Neutral nitrogen compounds
593	35	61	0	1	1	6	527.558	0.00208	Neutral nitrogen compounds
594	34	59	0	1	0	6	481.482	0.002207	Neutral nitrogen compounds
595	34	59	1	1	0	6	497.482	0.000317	Neutral nitrogen compounds
596	34	59	0	1	1	6	513.542	0.000393	Neutral nitrogen compounds
597	33	57	0	1	0	6	467.466	0.00261	Neutral nitrogen compounds
598	33	57	1	1	0	6	483.466	0.000412	Neutral nitrogen compounds
599	33	57	0	1	1	6	499.526	0.003202	Neutral nitrogen compounds
600	32	55	0	1	0	6	453.45	0.003199	Neutral nitrogen compounds
601	32	55	1	1	0	6	469.45	0.00054	Neutral nitrogen compounds
602	32	55	0	1	1	6	485.51	0.000545	Neutral nitrogen compounds
603	31	53	0	1	0	6	439.434	0.003137	Neutral nitrogen compounds
604	31	53	1	1	0	6	455.434	0.000443	Neutral nitrogen compounds
605	31	53	0	1	1	6	471.494	0.000692	Neutral nitrogen compounds
606	30	51	0	1	0	6	425.418	0.00339	Neutral nitrogen compounds
607	30	51	1	1	0	6	441.418	0.000481	Neutral nitrogen compounds
608	30	51	0	1	1	6	457.478	0.000718	Neutral nitrogen compounds
609	29	49	0	1	0	6	411.402	0.003425	Neutral nitrogen compounds
610	29	49	1	1	0	6	427.402	0.000538	Neutral nitrogen compounds
611	29	49	0	1	1	6	443.462	0.000924	Neutral nitrogen compounds
612	28	47	0	1	0	6	397.386	0.003567	Neutral nitrogen compounds
613	28	47	1	1	0	6	413.386	0.0005	Neutral nitrogen compounds
614	28	47	0	1	1	6	429.446	0.000819	Neutral nitrogen compounds
615	27	45	0	1	0	6	383.37	0.003821	Neutral nitrogen compounds
616	27	45	1	1	0	6	399.37	0.000485	Neutral nitrogen compounds
617	27	45	0	1	1	6	415.43	0.000883	Neutral nitrogen compounds
618	26	43	0	1	0	6	369.354	0.003385	Neutral nitrogen compounds
619	26	43	1	1	0	6	385.354	0.000444	Neutral nitrogen compounds
620	26	43	0	1	1	6	401.414	0.000939	Neutral nitrogen compounds
621	25	41	0	1	0	6	355.338	0.003079	Neutral nitrogen compounds
622	25	41	1	1	0	6	371.338	0.000474	Neutral nitrogen compounds
623	25	41	0	1	1	6	387.398	0.000983	Neutral nitrogen compounds
624	24	39	0	1	0	6	341.322	0.002578	Neutral nitrogen compounds
625	24	39	1	1	0	6	357.322	0.000366	Neutral nitrogen compounds
626	24	39	0	1	1	6	373.382	0.000901	Neutral nitrogen compounds
627	23	37	0	1	0	6	327.306	0.002355	Neutral nitrogen compounds
628	23	37	1	1	0	6	343.306	0.000276	Neutral nitrogen compounds
629	23	37	0	1	1	6	359.366	0.000939	Neutral nitrogen compounds
630	22	35	0	1	0	6	313.29	0.002116	Neutral nitrogen compounds
631	22	35	1	1	0	6	329.29	0.000241	Neutral nitrogen compounds
632	22	35	0	1	1	6	345.35	0.000909	Neutral nitrogen compounds
633	21	33	0	1	0	6	299.274	0.001804	Neutral nitrogen compounds
634	21	33	1	1	0	6	315.274	0.000204	Neutral nitrogen compounds
635	21	33	0	1	1	6	331.334	0.000721	Neutral nitrogen compounds
636	20	31	0	1	0	6	285.258	0.001405	Neutral nitrogen compounds
637	20	31	1	1	0	6	301.258	0.000143	Neutral nitrogen compounds
638	20	31	0	1	1	6	317.318	0.000725	Neutral nitrogen compounds
639	19	29	0	1	0	6	271.242	0.001004	Neutral nitrogen compounds
640	19	29	1	1	0	6	287.242	9.5e-05	Neutral nitrogen compounds
641	19	29	0	1	1	6	303.302	0.000606	Neutral nitrogen compounds
642	18	27	0	1	0	6	257.226	0.000694	Neutral nitrogen compounds
643	18	27	1	1	0	6	273.226	6.2e-05	Neutral nitrogen compounds
644	18	27	0	1	1	6	289.286	0.000483	Neutral nitrogen compounds
645	17	25	0	1	0	6	243.21	0.000471	Neutral nitrogen compounds
646	17	25	1	1	0	6	259.21	3.2e-05	Neutral nitrogen compounds
647	17	25	0	1	1	6	275.27	0.000396	Neutral nitrogen compounds
648	16	23	0	1	0	6	229.194	0.000236	Neutral nitrogen compounds
649	16	23	1	1	0	6	245.194	2.4e-05	Neutral nitrogen compounds
650	16	23	0	1	1	6	261.254	0.000289	Neutral nitrogen compounds
651	15	21	0	1	0	6	215.178	8.2e-05	Neutral nitrogen compounds
652	15	21	1	1	0	6	231.178	1e-05	Neutral nitrogen compounds
653	15	21	0	1	1	6	247.238	0.000216	Neutral nitrogen compounds
654	14	19	0	1	0	6	201.162	1.8e-05	Neutral nitrogen compounds
655	14	19	1	1	0	6	217.162	7e-06	Neutral nitrogen compounds
656	14	19	0	1	1	6	233.222	0.000131	Neutral nitrogen compounds
657	13	17	0	1	1	6	219.206	6.6e-05	Neutral nitrogen compounds
658	12	15	0	1	1	6	205.19	2.5e-05	Neutral nitrogen compounds
659	11	13	0	1	0	6	159.114	5e-06	Neutral nitrogen compounds
660	48	85	0	1	0	7	675.69	3.8e-05	Neutral nitrogen compounds
661	47	83	0	1	0	7	661.674	5e-05	Neutral nitrogen compounds
662	46	81	0	1	0	7	647.658	8.9e-05	Neutral nitrogen compounds
663	44	77	1	1	0	7	635.626	3e-05	Neutral nitrogen compounds
664	44	77	0	1	1	7	651.686	8.6e-05	Neutral nitrogen compounds
665	43	75	0	1	0	7	605.61	0.00041	Neutral nitrogen compounds
666	43	75	1	1	0	7	621.61	3.8e-05	Neutral nitrogen compounds
667	43	75	0	1	1	7	637.67	0.000135	Neutral nitrogen compounds
668	42	73	0	1	0	7	591.594	0.000641	Neutral nitrogen compounds
669	42	73	1	1	0	7	607.594	3.5e-05	Neutral nitrogen compounds
670	42	73	0	1	1	7	623.654	0.000182	Neutral nitrogen compounds
671	41	71	0	1	0	7	577.578	0.000695	Neutral nitrogen compounds
672	41	71	1	1	0	7	593.578	4.4e-05	Neutral nitrogen compounds
673	41	71	0	1	1	7	609.638	8.3e-05	Neutral nitrogen compounds
674	40	69	0	1	0	7	563.562	0.001	Neutral nitrogen compounds
675	40	69	1	1	0	7	579.562	7.3e-05	Neutral nitrogen compounds
676	40	69	0	1	1	7	595.622	9.6e-05	Neutral nitrogen compounds
677	39	67	0	1	0	7	549.546	0.001228	Neutral nitrogen compounds
678	39	67	1	1	0	7	565.546	0.000125	Neutral nitrogen compounds
679	39	67	0	1	1	7	581.606	0.000129	Neutral nitrogen compounds
680	38	65	0	1	0	7	535.53	0.001907	Neutral nitrogen compounds
681	38	65	1	1	0	7	551.53	0.000215	Neutral nitrogen compounds
682	38	65	0	1	1	7	567.59	0.000921	Neutral nitrogen compounds
683	37	63	0	1	0	7	521.514	0.002253	Neutral nitrogen compounds
684	37	63	1	1	0	7	537.514	0.000201	Neutral nitrogen compounds
685	37	63	0	1	1	7	553.574	0.001253	Neutral nitrogen compounds
686	36	61	0	1	0	7	507.498	0.003111	Neutral nitrogen compounds
687	36	61	1	1	0	7	523.498	0.00021	Neutral nitrogen compounds
688	36	61	0	1	1	7	539.558	0.001577	Neutral nitrogen compounds
689	35	59	0	1	0	7	493.482	0.003388	Neutral nitrogen compounds
690	35	59	1	1	0	7	509.482	0.000271	Neutral nitrogen compounds
691	35	59	0	1	1	7	525.542	0.00049	Neutral nitrogen compounds
692	34	57	0	1	0	7	479.466	0.005388	Neutral nitrogen compounds
693	34	57	1	1	0	7	495.466	0.000407	Neutral nitrogen compounds
694	34	57	0	1	1	7	511.526	0.002542	Neutral nitrogen compounds
695	33	55	0	1	0	7	465.45	0.00478	Neutral nitrogen compounds
696	33	55	1	1	0	7	481.45	0.000323	Neutral nitrogen compounds
697	33	55	0	1	1	7	497.51	0.002809	Neutral nitrogen compounds
698	32	53	0	1	0	7	451.434	0.004954	Neutral nitrogen compounds
699	32	53	1	1	0	7	467.434	0.000355	Neutral nitrogen compounds
700	32	53	0	1	1	7	483.494	0.003534	Neutral nitrogen compounds
701	31	51	0	1	0	7	437.418	0.005602	Neutral nitrogen compounds
702	31	51	1	1	0	7	453.418	0.000452	Neutral nitrogen compounds
703	31	51	0	1	1	7	469.478	0.000773	Neutral nitrogen compounds
704	30	49	0	1	0	7	423.402	0.005782	Neutral nitrogen compounds
705	30	49	1	1	0	7	439.402	0.00041	Neutral nitrogen compounds
706	30	49	0	1	1	7	455.462	0.000677	Neutral nitrogen compounds
707	30	49	2	1	0	7	455.402	2.5e-05	Neutral nitrogen compounds
708	29	47	0	1	0	7	409.386	0.003149	Neutral nitrogen compounds
709	29	47	1	1	0	7	425.386	0.000406	Neutral nitrogen compounds
710	29	47	0	1	1	7	441.446	0.000725	Neutral nitrogen compounds
711	29	47	2	1	0	7	441.386	2.4e-05	Neutral nitrogen compounds
712	28	45	0	1	0	7	395.37	0.006811	Neutral nitrogen compounds
713	28	45	1	1	0	7	411.37	0.00039	Neutral nitrogen compounds
714	28	45	0	1	1	7	427.43	0.000792	Neutral nitrogen compounds
715	28	45	2	1	0	7	427.37	2.5e-05	Neutral nitrogen compounds
716	27	44	0	2	0	7	396.372	3.3e-05	Neutral nitrogen compounds
717	27	43	0	1	0	7	381.354	0.006828	Neutral nitrogen compounds
718	27	43	1	1	0	7	397.354	0.000405	Neutral nitrogen compounds
719	27	43	0	1	1	7	413.414	0.000867	Neutral nitrogen compounds
720	27	43	2	1	0	7	413.354	2.5e-05	Neutral nitrogen compounds
721	26	42	0	2	0	7	382.356	3.2e-05	Neutral nitrogen compounds
722	26	41	0	1	0	7	367.338	0.006796	Neutral nitrogen compounds
723	26	41	1	1	0	7	383.338	0.000398	Neutral nitrogen compounds
724	26	41	0	1	1	7	399.398	0.000898	Neutral nitrogen compounds
725	26	41	2	1	0	7	399.338	2.6e-05	Neutral nitrogen compounds
726	25	40	0	2	0	7	368.34	2.6e-05	Neutral nitrogen compounds
727	25	39	0	1	0	7	353.322	0.005695	Neutral nitrogen compounds
728	25	39	1	1	0	7	369.322	0.000319	Neutral nitrogen compounds
729	25	39	0	1	1	7	385.382	0.000957	Neutral nitrogen compounds
730	25	39	2	1	0	7	385.322	2.8e-05	Neutral nitrogen compounds
731	24	38	0	2	0	7	354.324	2.3e-05	Neutral nitrogen compounds
732	24	37	0	1	0	7	339.306	0.004811	Neutral nitrogen compounds
733	24	37	1	1	0	7	355.306	0.000251	Neutral nitrogen compounds
734	24	37	0	1	1	7	371.366	0.001008	Neutral nitrogen compounds
735	24	37	2	1	0	7	371.306	2.9e-05	Neutral nitrogen compounds
736	23	36	0	2	0	7	340.308	2.1e-05	Neutral nitrogen compounds
737	23	35	0	1	0	7	325.29	0.004741	Neutral nitrogen compounds
738	23	35	1	1	0	7	341.29	0.000207	Neutral nitrogen compounds
739	23	35	0	1	1	7	357.35	0.000813	Neutral nitrogen compounds
740	23	35	2	1	0	7	357.29	3.1e-05	Neutral nitrogen compounds
741	22	34	0	2	0	7	326.292	1.5e-05	Neutral nitrogen compounds
742	22	33	0	1	0	7	311.274	0.003867	Neutral nitrogen compounds
743	22	33	1	1	0	7	327.274	0.000181	Neutral nitrogen compounds
744	22	33	0	1	1	7	343.334	0.000708	Neutral nitrogen compounds
745	22	33	2	1	0	7	343.274	2.5e-05	Neutral nitrogen compounds
746	21	32	0	2	0	7	312.276	2.4e-05	Neutral nitrogen compounds
747	21	31	0	1	0	7	297.258	0.002986	Neutral nitrogen compounds
748	21	31	1	1	0	7	313.258	0.000148	Neutral nitrogen compounds
749	21	31	0	1	1	7	329.318	0.000701	Neutral nitrogen compounds
750	21	31	2	1	0	7	329.258	2.6e-05	Neutral nitrogen compounds
751	20	30	0	2	0	7	298.26	1.9e-05	Neutral nitrogen compounds
752	20	29	0	1	0	7	283.242	0.002516	Neutral nitrogen compounds
753	20	29	1	1	0	7	299.242	0.000116	Neutral nitrogen compounds
754	20	29	0	1	1	7	315.302	0.000697	Neutral nitrogen compounds
755	20	29	2	1	0	7	315.242	2.4e-05	Neutral nitrogen compounds
756	19	28	0	2	0	7	284.244	1.4e-05	Neutral nitrogen compounds
757	19	27	0	1	0	7	269.226	0.001652	Neutral nitrogen compounds
758	19	27	1	1	0	7	285.226	7.9e-05	Neutral nitrogen compounds
759	19	27	0	1	1	7	301.286	0.000536	Neutral nitrogen compounds
760	19	27	2	1	0	7	301.226	2e-05	Neutral nitrogen compounds
761	18	26	0	2	0	7	270.228	1.4e-05	Neutral nitrogen compounds
762	18	25	0	1	0	7	255.21	0.001086	Neutral nitrogen compounds
763	18	25	1	1	0	7	271.21	5.5e-05	Neutral nitrogen compounds
764	18	25	0	1	1	7	287.27	0.000373	Neutral nitrogen compounds
765	18	25	2	1	0	7	287.21	1.6e-05	Neutral nitrogen compounds
766	17	24	0	2	0	7	256.212	1e-05	Neutral nitrogen compounds
767	17	23	0	1	0	7	241.194	0.000808	Neutral nitrogen compounds
768	17	23	1	1	0	7	257.194	3.2e-05	Neutral nitrogen compounds
769	17	23	0	1	1	7	273.254	0.000292	Neutral nitrogen compounds
770	17	23	2	1	0	7	273.194	9e-06	Neutral nitrogen compounds
771	16	21	0	1	0	7	227.178	0.000569	Neutral nitrogen compounds
772	16	21	1	1	0	7	243.178	2e-05	Neutral nitrogen compounds
773	16	21	0	1	1	7	259.238	0.000139	Neutral nitrogen compounds
774	16	21	2	1	0	7	259.178	1e-05	Neutral nitrogen compounds
775	15	19	0	1	0	7	213.162	0.000384	Neutral nitrogen compounds
776	15	19	1	1	0	7	229.162	1.2e-05	Neutral nitrogen compounds
777	15	19	0	1	1	7	245.222	8.5e-05	Neutral nitrogen compounds
778	14	17	0	1	0	7	199.146	0.000112	Neutral nitrogen compounds
779	14	17	0	1	1	7	231.206	3.1e-05	Neutral nitrogen compounds
780	13	15	0	1	1	7	217.19	1.1e-05	Neutral nitrogen compounds
781	12	13	0	1	0	7	171.114	4e-06	Neutral nitrogen compounds
782	48	83	0	1	0	8	673.674	8.1e-05	Neutral nitrogen compounds
783	48	83	0	1	1	8	705.734	2.6e-05	Neutral nitrogen compounds
784	47	81	0	1	0	8	659.658	7.8e-05	Neutral nitrogen compounds
785	46	79	0	1	0	8	645.642	0.000146	Neutral nitrogen compounds
786	45	77	0	1	0	8	631.626	0.000231	Neutral nitrogen compounds
787	44	75	0	1	0	8	617.61	0.000382	Neutral nitrogen compounds
788	43	73	0	1	0	8	603.594	0.000515	Neutral nitrogen compounds
789	43	73	0	1	1	8	635.654	4.9e-05	Neutral nitrogen compounds
790	42	71	1	1	0	8	605.578	4.2e-05	Neutral nitrogen compounds
791	42	71	0	1	1	8	621.638	0.0001	Neutral nitrogen compounds
792	41	69	0	1	0	8	575.562	0.000808	Neutral nitrogen compounds
793	41	69	1	1	0	8	591.562	7.1e-05	Neutral nitrogen compounds
794	41	69	0	1	1	8	607.622	7.8e-05	Neutral nitrogen compounds
795	40	67	0	1	0	8	561.546	0.001264	Neutral nitrogen compounds
796	40	67	1	1	0	8	577.546	7.4e-05	Neutral nitrogen compounds
797	40	67	0	1	1	8	593.606	0.000104	Neutral nitrogen compounds
798	39	65	0	1	0	8	547.53	0.001715	Neutral nitrogen compounds
799	39	65	1	1	0	8	563.53	0.000111	Neutral nitrogen compounds
800	39	65	0	1	1	8	579.59	0.000134	Neutral nitrogen compounds
801	38	63	0	1	0	8	533.514	0.00209	Neutral nitrogen compounds
802	38	63	1	1	0	8	549.514	0.000139	Neutral nitrogen compounds
803	38	63	0	1	1	8	565.574	0.000255	Neutral nitrogen compounds
804	37	61	0	1	0	8	519.498	0.003173	Neutral nitrogen compounds
805	37	61	1	1	0	8	535.498	0.000198	Neutral nitrogen compounds
806	37	61	0	1	1	8	551.558	0.00038	Neutral nitrogen compounds
807	36	59	1	1	0	8	521.482	0.000223	Neutral nitrogen compounds
808	36	59	0	1	1	8	537.542	0.000324	Neutral nitrogen compounds
809	35	57	1	1	0	8	507.466	0.000302	Neutral nitrogen compounds
810	35	57	0	1	1	8	523.526	0.001645	Neutral nitrogen compounds
811	34	55	0	1	0	8	477.45	0.005005	Neutral nitrogen compounds
812	34	55	1	1	0	8	493.45	0.000309	Neutral nitrogen compounds
813	34	55	0	1	1	8	509.51	0.000433	Neutral nitrogen compounds
814	33	53	0	1	0	8	463.434	0.005383	Neutral nitrogen compounds
815	33	53	1	1	0	8	479.434	0.000459	Neutral nitrogen compounds
816	33	53	0	1	1	8	495.494	0.000784	Neutral nitrogen compounds
817	33	53	2	1	0	8	495.434	3.8e-05	Neutral nitrogen compounds
818	32	51	0	1	0	8	449.418	0.005838	Neutral nitrogen compounds
819	32	51	1	1	0	8	465.418	0.000429	Neutral nitrogen compounds
820	32	51	0	1	1	8	481.478	0.000596	Neutral nitrogen compounds
821	31	49	0	1	0	8	435.402	0.006469	Neutral nitrogen compounds
822	31	49	1	1	0	8	451.402	0.000414	Neutral nitrogen compounds
823	31	49	0	1	1	8	467.462	0.000672	Neutral nitrogen compounds
824	31	49	2	1	0	8	467.402	3.1e-05	Neutral nitrogen compounds
825	30	48	0	2	0	8	436.404	5.1e-05	Neutral nitrogen compounds
826	30	47	0	1	0	8	421.386	0.006596	Neutral nitrogen compounds
827	30	47	1	1	0	8	437.386	0.000404	Neutral nitrogen compounds
828	30	47	0	1	1	8	453.446	0.000899	Neutral nitrogen compounds
829	30	47	2	1	0	8	453.386	5.1e-05	Neutral nitrogen compounds
830	29	46	0	2	0	8	422.388	4.1e-05	Neutral nitrogen compounds
831	29	45	0	1	0	8	407.37	0.006327	Neutral nitrogen compounds
832	29	45	1	1	0	8	423.37	0.000411	Neutral nitrogen compounds
833	29	45	0	1	1	8	439.43	0.000677	Neutral nitrogen compounds
834	29	45	2	1	0	8	439.37	3.7e-05	Neutral nitrogen compounds
835	28	43	0	1	0	8	393.354	0.007304	Neutral nitrogen compounds
836	28	43	1	1	0	8	409.354	0.000216	Neutral nitrogen compounds
837	28	43	0	1	1	8	425.414	0.00078	Neutral nitrogen compounds
838	28	43	2	1	0	8	425.354	3.7e-05	Neutral nitrogen compounds
839	27	42	0	2	0	8	394.356	5.4e-05	Neutral nitrogen compounds
840	27	41	0	1	0	8	379.338	0.007036	Neutral nitrogen compounds
841	27	41	1	1	0	8	395.338	0.000399	Neutral nitrogen compounds
842	27	41	0	1	1	8	411.398	0.000906	Neutral nitrogen compounds
843	27	41	2	1	0	8	411.338	4.7e-05	Neutral nitrogen compounds
844	26	40	0	2	0	8	380.34	4.9e-05	Neutral nitrogen compounds
845	26	39	0	1	0	8	365.322	0.006685	Neutral nitrogen compounds
846	26	39	1	1	0	8	381.322	0.000387	Neutral nitrogen compounds
847	26	39	0	1	1	8	397.382	0.000935	Neutral nitrogen compounds
848	26	39	2	1	0	8	397.322	4.6e-05	Neutral nitrogen compounds
849	25	38	0	2	0	8	366.324	4.8e-05	Neutral nitrogen compounds
850	25	37	0	1	0	8	351.306	0.006389	Neutral nitrogen compounds
851	25	37	1	1	0	8	367.306	0.000347	Neutral nitrogen compounds
852	25	37	0	1	1	8	383.366	0.000865	Neutral nitrogen compounds
853	25	37	2	1	0	8	383.306	4.2e-05	Neutral nitrogen compounds
854	24	36	0	2	0	8	352.308	4.9e-05	Neutral nitrogen compounds
855	24	35	0	1	0	8	337.29	0.005049	Neutral nitrogen compounds
856	24	35	1	1	0	8	353.29	0.000318	Neutral nitrogen compounds
857	24	35	0	1	1	8	369.35	0.000779	Neutral nitrogen compounds
858	24	35	2	1	0	8	369.29	4.6e-05	Neutral nitrogen compounds
859	23	34	0	2	0	8	338.292	4.6e-05	Neutral nitrogen compounds
860	23	33	0	1	0	8	323.274	0.004256	Neutral nitrogen compounds
861	23	33	1	1	0	8	339.274	0.000249	Neutral nitrogen compounds
862	23	33	0	1	1	8	355.334	0.000719	Neutral nitrogen compounds
863	23	33	2	1	0	8	355.274	3.8e-05	Neutral nitrogen compounds
864	22	32	0	2	0	8	324.276	4.7e-05	Neutral nitrogen compounds
865	22	31	0	1	0	8	309.258	0.003856	Neutral nitrogen compounds
866	22	31	1	1	0	8	325.258	0.000224	Neutral nitrogen compounds
867	22	31	0	1	1	8	341.318	0.000648	Neutral nitrogen compounds
868	22	31	2	1	0	8	341.258	5.1e-05	Neutral nitrogen compounds
869	21	30	0	2	0	8	310.26	3.5e-05	Neutral nitrogen compounds
870	21	29	0	1	0	8	295.242	0.002965	Neutral nitrogen compounds
871	21	29	1	1	0	8	311.242	0.000189	Neutral nitrogen compounds
872	21	29	0	1	1	8	327.302	0.000555	Neutral nitrogen compounds
873	21	29	2	1	0	8	327.242	4.2e-05	Neutral nitrogen compounds
874	20	28	0	2	0	8	296.244	3.8e-05	Neutral nitrogen compounds
875	20	27	0	1	0	8	281.226	0.002402	Neutral nitrogen compounds
876	20	27	1	1	0	8	297.226	0.000152	Neutral nitrogen compounds
877	20	27	0	1	1	8	313.286	0.00043	Neutral nitrogen compounds
878	20	27	2	1	0	8	313.226	3.5e-05	Neutral nitrogen compounds
879	19	26	0	2	0	8	282.228	3e-05	Neutral nitrogen compounds
880	19	25	0	1	0	8	267.21	0.001796	Neutral nitrogen compounds
881	19	25	1	1	0	8	283.21	0.000125	Neutral nitrogen compounds
882	19	25	0	1	1	8	299.27	0.000315	Neutral nitrogen compounds
883	19	25	2	1	0	8	299.21	1.9e-05	Neutral nitrogen compounds
884	18	24	0	2	0	8	268.212	2.3e-05	Neutral nitrogen compounds
885	18	23	0	1	0	8	253.194	0.001329	Neutral nitrogen compounds
886	18	23	1	1	0	8	269.194	8.3e-05	Neutral nitrogen compounds
887	18	23	0	1	1	8	285.254	0.000195	Neutral nitrogen compounds
888	18	23	2	1	0	8	285.194	1.6e-05	Neutral nitrogen compounds
889	17	22	0	2	0	8	254.196	1.6e-05	Neutral nitrogen compounds
890	17	21	0	1	0	8	239.178	0.000999	Neutral nitrogen compounds
891	17	21	1	1	0	8	255.178	6.5e-05	Neutral nitrogen compounds
892	17	21	0	1	1	8	271.238	9e-05	Neutral nitrogen compounds
893	16	20	0	2	0	8	240.18	1e-05	Neutral nitrogen compounds
894	16	19	0	1	0	8	225.162	0.000476	Neutral nitrogen compounds
895	16	19	1	1	0	8	241.162	6.1e-05	Neutral nitrogen compounds
896	16	19	0	1	1	8	257.222	3.8e-05	Neutral nitrogen compounds
897	15	17	0	1	0	8	211.146	0.00015	Neutral nitrogen compounds
898	15	17	1	1	0	8	227.146	1.9e-05	Neutral nitrogen compounds
899	15	17	0	1	1	8	243.206	1.8e-05	Neutral nitrogen compounds
900	14	15	0	1	0	8	197.13	2e-05	Neutral nitrogen compounds
901	14	15	1	1	0	8	213.13	9e-06	Neutral nitrogen compounds
902	14	15	0	1	1	8	229.19	7e-06	Neutral nitrogen compounds
903	49	83	0	1	0	9	685.674	4.8e-05	Neutral nitrogen compounds
904	48	81	0	1	0	9	671.658	5.9e-05	Neutral nitrogen compounds
905	47	79	0	1	0	9	657.642	0.00011	Neutral nitrogen compounds
906	46	77	0	1	0	9	643.626	0.000194	Neutral nitrogen compounds
907	45	75	0	1	0	9	629.61	0.000238	Neutral nitrogen compounds
908	45	75	0	1	1	9	661.67	4.2e-05	Neutral nitrogen compounds
909	44	73	1	1	0	9	631.594	2.7e-05	Neutral nitrogen compounds
910	43	71	0	1	0	9	601.578	0.000538	Neutral nitrogen compounds
911	43	71	1	1	0	9	617.578	2.9e-05	Neutral nitrogen compounds
912	43	71	0	1	1	9	633.638	6.6e-05	Neutral nitrogen compounds
913	42	69	0	1	0	9	587.562	0.000867	Neutral nitrogen compounds
914	42	69	1	1	0	9	603.562	5.3e-05	Neutral nitrogen compounds
915	42	69	0	1	1	9	619.622	6.3e-05	Neutral nitrogen compounds
916	41	67	0	1	0	9	573.546	0.001335	Neutral nitrogen compounds
917	41	67	1	1	0	9	589.546	6.1e-05	Neutral nitrogen compounds
918	41	67	0	1	1	9	605.606	0.000114	Neutral nitrogen compounds
919	40	65	0	1	0	9	559.53	0.001375	Neutral nitrogen compounds
920	40	65	1	1	0	9	575.53	8.1e-05	Neutral nitrogen compounds
921	40	65	0	1	1	9	591.59	0.000172	Neutral nitrogen compounds
922	39	63	0	1	0	9	545.514	0.001941	Neutral nitrogen compounds
923	39	63	1	1	0	9	561.514	0.000131	Neutral nitrogen compounds
924	39	63	0	1	1	9	577.574	0.000223	Neutral nitrogen compounds
925	38	61	0	1	0	9	531.498	0.003806	Neutral nitrogen compounds
926	38	61	1	1	0	9	547.498	0.00018	Neutral nitrogen compounds
927	38	61	0	1	1	9	563.558	0.000574	Neutral nitrogen compounds
928	37	59	1	1	0	9	533.482	0.000215	Neutral nitrogen compounds
929	37	59	0	1	1	9	549.542	0.000764	Neutral nitrogen compounds
930	36	57	0	1	0	9	503.466	0.00382	Neutral nitrogen compounds
931	36	57	1	1	0	9	519.466	0.000314	Neutral nitrogen compounds
932	36	57	0	1	1	9	535.526	0.000542	Neutral nitrogen compounds
933	36	57	2	1	0	9	535.466	3.9e-05	Neutral nitrogen compounds
934	35	55	0	1	0	9	489.45	0.004464	Neutral nitrogen compounds
935	35	55	1	1	0	9	505.45	0.000356	Neutral nitrogen compounds
936	35	55	0	1	1	9	521.51	0.000685	Neutral nitrogen compounds
937	34	53	1	1	0	9	491.434	0.000417	Neutral nitrogen compounds
938	34	53	0	1	1	9	507.494	0.00089	Neutral nitrogen compounds
939	34	53	2	1	0	9	507.434	3.1e-05	Neutral nitrogen compounds
940	33	52	0	2	0	9	476.436	7.6e-05	Neutral nitrogen compounds
941	33	51	0	1	0	9	461.418	0.005725	Neutral nitrogen compounds
942	33	51	1	1	0	9	477.418	0.000417	Neutral nitrogen compounds
943	33	51	0	1	1	9	493.478	0.001026	Neutral nitrogen compounds
944	33	51	2	1	0	9	493.418	3.9e-05	Neutral nitrogen compounds
945	32	50	0	2	0	9	462.42	8.9e-05	Neutral nitrogen compounds
946	32	49	0	1	0	9	447.402	0.006196	Neutral nitrogen compounds
947	32	49	1	1	0	9	463.402	0.000454	Neutral nitrogen compounds
948	32	49	0	1	1	9	479.462	0.001405	Neutral nitrogen compounds
949	32	49	2	1	0	9	479.402	6.9e-05	Neutral nitrogen compounds
950	31	48	0	2	0	9	448.404	9.2e-05	Neutral nitrogen compounds
951	31	47	0	1	0	9	433.386	0.006768	Neutral nitrogen compounds
952	31	47	1	1	0	9	449.386	0.000456	Neutral nitrogen compounds
953	31	47	0	1	1	9	465.446	0.001477	Neutral nitrogen compounds
954	31	47	2	1	0	9	465.386	6.3e-05	Neutral nitrogen compounds
955	30	46	0	2	0	9	434.388	0.000105	Neutral nitrogen compounds
956	30	45	0	1	0	9	419.37	0.006978	Neutral nitrogen compounds
957	30	45	1	1	0	9	435.37	0.000565	Neutral nitrogen compounds
958	30	45	0	1	1	9	451.43	0.001503	Neutral nitrogen compounds
959	30	45	2	1	0	9	451.37	5.9e-05	Neutral nitrogen compounds
960	29	44	0	2	0	9	420.372	8.3e-05	Neutral nitrogen compounds
961	29	43	0	1	0	9	405.354	0.007348	Neutral nitrogen compounds
962	29	43	1	1	0	9	421.354	0.000537	Neutral nitrogen compounds
963	29	43	0	1	1	9	437.414	0.001395	Neutral nitrogen compounds
964	29	43	2	1	0	9	437.354	6.7e-05	Neutral nitrogen compounds
965	28	42	0	2	0	9	406.356	0.000103	Neutral nitrogen compounds
966	28	41	0	1	0	9	391.338	0.007352	Neutral nitrogen compounds
967	28	41	1	1	0	9	407.338	0.000571	Neutral nitrogen compounds
968	28	41	0	1	1	9	423.398	0.001544	Neutral nitrogen compounds
969	28	41	2	1	0	9	423.338	7.7e-05	Neutral nitrogen compounds
970	27	40	0	2	0	9	392.34	8.4e-05	Neutral nitrogen compounds
971	27	39	0	1	0	9	377.322	0.007216	Neutral nitrogen compounds
972	27	39	1	1	0	9	393.322	0.000541	Neutral nitrogen compounds
973	27	39	0	1	1	9	409.382	0.001031	Neutral nitrogen compounds
974	27	39	2	1	0	9	409.322	4.1e-05	Neutral nitrogen compounds
975	26	38	0	2	0	9	378.324	0.000103	Neutral nitrogen compounds
976	26	37	0	1	0	9	363.306	0.006782	Neutral nitrogen compounds
977	26	37	1	1	0	9	379.306	0.000592	Neutral nitrogen compounds
978	26	37	0	1	1	9	395.366	0.001837	Neutral nitrogen compounds
979	26	37	2	1	0	9	395.306	8.2e-05	Neutral nitrogen compounds
980	25	36	0	2	0	9	364.308	0.000117	Neutral nitrogen compounds
981	25	35	0	1	0	9	349.29	0.006119	Neutral nitrogen compounds
982	25	35	1	1	0	9	365.29	0.000518	Neutral nitrogen compounds
983	25	35	0	1	1	9	381.35	0.001837	Neutral nitrogen compounds
984	25	35	2	1	0	9	381.29	6.3e-05	Neutral nitrogen compounds
985	24	34	0	2	0	9	350.292	0.000121	Neutral nitrogen compounds
986	24	33	0	1	0	9	335.274	0.005465	Neutral nitrogen compounds
987	24	33	1	1	0	9	351.274	0.000456	Neutral nitrogen compounds
988	24	33	0	1	1	9	367.334	0.001752	Neutral nitrogen compounds
989	24	33	2	1	0	9	367.274	7.1e-05	Neutral nitrogen compounds
990	23	32	0	2	0	9	336.276	0.000103	Neutral nitrogen compounds
991	23	31	0	1	0	9	321.258	0.004743	Neutral nitrogen compounds
992	23	31	1	1	0	9	337.258	0.000455	Neutral nitrogen compounds
993	23	31	0	1	1	9	353.318	0.001894	Neutral nitrogen compounds
994	23	31	2	1	0	9	353.258	7.8e-05	Neutral nitrogen compounds
995	22	30	0	2	0	9	322.26	0.000108	Neutral nitrogen compounds
996	22	29	0	1	0	9	307.242	0.004404	Neutral nitrogen compounds
997	22	29	1	1	0	9	323.242	0.000373	Neutral nitrogen compounds
998	22	29	0	1	1	9	339.302	0.001328	Neutral nitrogen compounds
999	22	29	2	1	0	9	339.242	4.6e-05	Neutral nitrogen compounds
1000	21	28	0	2	0	9	308.244	9.5e-05	Neutral nitrogen compounds
1001	21	27	0	1	0	9	293.226	0.003441	Neutral nitrogen compounds
1002	21	27	1	1	0	9	309.226	0.000314	Neutral nitrogen compounds
1003	21	27	0	1	1	9	325.286	0.001352	Neutral nitrogen compounds
1004	21	27	2	1	0	9	325.226	3.1e-05	Neutral nitrogen compounds
1005	20	26	0	2	0	9	294.228	9.3e-05	Neutral nitrogen compounds
1006	20	25	0	1	0	9	279.21	0.002548	Neutral nitrogen compounds
1007	20	25	1	1	0	9	295.21	0.000271	Neutral nitrogen compounds
1008	20	25	0	1	1	9	311.27	0.001152	Neutral nitrogen compounds
1009	20	25	2	1	0	9	311.21	1.8e-05	Neutral nitrogen compounds
1010	19	24	0	2	0	9	280.212	6.5e-05	Neutral nitrogen compounds
1011	19	23	0	1	0	9	265.194	0.001585	Neutral nitrogen compounds
1012	19	23	1	1	0	9	281.194	0.00018	Neutral nitrogen compounds
1013	19	23	0	1	1	9	297.254	0.001061	Neutral nitrogen compounds
1014	19	23	2	1	0	9	297.194	1.8e-05	Neutral nitrogen compounds
1015	18	22	0	2	0	9	266.196	4e-05	Neutral nitrogen compounds
1016	18	21	0	1	0	9	251.178	0.000847	Neutral nitrogen compounds
1017	18	21	1	1	0	9	267.178	0.000126	Neutral nitrogen compounds
1018	18	21	0	1	1	9	283.238	0.000903	Neutral nitrogen compounds
1019	18	21	2	1	0	9	283.178	1.2e-05	Neutral nitrogen compounds
1020	17	20	0	2	0	9	252.18	2.4e-05	Neutral nitrogen compounds
1021	17	19	0	1	0	9	237.162	0.000348	Neutral nitrogen compounds
1022	17	19	1	1	0	9	253.162	6.8e-05	Neutral nitrogen compounds
1023	17	19	0	1	1	9	269.222	0.000721	Neutral nitrogen compounds
1024	17	19	2	1	0	9	269.162	9e-06	Neutral nitrogen compounds
1025	16	18	0	2	0	9	238.164	1.5e-05	Neutral nitrogen compounds
1026	16	17	0	1	0	9	223.146	0.000131	Neutral nitrogen compounds
1027	16	17	1	1	0	9	239.146	3.4e-05	Neutral nitrogen compounds
1028	16	17	0	1	1	9	255.206	0.000533	Neutral nitrogen compounds
1029	15	15	0	1	0	9	209.13	3.9e-05	Neutral nitrogen compounds
1030	15	15	1	1	0	9	225.13	1.4e-05	Neutral nitrogen compounds
1031	15	15	0	1	1	9	241.19	0.000505	Neutral nitrogen compounds
1032	14	13	0	1	0	9	195.114	1.1e-05	Neutral nitrogen compounds
1033	14	13	1	1	0	9	211.114	6e-06	Neutral nitrogen compounds
1034	14	13	0	1	1	9	227.174	0.000248	Neutral nitrogen compounds
1035	13	11	0	1	0	9	181.098	4e-06	Neutral nitrogen compounds
1036	13	11	0	1	1	9	213.158	7e-05	Neutral nitrogen compounds
1037	50	83	0	1	0	10	697.674	3.2e-05	Neutral nitrogen compounds
1038	49	81	0	1	0	10	683.658	4.1e-05	Neutral nitrogen compounds
1039	48	79	0	1	0	10	669.642	7.6e-05	Neutral nitrogen compounds
1040	47	77	0	1	0	10	655.626	9.9e-05	Neutral nitrogen compounds
1041	46	75	0	1	1	10	673.67	2.9e-05	Neutral nitrogen compounds
1042	45	73	0	1	0	10	627.594	0.000195	Neutral nitrogen compounds
1043	44	71	0	1	0	10	613.578	0.000411	Neutral nitrogen compounds
1044	44	71	0	1	1	10	645.638	4.4e-05	Neutral nitrogen compounds
1045	43	69	0	1	0	10	599.562	0.000602	Neutral nitrogen compounds
1046	43	69	1	1	0	10	615.562	3.9e-05	Neutral nitrogen compounds
1047	43	69	0	1	1	10	631.622	6.8e-05	Neutral nitrogen compounds
1048	42	67	1	1	0	10	601.546	5.3e-05	Neutral nitrogen compounds
1049	42	67	0	1	1	10	617.606	0.000112	Neutral nitrogen compounds
1050	41	65	1	1	0	10	587.53	0.000102	Neutral nitrogen compounds
1051	41	65	0	1	1	10	603.59	0.000114	Neutral nitrogen compounds
1052	40	63	0	1	0	10	557.514	0.001423	Neutral nitrogen compounds
1053	40	63	1	1	0	10	573.514	0.000146	Neutral nitrogen compounds
1054	40	63	0	1	1	10	589.574	0.000167	Neutral nitrogen compounds
1055	39	61	1	1	0	10	559.498	0.000144	Neutral nitrogen compounds
1056	39	61	0	1	1	10	575.558	0.000326	Neutral nitrogen compounds
1057	38	59	1	1	0	10	545.482	0.000184	Neutral nitrogen compounds
1058	38	59	0	1	1	10	561.542	0.000316	Neutral nitrogen compounds
1059	37	57	0	1	0	10	515.466	0.003023	Neutral nitrogen compounds
1060	37	57	1	1	0	10	531.466	0.000356	Neutral nitrogen compounds
1061	37	57	0	1	1	10	547.526	0.000457	Neutral nitrogen compounds
1062	37	57	2	1	0	10	547.466	3.2e-05	Neutral nitrogen compounds
1063	36	56	0	2	0	10	516.468	9.3e-05	Neutral nitrogen compounds
1064	36	55	0	1	0	10	501.45	0.004919	Neutral nitrogen compounds
1065	36	55	1	1	0	10	517.45	0.000278	Neutral nitrogen compounds
1066	36	55	0	1	1	10	533.51	0.000746	Neutral nitrogen compounds
1067	36	55	2	1	0	10	533.45	2.8e-05	Neutral nitrogen compounds
1068	35	53	0	1	0	10	487.434	0.00591	Neutral nitrogen compounds
1069	35	53	1	1	0	10	503.434	0.000338	Neutral nitrogen compounds
1070	35	53	0	1	1	10	519.494	0.000762	Neutral nitrogen compounds
1071	35	53	2	1	0	10	519.434	4.9e-05	Neutral nitrogen compounds
1072	34	52	0	2	0	10	488.436	0.000102	Neutral nitrogen compounds
1073	34	51	0	1	0	10	473.418	0.00467	Neutral nitrogen compounds
1074	34	51	1	1	0	10	489.418	0.000391	Neutral nitrogen compounds
1075	34	51	0	1	1	10	505.478	0.001047	Neutral nitrogen compounds
1076	34	51	2	1	0	10	505.418	3.5e-05	Neutral nitrogen compounds
1077	33	50	0	2	0	10	474.42	0.000105	Neutral nitrogen compounds
1078	33	49	0	1	0	10	459.402	0.006495	Neutral nitrogen compounds
1079	33	49	1	1	0	10	475.402	0.000471	Neutral nitrogen compounds
1080	33	49	0	1	1	10	491.462	0.001175	Neutral nitrogen compounds
1081	33	49	2	1	0	10	491.402	7.2e-05	Neutral nitrogen compounds
1082	32	48	0	2	0	10	460.404	0.00012	Neutral nitrogen compounds
1083	32	47	0	1	0	10	445.386	0.007222	Neutral nitrogen compounds
1084	32	47	1	1	0	10	461.386	0.000449	Neutral nitrogen compounds
1085	32	47	0	1	1	10	477.446	0.001011	Neutral nitrogen compounds
1086	32	47	2	1	0	10	477.386	5.8e-05	Neutral nitrogen compounds
1087	31	46	0	2	0	10	446.388	0.000116	Neutral nitrogen compounds
1088	31	45	0	1	0	10	431.37	0.006392	Neutral nitrogen compounds
1089	31	45	1	1	0	10	447.37	0.000485	Neutral nitrogen compounds
1090	31	45	0	1	1	10	463.43	0.001162	Neutral nitrogen compounds
1091	31	45	2	1	0	10	463.37	8e-05	Neutral nitrogen compounds
1092	30	44	0	2	0	10	432.372	0.000128	Neutral nitrogen compounds
1093	30	43	0	1	0	10	417.354	0.006514	Neutral nitrogen compounds
1094	30	43	1	1	0	10	433.354	0.000618	Neutral nitrogen compounds
1095	30	43	0	1	1	10	449.414	0.001152	Neutral nitrogen compounds
1096	30	43	2	1	0	10	449.354	6.5e-05	Neutral nitrogen compounds
1097	29	42	0	2	0	10	418.356	0.000105	Neutral nitrogen compounds
1098	29	41	0	1	0	10	403.338	0.006874	Neutral nitrogen compounds
1099	29	41	1	1	0	10	419.338	0.000534	Neutral nitrogen compounds
1100	29	41	0	1	1	10	435.398	0.001373	Neutral nitrogen compounds
1101	29	41	2	1	0	10	435.338	7.9e-05	Neutral nitrogen compounds
1102	28	40	0	2	0	10	404.34	0.000111	Neutral nitrogen compounds
1103	28	39	0	1	0	10	389.322	0.006947	Neutral nitrogen compounds
1104	28	39	1	1	0	10	405.322	0.000649	Neutral nitrogen compounds
1105	28	39	0	1	1	10	421.382	0.001316	Neutral nitrogen compounds
1106	28	39	2	1	0	10	421.322	7.8e-05	Neutral nitrogen compounds
1107	27	38	0	2	0	10	390.324	0.000141	Neutral nitrogen compounds
1108	27	37	0	1	0	10	375.306	0.007374	Neutral nitrogen compounds
1109	27	37	1	1	0	10	391.306	0.000592	Neutral nitrogen compounds
1110	27	37	0	1	1	10	407.366	0.001521	Neutral nitrogen compounds
1111	27	37	2	1	0	10	407.306	0.000101	Neutral nitrogen compounds
1112	26	36	0	2	0	10	376.308	0.000141	Neutral nitrogen compounds
1113	26	35	0	1	0	10	361.29	0.007015	Neutral nitrogen compounds
1114	26	35	1	1	0	10	377.29	0.000534	Neutral nitrogen compounds
1115	26	35	0	1	1	10	393.35	0.001401	Neutral nitrogen compounds
1116	26	35	2	1	0	10	393.29	7.8e-05	Neutral nitrogen compounds
1117	25	34	0	2	0	10	362.292	0.00015	Neutral nitrogen compounds
1118	25	33	0	1	0	10	347.274	0.006259	Neutral nitrogen compounds
1119	25	33	1	1	0	10	363.274	0.000516	Neutral nitrogen compounds
1120	25	33	0	1	1	10	379.334	0.001576	Neutral nitrogen compounds
1121	25	33	2	1	0	10	379.274	9.6e-05	Neutral nitrogen compounds
1122	24	32	0	2	0	10	348.276	0.000128	Neutral nitrogen compounds
1123	24	31	0	1	0	10	333.258	0.005272	Neutral nitrogen compounds
1124	24	31	1	1	0	10	349.258	0.000508	Neutral nitrogen compounds
1125	24	31	0	1	1	10	365.318	0.001501	Neutral nitrogen compounds
1126	24	31	2	1	0	10	365.258	6.1e-05	Neutral nitrogen compounds
1127	23	30	0	2	0	10	334.26	0.000131	Neutral nitrogen compounds
1128	23	29	0	1	0	10	319.242	0.00495	Neutral nitrogen compounds
1129	23	29	1	1	0	10	335.242	0.000356	Neutral nitrogen compounds
1130	23	29	0	1	1	10	351.302	0.001357	Neutral nitrogen compounds
1131	23	29	2	1	0	10	351.242	5.3e-05	Neutral nitrogen compounds
1132	22	28	0	2	0	10	320.244	0.000126	Neutral nitrogen compounds
1133	22	27	0	1	0	10	305.226	0.003526	Neutral nitrogen compounds
1134	22	27	1	1	0	10	321.226	0.000313	Neutral nitrogen compounds
1135	22	27	0	1	1	10	337.286	0.001321	Neutral nitrogen compounds
1136	22	27	2	1	0	10	337.226	4e-05	Neutral nitrogen compounds
1137	21	26	0	2	0	10	306.228	9.7e-05	Neutral nitrogen compounds
1138	21	25	0	1	0	10	291.21	0.002704	Neutral nitrogen compounds
1139	21	25	1	1	0	10	307.21	0.000225	Neutral nitrogen compounds
1140	21	25	0	1	1	10	323.27	0.001133	Neutral nitrogen compounds
1141	21	25	2	1	0	10	323.21	3.3e-05	Neutral nitrogen compounds
1142	20	24	0	2	0	10	292.212	7.4e-05	Neutral nitrogen compounds
1143	20	23	0	1	0	10	277.194	0.00188	Neutral nitrogen compounds
1144	20	23	1	1	0	10	293.194	0.000162	Neutral nitrogen compounds
1145	20	23	0	1	1	10	309.254	0.00099	Neutral nitrogen compounds
1146	20	23	2	1	0	10	309.194	2.1e-05	Neutral nitrogen compounds
1147	19	22	0	2	0	10	278.196	6.4e-05	Neutral nitrogen compounds
1148	19	21	0	1	0	10	263.178	0.001348	Neutral nitrogen compounds
1149	19	21	1	1	0	10	279.178	8.7e-05	Neutral nitrogen compounds
1150	19	21	0	1	1	10	295.238	0.000858	Neutral nitrogen compounds
1151	19	21	2	1	0	10	295.178	1.7e-05	Neutral nitrogen compounds
1152	18	20	0	2	0	10	264.18	2.8e-05	Neutral nitrogen compounds
1153	18	19	0	1	0	10	249.162	0.001212	Neutral nitrogen compounds
1154	18	19	1	1	0	10	265.162	4.2e-05	Neutral nitrogen compounds
1155	18	19	0	1	1	10	281.222	0.000587	Neutral nitrogen compounds
1156	17	18	0	2	0	10	250.164	1.3e-05	Neutral nitrogen compounds
1157	17	17	0	1	0	10	235.146	0.001075	Neutral nitrogen compounds
1158	17	17	1	1	0	10	251.146	3e-05	Neutral nitrogen compounds
1159	17	17	0	1	1	10	267.206	0.000329	Neutral nitrogen compounds
1160	16	16	0	2	0	10	236.148	1.1e-05	Neutral nitrogen compounds
1161	16	15	0	1	0	10	221.13	0.000765	Neutral nitrogen compounds
1162	16	15	1	1	0	10	237.13	1.4e-05	Neutral nitrogen compounds
1163	16	15	0	1	1	10	253.19	0.000129	Neutral nitrogen compounds
1164	15	14	0	2	0	10	222.132	6e-06	Neutral nitrogen compounds
1165	15	13	0	1	0	10	207.114	0.000218	Neutral nitrogen compounds
1166	15	13	1	1	0	10	223.114	7e-06	Neutral nitrogen compounds
1167	15	13	0	1	1	10	239.174	3.5e-05	Neutral nitrogen compounds
1168	14	11	0	1	0	10	193.098	5e-06	Neutral nitrogen compounds
1169	14	11	0	1	1	10	225.158	1e-05	Neutral nitrogen compounds
1170	50	81	0	1	0	11	695.658	6e-05	Neutral nitrogen compounds
1171	49	79	0	1	0	11	681.642	3.1e-05	Neutral nitrogen compounds
1172	48	77	0	1	0	11	667.626	7.7e-05	Neutral nitrogen compounds
1173	47	75	0	1	0	11	653.61	0.000158	Neutral nitrogen compounds
1174	46	73	0	1	0	11	639.594	0.000271	Neutral nitrogen compounds
1175	45	71	0	1	0	11	625.578	0.000298	Neutral nitrogen compounds
1176	45	71	1	1	0	11	641.578	2.9e-05	Neutral nitrogen compounds
1177	44	69	0	1	0	11	611.562	0.000308	Neutral nitrogen compounds
1178	44	69	1	1	0	11	627.562	2.6e-05	Neutral nitrogen compounds
1179	44	69	0	1	1	11	643.622	3.6e-05	Neutral nitrogen compounds
1180	43	67	0	1	0	11	597.546	0.000441	Neutral nitrogen compounds
1181	43	67	1	1	0	11	613.546	3.8e-05	Neutral nitrogen compounds
1182	43	67	0	1	1	11	629.606	4.5e-05	Neutral nitrogen compounds
1183	42	65	0	1	0	11	583.53	0.000743	Neutral nitrogen compounds
1184	42	65	1	1	0	11	599.53	5.6e-05	Neutral nitrogen compounds
1185	42	65	0	1	1	11	615.59	8e-05	Neutral nitrogen compounds
1186	41	63	0	1	0	11	569.514	0.001375	Neutral nitrogen compounds
1187	41	63	1	1	0	11	585.514	8.3e-05	Neutral nitrogen compounds
1188	41	63	0	1	1	11	601.574	0.000118	Neutral nitrogen compounds
1189	40	61	0	1	0	11	555.498	0.001761	Neutral nitrogen compounds
1190	40	61	1	1	0	11	571.498	0.000109	Neutral nitrogen compounds
1191	40	61	0	1	1	11	587.558	0.000221	Neutral nitrogen compounds
1192	39	59	0	1	0	11	541.482	0.002409	Neutral nitrogen compounds
1193	39	59	1	1	0	11	557.482	0.00016	Neutral nitrogen compounds
1194	39	59	0	1	1	11	573.542	0.000375	Neutral nitrogen compounds
1195	39	59	2	1	0	11	573.482	3e-05	Neutral nitrogen compounds
1196	38	57	0	1	0	11	527.466	0.002079	Neutral nitrogen compounds
1197	38	57	1	1	0	11	543.466	0.000178	Neutral nitrogen compounds
1198	38	57	0	1	1	11	559.526	0.000329	Neutral nitrogen compounds
1199	37	55	0	1	0	11	513.45	0.002947	Neutral nitrogen compounds
1200	37	55	1	1	0	11	529.45	0.000273	Neutral nitrogen compounds
1201	37	55	0	1	1	11	545.51	0.000408	Neutral nitrogen compounds
1202	37	55	2	1	0	11	545.45	3.8e-05	Neutral nitrogen compounds
1203	36	53	0	1	0	11	499.434	0.003201	Neutral nitrogen compounds
1204	36	53	1	1	0	11	515.434	0.000291	Neutral nitrogen compounds
1205	36	53	0	1	1	11	531.494	0.000747	Neutral nitrogen compounds
1206	36	53	2	1	0	11	531.434	4.6e-05	Neutral nitrogen compounds
1207	35	52	0	2	0	11	500.436	9e-05	Neutral nitrogen compounds
1208	35	51	0	1	0	11	485.418	0.003784	Neutral nitrogen compounds
1209	35	51	1	1	0	11	501.418	0.000486	Neutral nitrogen compounds
1210	35	51	0	1	1	11	517.478	0.000643	Neutral nitrogen compounds
1211	35	51	2	1	0	11	517.418	3.3e-05	Neutral nitrogen compounds
1212	34	50	0	2	0	11	486.42	0.000103	Neutral nitrogen compounds
1213	34	49	0	1	0	11	471.402	0.00467	Neutral nitrogen compounds
1214	34	49	1	1	0	11	487.402	0.000608	Neutral nitrogen compounds
1215	34	49	0	1	1	11	503.462	0.00075	Neutral nitrogen compounds
1216	34	49	2	1	0	11	503.402	5.8e-05	Neutral nitrogen compounds
1217	33	48	0	2	0	11	472.404	0.000105	Neutral nitrogen compounds
1218	33	47	0	1	0	11	457.386	0.004783	Neutral nitrogen compounds
1219	33	47	1	1	0	11	473.386	0.000454	Neutral nitrogen compounds
1220	33	47	0	1	1	11	489.446	0.000845	Neutral nitrogen compounds
1221	33	47	2	1	0	11	489.386	6.6e-05	Neutral nitrogen compounds
1222	32	46	0	2	0	11	458.388	0.000137	Neutral nitrogen compounds
1223	32	45	0	1	0	11	443.37	0.005772	Neutral nitrogen compounds
1224	32	45	1	1	0	11	459.37	0.000654	Neutral nitrogen compounds
1225	32	45	0	1	1	11	475.43	0.001023	Neutral nitrogen compounds
1226	32	45	2	1	0	11	475.37	6.9e-05	Neutral nitrogen compounds
1227	31	44	0	2	0	11	444.372	0.000148	Neutral nitrogen compounds
1228	31	43	0	1	0	11	429.354	0.005096	Neutral nitrogen compounds
1229	31	43	1	1	0	11	445.354	0.000627	Neutral nitrogen compounds
1230	31	43	0	1	1	11	461.414	0.001023	Neutral nitrogen compounds
1231	31	43	2	1	0	11	461.354	7.1e-05	Neutral nitrogen compounds
1232	30	42	0	2	0	11	430.356	0.000152	Neutral nitrogen compounds
1233	30	41	0	1	0	11	415.338	0.005165	Neutral nitrogen compounds
1234	30	41	1	1	0	11	431.338	0.000632	Neutral nitrogen compounds
1235	30	41	0	1	1	11	447.398	0.001087	Neutral nitrogen compounds
1236	30	41	2	1	0	11	447.338	8.4e-05	Neutral nitrogen compounds
1237	29	40	0	2	0	11	416.34	0.000123	Neutral nitrogen compounds
1238	29	39	0	1	0	11	401.322	0.005377	Neutral nitrogen compounds
1239	29	39	1	1	0	11	417.322	0.000525	Neutral nitrogen compounds
1240	29	39	0	1	1	11	433.382	0.001314	Neutral nitrogen compounds
1241	29	39	2	1	0	11	433.322	0.000113	Neutral nitrogen compounds
1242	28	38	0	2	0	11	402.324	0.000134	Neutral nitrogen compounds
1243	28	37	0	1	0	11	387.306	0.005325	Neutral nitrogen compounds
1244	28	37	1	1	0	11	403.306	0.00059	Neutral nitrogen compounds
1245	28	37	0	1	1	11	419.366	0.001139	Neutral nitrogen compounds
1246	28	37	2	1	0	11	419.306	8.6e-05	Neutral nitrogen compounds
1247	27	36	0	2	0	11	388.308	0.000158	Neutral nitrogen compounds
1248	27	35	0	1	0	11	373.29	0.005574	Neutral nitrogen compounds
1249	27	35	1	1	0	11	389.29	0.000625	Neutral nitrogen compounds
1250	27	35	0	1	1	11	405.35	0.001269	Neutral nitrogen compounds
1251	27	35	2	1	0	11	405.29	9.7e-05	Neutral nitrogen compounds
1252	26	34	0	2	0	11	374.292	0.000179	Neutral nitrogen compounds
1253	26	33	0	1	0	11	359.274	0.004837	Neutral nitrogen compounds
1254	26	33	1	1	0	11	375.274	0.000515	Neutral nitrogen compounds
1255	26	33	0	1	1	11	391.334	0.001161	Neutral nitrogen compounds
1256	26	33	2	1	0	11	391.274	8.7e-05	Neutral nitrogen compounds
1257	25	32	0	2	0	11	360.276	0.000158	Neutral nitrogen compounds
1258	25	31	0	1	0	11	345.258	0.004214	Neutral nitrogen compounds
1259	25	31	1	1	0	11	361.258	0.00045	Neutral nitrogen compounds
1260	25	31	0	1	1	11	377.318	0.001096	Neutral nitrogen compounds
1261	25	31	2	1	0	11	377.258	7.6e-05	Neutral nitrogen compounds
1262	24	30	0	2	0	11	346.26	0.000145	Neutral nitrogen compounds
1263	24	29	0	1	0	11	331.242	0.00371	Neutral nitrogen compounds
1264	24	29	1	1	0	11	347.242	0.00034	Neutral nitrogen compounds
1265	24	29	0	1	1	11	363.302	0.001042	Neutral nitrogen compounds
1266	24	29	2	1	0	11	363.242	6.9e-05	Neutral nitrogen compounds
1267	23	28	0	2	0	11	332.244	0.00013	Neutral nitrogen compounds
1268	23	27	0	1	0	11	317.226	0.003106	Neutral nitrogen compounds
1269	23	27	1	1	0	11	333.226	0.000352	Neutral nitrogen compounds
1270	23	27	0	1	1	11	349.286	0.000971	Neutral nitrogen compounds
1271	23	27	2	1	0	11	349.226	5.1e-05	Neutral nitrogen compounds
1272	22	26	0	2	0	11	318.228	0.000116	Neutral nitrogen compounds
1273	22	25	0	1	0	11	303.21	0.002529	Neutral nitrogen compounds
1274	22	25	1	1	0	11	319.21	0.000246	Neutral nitrogen compounds
1275	22	25	0	1	1	11	335.27	0.000716	Neutral nitrogen compounds
1276	22	25	2	1	0	11	335.21	4.4e-05	Neutral nitrogen compounds
1277	21	24	0	2	0	11	304.212	7.9e-05	Neutral nitrogen compounds
1278	21	23	0	1	0	11	289.194	0.002004	Neutral nitrogen compounds
1279	21	23	1	1	0	11	305.194	0.000185	Neutral nitrogen compounds
1280	21	23	0	1	1	11	321.254	0.000583	Neutral nitrogen compounds
1281	21	23	2	1	0	11	321.194	2.7e-05	Neutral nitrogen compounds
1282	20	22	0	2	0	11	290.196	5e-05	Neutral nitrogen compounds
1283	20	21	0	1	0	11	275.178	0.00147	Neutral nitrogen compounds
1284	20	21	1	1	0	11	291.178	0.000151	Neutral nitrogen compounds
1285	20	21	0	1	1	11	307.238	0.000346	Neutral nitrogen compounds
1286	20	21	2	1	0	11	307.178	2e-05	Neutral nitrogen compounds
1287	19	20	0	2	0	11	276.18	3e-05	Neutral nitrogen compounds
1288	19	19	0	1	0	11	261.162	0.000882	Neutral nitrogen compounds
1289	19	19	1	1	0	11	277.162	9.5e-05	Neutral nitrogen compounds
1290	19	19	0	1	1	11	293.222	0.000197	Neutral nitrogen compounds
1291	18	18	0	2	0	11	262.164	1.5e-05	Neutral nitrogen compounds
1292	18	17	0	1	0	11	247.146	0.000439	Neutral nitrogen compounds
1293	18	17	1	1	0	11	263.146	4.3e-05	Neutral nitrogen compounds
1294	18	17	0	1	1	11	279.206	0.000103	Neutral nitrogen compounds
1295	17	15	0	1	0	11	233.13	0.000132	Neutral nitrogen compounds
1296	17	15	1	1	0	11	249.13	1.2e-05	Neutral nitrogen compounds
1297	17	15	0	1	1	11	265.19	4.6e-05	Neutral nitrogen compounds
1298	16	13	0	1	0	11	219.114	2.7e-05	Neutral nitrogen compounds
1299	16	13	0	1	1	11	251.174	1.8e-05	Neutral nitrogen compounds
1300	15	11	0	1	0	11	205.098	1.4e-05	Neutral nitrogen compounds
1301	15	11	0	1	1	11	237.158	8e-06	Neutral nitrogen compounds
1302	50	79	0	1	0	12	693.642	2.5e-05	Neutral nitrogen compounds
1303	49	77	0	1	0	12	679.626	5.8e-05	Neutral nitrogen compounds
1304	48	75	0	1	0	12	665.61	4.6e-05	Neutral nitrogen compounds
1305	47	73	0	1	0	12	651.594	8.6e-05	Neutral nitrogen compounds
1306	46	71	0	1	0	12	637.578	0.000135	Neutral nitrogen compounds
1307	46	71	1	1	0	12	653.578	2.4e-05	Neutral nitrogen compounds
1308	45	69	0	1	0	12	623.562	0.000182	Neutral nitrogen compounds
1309	45	69	1	1	0	12	639.562	4.1e-05	Neutral nitrogen compounds
1310	45	69	0	1	1	12	655.622	2.6e-05	Neutral nitrogen compounds
1311	44	67	0	1	0	12	609.546	0.000414	Neutral nitrogen compounds
1312	44	67	1	1	0	12	625.546	4.8e-05	Neutral nitrogen compounds
1313	44	67	0	1	1	12	641.606	2.8e-05	Neutral nitrogen compounds
1314	43	65	0	1	0	12	595.53	0.000474	Neutral nitrogen compounds
1315	43	65	1	1	0	12	611.53	3.3e-05	Neutral nitrogen compounds
1316	43	65	0	1	1	12	627.59	4.4e-05	Neutral nitrogen compounds
1317	42	63	0	1	0	12	581.514	0.000605	Neutral nitrogen compounds
1318	42	63	1	1	0	12	597.514	5.3e-05	Neutral nitrogen compounds
1319	42	63	0	1	1	12	613.574	9.1e-05	Neutral nitrogen compounds
1320	41	61	0	1	0	12	567.498	0.000921	Neutral nitrogen compounds
1321	41	61	1	1	0	12	583.498	8.2e-05	Neutral nitrogen compounds
1322	41	61	0	1	1	12	599.558	0.000117	Neutral nitrogen compounds
1323	40	59	0	1	0	12	553.482	0.001253	Neutral nitrogen compounds
1324	40	59	1	1	0	12	569.482	0.000176	Neutral nitrogen compounds
1325	40	59	0	1	1	12	585.542	0.000156	Neutral nitrogen compounds
1326	39	57	0	1	0	12	539.466	0.001577	Neutral nitrogen compounds
1327	39	57	1	1	0	12	555.466	0.0002	Neutral nitrogen compounds
1328	39	57	0	1	1	12	571.526	0.000242	Neutral nitrogen compounds
1329	38	56	0	2	0	12	540.468	6.8e-05	Neutral nitrogen compounds
1330	38	55	0	1	0	12	525.45	0.002796	Neutral nitrogen compounds
1331	38	55	1	1	0	12	541.45	0.000312	Neutral nitrogen compounds
1332	38	55	0	1	1	12	557.51	0.000331	Neutral nitrogen compounds
1333	37	54	0	2	0	12	526.452	6.6e-05	Neutral nitrogen compounds
1334	37	53	0	1	0	12	511.434	0.002542	Neutral nitrogen compounds
1335	37	53	1	1	0	12	527.434	0.000248	Neutral nitrogen compounds
1336	37	53	0	1	1	12	543.494	0.000446	Neutral nitrogen compounds
1337	37	53	2	1	0	12	543.434	3.3e-05	Neutral nitrogen compounds
1338	36	52	0	2	0	12	512.436	9.9e-05	Neutral nitrogen compounds
1339	36	51	0	1	0	12	497.418	0.002808	Neutral nitrogen compounds
1340	36	51	1	1	0	12	513.418	0.000339	Neutral nitrogen compounds
1341	36	51	0	1	1	12	529.478	0.000535	Neutral nitrogen compounds
1342	36	51	2	1	0	12	529.418	3.3e-05	Neutral nitrogen compounds
1343	35	50	0	2	0	12	498.42	0.000156	Neutral nitrogen compounds
1344	35	49	0	1	0	12	483.402	0.003533	Neutral nitrogen compounds
1345	35	49	1	1	0	12	499.402	0.000346	Neutral nitrogen compounds
1346	35	49	0	1	1	12	515.462	0.000685	Neutral nitrogen compounds
1347	35	49	2	1	0	12	515.402	5.9e-05	Neutral nitrogen compounds
1348	34	48	0	2	0	12	484.404	0.00013	Neutral nitrogen compounds
1349	34	47	0	1	0	12	469.386	0.004155	Neutral nitrogen compounds
1350	34	47	1	1	0	12	485.386	0.000398	Neutral nitrogen compounds
1351	34	47	0	1	1	12	501.446	0.000989	Neutral nitrogen compounds
1352	34	47	2	1	0	12	501.386	8.5e-05	Neutral nitrogen compounds
1353	33	46	0	2	0	12	470.388	0.000168	Neutral nitrogen compounds
1354	33	45	0	1	0	12	455.37	0.00371	Neutral nitrogen compounds
1355	33	45	1	1	0	12	471.37	0.000449	Neutral nitrogen compounds
1356	33	45	0	1	1	12	487.43	0.001357	Neutral nitrogen compounds
1357	33	45	2	1	0	12	487.37	0.000111	Neutral nitrogen compounds
1358	32	44	0	2	0	12	456.372	0.000129	Neutral nitrogen compounds
1359	32	43	0	1	0	12	441.354	0.003949	Neutral nitrogen compounds
1360	32	43	1	1	0	12	457.354	0.000517	Neutral nitrogen compounds
1361	32	43	0	1	1	12	473.414	0.001002	Neutral nitrogen compounds
1362	32	43	2	1	0	12	473.354	8.4e-05	Neutral nitrogen compounds
1363	31	42	0	2	0	12	442.356	0.000163	Neutral nitrogen compounds
1364	31	41	0	1	0	12	427.338	0.00414	Neutral nitrogen compounds
1365	31	41	1	1	0	12	443.338	0.000545	Neutral nitrogen compounds
1366	31	41	0	1	1	12	459.398	0.001404	Neutral nitrogen compounds
1367	31	41	2	1	0	12	459.338	0.000119	Neutral nitrogen compounds
1368	30	40	0	2	0	12	428.34	0.000158	Neutral nitrogen compounds
1369	30	39	0	1	0	12	413.322	0.004339	Neutral nitrogen compounds
1370	30	39	1	1	0	12	429.322	0.00055	Neutral nitrogen compounds
1371	30	39	0	1	1	12	445.382	0.001253	Neutral nitrogen compounds
1372	30	39	2	1	0	12	445.322	9.6e-05	Neutral nitrogen compounds
1373	29	38	0	2	0	12	414.324	0.000177	Neutral nitrogen compounds
1374	29	37	0	1	0	12	399.306	0.004411	Neutral nitrogen compounds
1375	29	37	1	1	0	12	415.306	0.000523	Neutral nitrogen compounds
1376	29	37	0	1	1	12	431.366	0.001183	Neutral nitrogen compounds
1377	29	37	2	1	0	12	431.306	0.000101	Neutral nitrogen compounds
1378	28	36	0	2	0	12	400.308	0.000192	Neutral nitrogen compounds
1379	28	35	0	1	0	12	385.29	0.004403	Neutral nitrogen compounds
1380	28	35	1	1	0	12	401.29	0.000476	Neutral nitrogen compounds
1381	28	35	0	1	1	12	417.35	0.001198	Neutral nitrogen compounds
1382	28	35	2	1	0	12	417.29	9.9e-05	Neutral nitrogen compounds
1383	27	34	0	2	0	12	386.292	0.000185	Neutral nitrogen compounds
1384	27	33	0	1	0	12	371.274	0.004196	Neutral nitrogen compounds
1385	27	33	1	1	0	12	387.274	0.000463	Neutral nitrogen compounds
1386	27	33	0	1	1	12	403.334	0.00113	Neutral nitrogen compounds
1387	27	33	2	1	0	12	403.274	8.7e-05	Neutral nitrogen compounds
1388	26	32	0	2	0	12	372.276	0.000185	Neutral nitrogen compounds
1389	26	31	0	1	0	12	357.258	0.003717	Neutral nitrogen compounds
1390	26	31	1	1	0	12	373.258	0.000442	Neutral nitrogen compounds
1391	26	31	0	1	1	12	389.318	0.001287	Neutral nitrogen compounds
1392	26	31	2	1	0	12	389.258	0.000123	Neutral nitrogen compounds
1393	25	30	0	2	0	12	358.26	0.000181	Neutral nitrogen compounds
1394	25	29	0	1	0	12	343.242	0.003209	Neutral nitrogen compounds
1395	25	29	1	1	0	12	359.242	0.000441	Neutral nitrogen compounds
1396	25	29	0	1	1	12	375.302	0.001112	Neutral nitrogen compounds
1397	25	29	2	1	0	12	375.242	7.9e-05	Neutral nitrogen compounds
1398	24	28	0	2	0	12	344.244	0.00016	Neutral nitrogen compounds
1399	24	27	0	1	0	12	329.226	0.003003	Neutral nitrogen compounds
1400	24	27	1	1	0	12	345.226	0.000378	Neutral nitrogen compounds
1401	24	27	0	1	1	12	361.286	0.00099	Neutral nitrogen compounds
1402	24	27	2	1	0	12	361.226	8e-05	Neutral nitrogen compounds
1403	23	26	0	2	0	12	330.228	0.000144	Neutral nitrogen compounds
1404	23	25	0	1	0	12	315.21	0.00269	Neutral nitrogen compounds
1405	23	25	1	1	0	12	331.21	0.000297	Neutral nitrogen compounds
1406	23	25	0	1	1	12	347.27	0.000907	Neutral nitrogen compounds
1407	23	25	2	1	0	12	347.21	7.4e-05	Neutral nitrogen compounds
1408	22	24	0	2	0	12	316.212	0.000142	Neutral nitrogen compounds
1409	22	23	0	1	0	12	301.194	0.002076	Neutral nitrogen compounds
1410	22	23	1	1	0	12	317.194	0.000266	Neutral nitrogen compounds
1411	22	23	0	1	1	12	333.254	0.001071	Neutral nitrogen compounds
1412	22	23	2	1	0	12	333.194	7.7e-05	Neutral nitrogen compounds
1413	21	22	0	2	0	12	302.196	0.000129	Neutral nitrogen compounds
1414	21	21	0	1	0	12	287.178	0.001452	Neutral nitrogen compounds
1415	21	21	1	1	0	12	303.178	0.000208	Neutral nitrogen compounds
1416	21	21	0	1	1	12	319.238	0.001035	Neutral nitrogen compounds
1417	21	21	2	1	0	12	319.178	4.4e-05	Neutral nitrogen compounds
1418	20	20	0	2	0	12	288.18	0.000104	Neutral nitrogen compounds
1419	20	19	0	1	0	12	273.162	0.001026	Neutral nitrogen compounds
1420	20	19	1	1	0	12	289.162	0.000126	Neutral nitrogen compounds
1421	20	19	0	1	1	12	305.222	0.001101	Neutral nitrogen compounds
1422	20	19	2	1	0	12	305.162	1.7e-05	Neutral nitrogen compounds
1423	19	18	0	2	0	12	274.164	6.6e-05	Neutral nitrogen compounds
1424	19	17	0	1	0	12	259.146	0.000634	Neutral nitrogen compounds
1425	19	17	1	1	0	12	275.146	6.8e-05	Neutral nitrogen compounds
1426	19	17	0	1	1	12	291.206	0.001115	Neutral nitrogen compounds
1427	18	16	0	2	0	12	260.148	3.6e-05	Neutral nitrogen compounds
1428	18	15	0	1	0	12	245.13	0.000264	Neutral nitrogen compounds
1429	18	15	1	1	0	12	261.13	3.2e-05	Neutral nitrogen compounds
1430	18	15	0	1	1	12	277.19	0.000642	Neutral nitrogen compounds
1431	17	13	0	1	0	12	231.114	6.4e-05	Neutral nitrogen compounds
1432	17	13	1	1	0	12	247.114	1.3e-05	Neutral nitrogen compounds
1433	17	13	0	1	1	12	263.174	0.000224	Neutral nitrogen compounds
1434	16	11	0	1	0	12	217.098	1.8e-05	Neutral nitrogen compounds
1435	16	11	0	1	1	12	249.158	2.6e-05	Neutral nitrogen compounds
1436	49	75	0	1	0	13	677.61	3e-05	Neutral nitrogen compounds
1437	48	73	0	1	0	13	663.594	8.7e-05	Neutral nitrogen compounds
1438	47	71	0	1	0	13	649.578	9.9e-05	Neutral nitrogen compounds
1439	46	69	0	1	0	13	635.562	0.000165	Neutral nitrogen compounds
1440	45	67	0	1	0	13	621.546	0.000279	Neutral nitrogen compounds
1441	45	67	0	1	1	13	653.606	3.3e-05	Neutral nitrogen compounds
1442	44	65	0	1	0	13	607.53	0.000296	Neutral nitrogen compounds
1443	44	65	1	1	0	13	623.53	2.6e-05	Neutral nitrogen compounds
1444	44	65	0	1	1	13	639.59	6.7e-05	Neutral nitrogen compounds
1445	43	63	0	1	0	13	593.514	0.000444	Neutral nitrogen compounds
1446	43	63	1	1	0	13	609.514	5.5e-05	Neutral nitrogen compounds
1447	43	63	0	1	1	13	625.574	8.2e-05	Neutral nitrogen compounds
1448	42	61	0	1	0	13	579.498	0.000572	Neutral nitrogen compounds
1449	42	61	1	1	0	13	595.498	6e-05	Neutral nitrogen compounds
1450	42	61	0	1	1	13	611.558	6.9e-05	Neutral nitrogen compounds
1451	41	59	0	1	0	13	565.482	0.000976	Neutral nitrogen compounds
1452	41	59	1	1	0	13	581.482	8.7e-05	Neutral nitrogen compounds
1453	41	59	0	1	1	13	597.542	0.000108	Neutral nitrogen compounds
1454	40	57	0	1	0	13	551.466	0.001609	Neutral nitrogen compounds
1455	40	57	1	1	0	13	567.466	0.000128	Neutral nitrogen compounds
1456	40	57	0	1	1	13	583.526	0.000187	Neutral nitrogen compounds
1457	39	55	0	1	0	13	537.45	0.001351	Neutral nitrogen compounds
1458	39	55	1	1	0	13	553.45	0.000178	Neutral nitrogen compounds
1459	39	55	0	1	1	13	569.51	0.000385	Neutral nitrogen compounds
1460	38	53	0	1	0	13	523.434	0.001644	Neutral nitrogen compounds
1461	38	53	1	1	0	13	539.434	0.000205	Neutral nitrogen compounds
1462	38	53	0	1	1	13	555.494	0.000389	Neutral nitrogen compounds
1463	38	53	2	1	0	13	555.434	5.2e-05	Neutral nitrogen compounds
1464	37	51	0	1	0	13	509.418	0.001792	Neutral nitrogen compounds
1465	37	51	1	1	0	13	525.418	0.000351	Neutral nitrogen compounds
1466	37	51	0	1	1	13	541.478	0.00061	Neutral nitrogen compounds
1467	37	51	2	1	0	13	541.418	8.1e-05	Neutral nitrogen compounds
1468	36	50	0	2	0	13	510.42	0.000109	Neutral nitrogen compounds
1469	36	49	0	1	0	13	495.402	0.00309	Neutral nitrogen compounds
1470	36	49	1	1	0	13	511.402	0.000297	Neutral nitrogen compounds
1471	36	49	0	1	1	13	527.462	0.000457	Neutral nitrogen compounds
1472	36	49	2	1	0	13	527.402	3.3e-05	Neutral nitrogen compounds
1473	35	48	0	2	0	13	496.404	0.000108	Neutral nitrogen compounds
1474	35	47	0	1	0	13	481.386	0.002336	Neutral nitrogen compounds
1475	35	47	1	1	0	13	497.386	0.000374	Neutral nitrogen compounds
1476	35	47	0	1	1	13	513.446	0.000658	Neutral nitrogen compounds
1477	35	47	2	1	0	13	513.386	4.7e-05	Neutral nitrogen compounds
1478	34	46	0	2	0	13	482.388	0.000132	Neutral nitrogen compounds
1479	34	45	0	1	0	13	467.37	0.002574	Neutral nitrogen compounds
1480	34	45	1	1	0	13	483.37	0.000448	Neutral nitrogen compounds
1481	34	45	0	1	1	13	499.43	0.000642	Neutral nitrogen compounds
1482	34	45	2	1	0	13	499.37	6.3e-05	Neutral nitrogen compounds
1483	33	44	0	2	0	13	468.372	0.000158	Neutral nitrogen compounds
1484	33	43	0	1	0	13	453.354	0.003092	Neutral nitrogen compounds
1485	33	43	1	1	0	13	469.354	0.00044	Neutral nitrogen compounds
1486	33	43	0	1	1	13	485.414	0.000718	Neutral nitrogen compounds
1487	33	43	2	1	0	13	485.354	7.3e-05	Neutral nitrogen compounds
1488	32	42	0	2	0	13	454.356	0.000164	Neutral nitrogen compounds
1489	32	41	0	1	0	13	439.338	0.002883	Neutral nitrogen compounds
1490	32	41	1	1	0	13	455.338	0.000391	Neutral nitrogen compounds
1491	32	41	0	1	1	13	471.398	0.000818	Neutral nitrogen compounds
1492	32	41	2	1	0	13	471.338	8.4e-05	Neutral nitrogen compounds
1493	31	40	0	2	0	13	440.34	0.000166	Neutral nitrogen compounds
1494	31	39	0	1	0	13	425.322	0.002891	Neutral nitrogen compounds
1495	31	39	1	1	0	13	441.322	0.000437	Neutral nitrogen compounds
1496	31	39	0	1	1	13	457.382	0.000968	Neutral nitrogen compounds
1497	31	39	2	1	0	13	457.322	0.000101	Neutral nitrogen compounds
1498	30	38	0	2	0	13	426.324	0.000169	Neutral nitrogen compounds
1499	30	37	0	1	0	13	411.306	0.003148	Neutral nitrogen compounds
1500	30	37	1	1	0	13	427.306	0.000489	Neutral nitrogen compounds
1501	30	37	0	1	1	13	443.366	0.000984	Neutral nitrogen compounds
1502	30	37	2	1	0	13	443.306	0.000102	Neutral nitrogen compounds
1503	29	36	0	2	0	13	412.308	0.000166	Neutral nitrogen compounds
1504	29	35	0	1	0	13	397.29	0.003207	Neutral nitrogen compounds
1505	29	35	1	1	0	13	413.29	0.000442	Neutral nitrogen compounds
1506	29	35	0	1	1	13	429.35	0.00099	Neutral nitrogen compounds
1507	29	35	2	1	0	13	429.29	0.00011	Neutral nitrogen compounds
1508	28	34	0	2	0	13	398.292	0.00019	Neutral nitrogen compounds
1509	28	33	0	1	0	13	383.274	0.00309	Neutral nitrogen compounds
1510	28	33	1	1	0	13	399.274	0.000439	Neutral nitrogen compounds
1511	28	33	0	1	1	13	415.334	0.000913	Neutral nitrogen compounds
1512	28	33	2	1	0	13	415.274	8.9e-05	Neutral nitrogen compounds
1513	27	32	0	2	0	13	384.276	0.000211	Neutral nitrogen compounds
1514	27	31	0	1	0	13	369.258	0.002799	Neutral nitrogen compounds
1515	27	31	1	1	0	13	385.258	0.000402	Neutral nitrogen compounds
1516	27	31	0	1	1	13	401.318	0.000856	Neutral nitrogen compounds
1517	27	31	2	1	0	13	401.258	9.3e-05	Neutral nitrogen compounds
1518	26	30	0	2	0	13	370.26	0.000164	Neutral nitrogen compounds
1519	26	29	0	1	0	13	355.242	0.002436	Neutral nitrogen compounds
1520	26	29	1	1	0	13	371.242	0.000461	Neutral nitrogen compounds
1521	26	29	0	1	1	13	387.302	0.000841	Neutral nitrogen compounds
1522	26	29	2	1	0	13	387.242	8.9e-05	Neutral nitrogen compounds
1523	25	28	0	2	0	13	356.244	0.000186	Neutral nitrogen compounds
1524	25	27	0	1	0	13	341.226	0.002032	Neutral nitrogen compounds
1525	25	27	1	1	0	13	357.226	0.000317	Neutral nitrogen compounds
1526	25	27	0	1	1	13	373.286	0.000865	Neutral nitrogen compounds
1527	25	27	2	1	0	13	373.226	8.2e-05	Neutral nitrogen compounds
1528	24	26	0	2	0	13	342.228	0.000157	Neutral nitrogen compounds
1529	24	25	0	1	0	13	327.21	0.001687	Neutral nitrogen compounds
1530	24	25	1	1	0	13	343.21	0.00027	Neutral nitrogen compounds
1531	24	25	0	1	1	13	359.27	0.000925	Neutral nitrogen compounds
1532	24	25	2	1	0	13	359.21	6.9e-05	Neutral nitrogen compounds
1533	23	24	0	2	0	13	328.212	0.000122	Neutral nitrogen compounds
1534	23	23	0	1	0	13	313.194	0.001246	Neutral nitrogen compounds
1535	23	23	1	1	0	13	329.194	0.000205	Neutral nitrogen compounds
1536	23	23	0	1	1	13	345.254	0.000783	Neutral nitrogen compounds
1537	23	23	2	1	0	13	345.194	4.4e-05	Neutral nitrogen compounds
1538	22	22	0	2	0	13	314.196	9.5e-05	Neutral nitrogen compounds
1539	22	21	0	1	0	13	299.178	0.00088	Neutral nitrogen compounds
1540	22	21	1	1	0	13	315.178	0.000173	Neutral nitrogen compounds
1541	22	21	0	1	1	13	331.238	0.000569	Neutral nitrogen compounds
1542	22	21	2	1	0	13	331.178	1.8e-05	Neutral nitrogen compounds
1543	21	20	0	2	0	13	300.18	5.2e-05	Neutral nitrogen compounds
1544	21	19	0	1	0	13	285.162	0.00058	Neutral nitrogen compounds
1545	21	19	1	1	0	13	301.162	0.000142	Neutral nitrogen compounds
1546	21	19	0	1	1	13	317.222	0.000364	Neutral nitrogen compounds
1547	21	19	2	1	0	13	317.162	1.1e-05	Neutral nitrogen compounds
1548	20	18	0	2	0	13	286.164	2.4e-05	Neutral nitrogen compounds
1549	20	17	0	1	0	13	271.146	0.000355	Neutral nitrogen compounds
1550	20	17	1	1	0	13	287.146	7.1e-05	Neutral nitrogen compounds
1551	20	17	0	1	1	13	303.206	0.000157	Neutral nitrogen compounds
1552	20	17	2	1	0	13	303.146	1.3e-05	Neutral nitrogen compounds
1553	19	15	0	1	0	13	257.13	0.000164	Neutral nitrogen compounds
1554	19	15	1	1	0	13	273.13	3.9e-05	Neutral nitrogen compounds
1555	19	15	0	1	1	13	289.19	5.6e-05	Neutral nitrogen compounds
1556	18	13	0	1	0	13	243.114	4.6e-05	Neutral nitrogen compounds
1557	18	13	1	1	0	13	259.114	1.3e-05	Neutral nitrogen compounds
1558	18	13	0	1	1	13	275.174	1.8e-05	Neutral nitrogen compounds
1559	17	11	0	1	0	13	229.098	1.2e-05	Neutral nitrogen compounds
1560	52	79	0	1	0	14	717.642	4.1e-05	Neutral nitrogen compounds
1561	50	75	0	1	0	14	689.61	3.8e-05	Neutral nitrogen compounds
1562	49	73	0	1	0	14	675.594	2.8e-05	Neutral nitrogen compounds
1563	48	71	0	1	0	14	661.578	4.2e-05	Neutral nitrogen compounds
1564	47	69	0	1	0	14	647.562	5.1e-05	Neutral nitrogen compounds
1565	46	67	0	1	0	14	633.546	6.6e-05	Neutral nitrogen compounds
1566	45	65	0	1	0	14	619.53	0.000142	Neutral nitrogen compounds
1567	45	65	1	1	0	14	635.53	2.3e-05	Neutral nitrogen compounds
1568	44	63	0	1	0	14	605.514	0.000289	Neutral nitrogen compounds
1569	44	63	1	1	0	14	621.514	5.1e-05	Neutral nitrogen compounds
1570	44	63	0	1	1	14	637.574	3.5e-05	Neutral nitrogen compounds
1571	43	61	0	1	0	14	591.498	0.000339	Neutral nitrogen compounds
1572	43	61	1	1	0	14	607.498	4.8e-05	Neutral nitrogen compounds
1573	43	61	0	1	1	14	623.558	4.8e-05	Neutral nitrogen compounds
1574	42	59	0	1	0	14	577.482	0.000467	Neutral nitrogen compounds
1575	42	59	1	1	0	14	593.482	7e-05	Neutral nitrogen compounds
1576	42	59	0	1	1	14	609.542	8.9e-05	Neutral nitrogen compounds
1577	41	57	0	1	0	14	563.466	0.000574	Neutral nitrogen compounds
1578	41	57	1	1	0	14	579.466	8.1e-05	Neutral nitrogen compounds
1579	41	57	0	1	1	14	595.526	0.000104	Neutral nitrogen compounds
1580	40	55	0	1	0	14	549.45	0.000764	Neutral nitrogen compounds
1581	40	55	1	1	0	14	565.45	0.000155	Neutral nitrogen compounds
1582	40	55	0	1	1	14	581.51	0.00013	Neutral nitrogen compounds
1583	39	53	0	1	0	14	535.434	0.001085	Neutral nitrogen compounds
1584	39	53	1	1	0	14	551.434	0.000254	Neutral nitrogen compounds
1585	39	53	0	1	1	14	567.494	0.000237	Neutral nitrogen compounds
1586	38	51	0	1	0	14	521.418	0.001238	Neutral nitrogen compounds
1587	38	51	1	1	0	14	537.418	0.000196	Neutral nitrogen compounds
1588	38	51	0	1	1	14	553.478	0.000284	Neutral nitrogen compounds
1589	38	51	2	1	0	14	553.418	2.8e-05	Neutral nitrogen compounds
1590	37	50	0	2	0	14	522.42	0.000101	Neutral nitrogen compounds
1591	37	49	0	1	0	14	507.402	0.001495	Neutral nitrogen compounds
1592	37	49	1	1	0	14	523.402	0.000244	Neutral nitrogen compounds
1593	37	49	0	1	1	14	539.462	0.000354	Neutral nitrogen compounds
1594	37	49	2	1	0	14	539.402	3.9e-05	Neutral nitrogen compounds
1595	36	48	0	2	0	14	508.404	0.000122	Neutral nitrogen compounds
1596	36	47	0	1	0	14	493.386	0.001781	Neutral nitrogen compounds
1597	36	47	1	1	0	14	509.386	0.000279	Neutral nitrogen compounds
1598	36	47	0	1	1	14	525.446	0.000641	Neutral nitrogen compounds
1599	36	47	2	1	0	14	525.386	8.1e-05	Neutral nitrogen compounds
1600	35	46	0	2	0	14	494.388	0.000117	Neutral nitrogen compounds
1601	35	45	0	1	0	14	479.37	0.002286	Neutral nitrogen compounds
1602	35	45	1	1	0	14	495.37	0.000436	Neutral nitrogen compounds
1603	35	45	0	1	1	14	511.43	0.000571	Neutral nitrogen compounds
1604	35	45	2	1	0	14	511.37	6.4e-05	Neutral nitrogen compounds
1605	34	44	0	2	0	14	480.372	0.000154	Neutral nitrogen compounds
1606	34	43	0	1	0	14	465.354	0.002087	Neutral nitrogen compounds
1607	34	43	1	1	0	14	481.354	0.000355	Neutral nitrogen compounds
1608	34	43	0	1	1	14	497.414	0.000676	Neutral nitrogen compounds
1609	34	43	2	1	0	14	497.354	5e-05	Neutral nitrogen compounds
1610	33	42	0	2	0	14	466.356	0.000127	Neutral nitrogen compounds
1611	33	41	0	1	0	14	451.338	0.002022	Neutral nitrogen compounds
1612	33	41	1	1	0	14	467.338	0.000377	Neutral nitrogen compounds
1613	33	41	0	1	1	14	483.398	0.00074	Neutral nitrogen compounds
1614	33	41	2	1	0	14	483.338	8e-05	Neutral nitrogen compounds
1615	32	40	0	2	0	14	452.34	0.000213	Neutral nitrogen compounds
1616	32	39	0	1	0	14	437.322	0.002003	Neutral nitrogen compounds
1617	32	39	1	1	0	14	453.322	0.000464	Neutral nitrogen compounds
1618	32	39	0	1	1	14	469.382	0.000858	Neutral nitrogen compounds
1619	32	39	2	1	0	14	469.322	9.4e-05	Neutral nitrogen compounds
1620	31	38	0	2	0	14	438.324	0.000142	Neutral nitrogen compounds
1621	31	37	0	1	0	14	423.306	0.00213	Neutral nitrogen compounds
1622	31	37	1	1	0	14	439.306	0.000408	Neutral nitrogen compounds
1623	31	37	0	1	1	14	455.366	0.000692	Neutral nitrogen compounds
1624	31	37	2	1	0	14	455.306	6.6e-05	Neutral nitrogen compounds
1625	30	36	0	2	0	14	424.308	0.000147	Neutral nitrogen compounds
1626	30	35	0	1	0	14	409.29	0.001206	Neutral nitrogen compounds
1627	30	35	1	1	0	14	425.29	0.000447	Neutral nitrogen compounds
1628	30	35	0	1	1	14	441.35	0.000844	Neutral nitrogen compounds
1629	30	35	2	1	0	14	441.29	9.3e-05	Neutral nitrogen compounds
1630	29	34	0	2	0	14	410.292	0.000158	Neutral nitrogen compounds
1631	29	33	0	1	0	14	395.274	0.001996	Neutral nitrogen compounds
1632	29	33	1	1	0	14	411.274	0.000442	Neutral nitrogen compounds
1633	29	33	0	1	1	14	427.334	0.000843	Neutral nitrogen compounds
1634	29	33	2	1	0	14	427.274	9.4e-05	Neutral nitrogen compounds
1635	28	32	0	2	0	14	396.276	0.000158	Neutral nitrogen compounds
1636	28	31	0	1	0	14	381.258	0.00188	Neutral nitrogen compounds
1637	28	31	1	1	0	14	397.258	0.000402	Neutral nitrogen compounds
1638	28	31	0	1	1	14	413.318	0.000781	Neutral nitrogen compounds
1639	28	31	2	1	0	14	413.258	8.7e-05	Neutral nitrogen compounds
1640	27	30	0	2	0	14	382.26	0.000149	Neutral nitrogen compounds
1641	27	29	0	1	0	14	367.242	0.001601	Neutral nitrogen compounds
1642	27	29	1	1	0	14	383.242	0.000401	Neutral nitrogen compounds
1643	27	29	0	1	1	14	399.302	0.000694	Neutral nitrogen compounds
1644	27	29	2	1	0	14	399.242	7.2e-05	Neutral nitrogen compounds
1645	26	28	0	2	0	14	368.244	0.000137	Neutral nitrogen compounds
1646	26	27	0	1	0	14	353.226	0.001496	Neutral nitrogen compounds
1647	26	27	1	1	0	14	369.226	0.000332	Neutral nitrogen compounds
1648	26	27	0	1	1	14	385.286	0.000618	Neutral nitrogen compounds
1649	26	27	2	1	0	14	385.226	5.8e-05	Neutral nitrogen compounds
1650	25	26	0	2	0	14	354.228	8.7e-05	Neutral nitrogen compounds
1651	25	25	0	1	0	14	339.21	0.000935	Neutral nitrogen compounds
1652	25	25	1	1	0	14	355.21	0.000327	Neutral nitrogen compounds
1653	25	25	0	1	1	14	371.27	0.000593	Neutral nitrogen compounds
1654	25	25	2	1	0	14	371.21	6.4e-05	Neutral nitrogen compounds
1655	24	24	0	2	0	14	340.212	5.5e-05	Neutral nitrogen compounds
1656	24	23	0	1	0	14	325.194	0.00071	Neutral nitrogen compounds
1657	24	23	1	1	0	14	341.194	0.000343	Neutral nitrogen compounds
1658	24	23	0	1	1	14	357.254	0.000378	Neutral nitrogen compounds
1659	24	23	2	1	0	14	357.194	5.6e-05	Neutral nitrogen compounds
1660	23	22	0	2	0	14	326.196	4.1e-05	Neutral nitrogen compounds
1661	23	21	0	1	0	14	311.178	0.000465	Neutral nitrogen compounds
1662	23	21	1	1	0	14	327.178	0.000294	Neutral nitrogen compounds
1663	23	21	0	1	1	14	343.238	0.000247	Neutral nitrogen compounds
1664	23	21	2	1	0	14	343.178	3.6e-05	Neutral nitrogen compounds
1665	22	20	0	2	0	14	312.18	2e-05	Neutral nitrogen compounds
1666	22	19	0	1	0	14	297.162	0.000289	Neutral nitrogen compounds
1667	22	19	1	1	0	14	313.162	0.000255	Neutral nitrogen compounds
1668	22	19	0	1	1	14	329.222	0.00018	Neutral nitrogen compounds
1669	22	19	2	1	0	14	329.162	2.3e-05	Neutral nitrogen compounds
1670	21	18	0	2	0	14	298.164	1.5e-05	Neutral nitrogen compounds
1671	21	17	0	1	0	14	283.146	0.000116	Neutral nitrogen compounds
1672	21	17	1	1	0	14	299.146	0.000146	Neutral nitrogen compounds
1673	21	17	0	1	1	14	315.206	0.000123	Neutral nitrogen compounds
1674	21	17	2	1	0	14	315.146	1.9e-05	Neutral nitrogen compounds
1675	20	15	0	1	0	14	269.13	4.1e-05	Neutral nitrogen compounds
1676	20	15	1	1	0	14	285.13	3.6e-05	Neutral nitrogen compounds
1677	20	15	0	1	1	14	301.19	6.8e-05	Neutral nitrogen compounds
1678	19	13	0	1	0	14	255.114	1.6e-05	Neutral nitrogen compounds
1679	19	13	1	1	0	14	271.114	1.2e-05	Neutral nitrogen compounds
1680	19	13	0	1	1	14	287.174	1.9e-05	Neutral nitrogen compounds
1681	18	11	0	1	0	14	241.098	1e-05	Neutral nitrogen compounds
1682	49	71	0	1	0	15	673.578	3.9e-05	Neutral nitrogen compounds
1683	48	69	0	1	0	15	659.562	2.5e-05	Neutral nitrogen compounds
1684	47	67	0	1	0	15	645.546	6.4e-05	Neutral nitrogen compounds
1685	47	67	0	1	1	15	677.606	2.7e-05	Neutral nitrogen compounds
1686	46	65	0	1	0	15	631.53	0.000105	Neutral nitrogen compounds
1687	45	63	0	1	0	15	617.514	0.000179	Neutral nitrogen compounds
1688	45	63	0	1	1	15	649.574	3.3e-05	Neutral nitrogen compounds
1689	44	61	0	1	0	15	603.498	0.000237	Neutral nitrogen compounds
1690	44	61	0	1	1	15	635.558	4.8e-05	Neutral nitrogen compounds
1691	43	59	0	1	0	15	589.482	0.000213	Neutral nitrogen compounds
1692	43	59	1	1	0	15	605.482	4.3e-05	Neutral nitrogen compounds
1693	43	59	0	1	1	15	621.542	6.8e-05	Neutral nitrogen compounds
1694	42	57	0	1	0	15	575.466	0.000326	Neutral nitrogen compounds
1695	42	57	1	1	0	15	591.466	5.4e-05	Neutral nitrogen compounds
1696	42	57	0	1	1	15	607.526	6.3e-05	Neutral nitrogen compounds
1697	41	55	0	1	0	15	561.45	0.000473	Neutral nitrogen compounds
1698	41	55	1	1	0	15	577.45	8.9e-05	Neutral nitrogen compounds
1699	41	55	0	1	1	15	593.51	7.5e-05	Neutral nitrogen compounds
1700	40	53	0	1	0	15	547.434	0.000715	Neutral nitrogen compounds
1701	40	53	1	1	0	15	563.434	9.9e-05	Neutral nitrogen compounds
1702	40	53	0	1	1	15	579.494	0.000113	Neutral nitrogen compounds
1703	39	51	0	1	0	15	533.418	0.000746	Neutral nitrogen compounds
1704	39	51	1	1	0	15	549.418	0.000127	Neutral nitrogen compounds
1705	39	51	0	1	1	15	565.478	0.000228	Neutral nitrogen compounds
1706	39	51	2	1	0	15	565.418	2.9e-05	Neutral nitrogen compounds
1707	38	49	0	1	0	15	519.402	0.000939	Neutral nitrogen compounds
1708	38	49	1	1	0	15	535.402	0.000172	Neutral nitrogen compounds
1709	38	49	0	1	1	15	551.462	0.000377	Neutral nitrogen compounds
1710	38	49	2	1	0	15	551.402	4.2e-05	Neutral nitrogen compounds
1711	37	47	0	1	0	15	505.386	0.001047	Neutral nitrogen compounds
1712	37	47	1	1	0	15	521.386	0.000205	Neutral nitrogen compounds
1713	37	47	0	1	1	15	537.446	0.000272	Neutral nitrogen compounds
1714	37	47	2	1	0	15	537.386	3.3e-05	Neutral nitrogen compounds
1715	36	46	0	2	0	15	506.388	9.4e-05	Neutral nitrogen compounds
1716	36	45	0	1	0	15	491.37	0.001175	Neutral nitrogen compounds
1717	36	45	1	1	0	15	507.37	0.000267	Neutral nitrogen compounds
1718	36	45	0	1	1	15	523.43	0.000351	Neutral nitrogen compounds
1719	36	45	2	1	0	15	523.37	5.4e-05	Neutral nitrogen compounds
1720	35	44	0	2	0	15	492.372	0.000102	Neutral nitrogen compounds
1721	35	43	0	1	0	15	477.354	0.001222	Neutral nitrogen compounds
1722	35	43	1	1	0	15	493.354	0.000289	Neutral nitrogen compounds
1723	35	43	0	1	1	15	509.414	0.000368	Neutral nitrogen compounds
1724	35	43	2	1	0	15	509.354	4.1e-05	Neutral nitrogen compounds
1725	34	42	0	2	0	15	478.356	0.00012	Neutral nitrogen compounds
1726	34	41	0	1	0	15	463.338	0.001347	Neutral nitrogen compounds
1727	34	41	1	1	0	15	479.338	0.000411	Neutral nitrogen compounds
1728	34	41	0	1	1	15	495.398	0.000512	Neutral nitrogen compounds
1729	34	41	2	1	0	15	495.338	6.5e-05	Neutral nitrogen compounds
1730	33	40	0	2	0	15	464.34	0.000169	Neutral nitrogen compounds
1731	33	39	0	1	0	15	449.322	0.001299	Neutral nitrogen compounds
1732	33	39	1	1	0	15	465.322	0.000323	Neutral nitrogen compounds
1733	33	39	0	1	1	15	481.382	0.000495	Neutral nitrogen compounds
1734	33	39	2	1	0	15	481.322	5.7e-05	Neutral nitrogen compounds
1735	32	38	0	2	0	15	450.324	0.000113	Neutral nitrogen compounds
1736	32	37	0	1	0	15	435.306	0.001457	Neutral nitrogen compounds
1737	32	37	1	1	0	15	451.306	0.00036	Neutral nitrogen compounds
1738	32	37	0	1	1	15	467.366	0.000502	Neutral nitrogen compounds
1739	32	37	2	1	0	15	467.306	6.2e-05	Neutral nitrogen compounds
1740	31	36	0	2	0	15	436.308	0.000107	Neutral nitrogen compounds
1741	31	35	0	1	0	15	421.29	0.001391	Neutral nitrogen compounds
1742	31	35	1	1	0	15	437.29	0.000313	Neutral nitrogen compounds
1743	31	35	0	1	1	15	453.35	0.000516	Neutral nitrogen compounds
1744	31	35	2	1	0	15	453.29	7.9e-05	Neutral nitrogen compounds
1745	30	34	0	2	0	15	422.292	0.000116	Neutral nitrogen compounds
1746	30	33	0	1	0	15	407.274	0.001467	Neutral nitrogen compounds
1747	30	33	1	1	0	15	423.274	0.000311	Neutral nitrogen compounds
1748	30	33	0	1	1	15	439.334	0.00047	Neutral nitrogen compounds
1749	30	33	2	1	0	15	439.274	7.4e-05	Neutral nitrogen compounds
1750	29	32	0	2	0	15	408.276	8.2e-05	Neutral nitrogen compounds
1751	29	31	0	1	0	15	393.258	0.001181	Neutral nitrogen compounds
1752	29	31	1	1	0	15	409.258	0.000219	Neutral nitrogen compounds
1753	29	31	0	1	1	15	425.318	0.000518	Neutral nitrogen compounds
1754	29	31	2	1	0	15	425.258	6.7e-05	Neutral nitrogen compounds
1755	28	30	0	2	0	15	394.26	0.000104	Neutral nitrogen compounds
1756	28	29	0	1	0	15	379.242	0.001212	Neutral nitrogen compounds
1757	28	29	1	1	0	15	395.242	0.000269	Neutral nitrogen compounds
1758	28	29	0	1	1	15	411.302	0.000496	Neutral nitrogen compounds
1759	28	29	2	1	0	15	411.242	6.5e-05	Neutral nitrogen compounds
1760	27	28	0	2	0	15	380.244	8.9e-05	Neutral nitrogen compounds
1761	27	27	0	1	0	15	365.226	0.001001	Neutral nitrogen compounds
1762	27	27	1	1	0	15	381.226	0.000253	Neutral nitrogen compounds
1763	27	27	0	1	1	15	397.286	0.000397	Neutral nitrogen compounds
1764	27	27	2	1	0	15	397.226	5.6e-05	Neutral nitrogen compounds
1765	26	26	0	2	0	15	366.228	6.8e-05	Neutral nitrogen compounds
1766	26	25	0	1	0	15	351.21	0.000744	Neutral nitrogen compounds
1767	26	25	1	1	0	15	367.21	0.000231	Neutral nitrogen compounds
1768	26	25	0	1	1	15	383.27	0.000352	Neutral nitrogen compounds
1769	26	25	2	1	0	15	383.21	5e-05	Neutral nitrogen compounds
1770	25	24	0	2	0	15	352.212	5.7e-05	Neutral nitrogen compounds
1771	25	23	0	1	0	15	337.194	0.000679	Neutral nitrogen compounds
1772	25	23	1	1	0	15	353.194	0.0002	Neutral nitrogen compounds
1773	25	23	0	1	1	15	369.254	0.000336	Neutral nitrogen compounds
1774	25	23	2	1	0	15	369.194	3.7e-05	Neutral nitrogen compounds
1775	24	22	0	2	0	15	338.196	4.2e-05	Neutral nitrogen compounds
1776	24	21	0	1	0	15	323.178	0.000543	Neutral nitrogen compounds
1777	24	21	1	1	0	15	339.178	0.000101	Neutral nitrogen compounds
1778	24	21	0	1	1	15	355.238	0.000307	Neutral nitrogen compounds
1779	24	21	2	1	0	15	355.178	2.4e-05	Neutral nitrogen compounds
1780	23	20	0	2	0	15	324.18	3.4e-05	Neutral nitrogen compounds
1781	23	19	0	1	0	15	309.162	0.000416	Neutral nitrogen compounds
1782	23	19	1	1	0	15	325.162	6.4e-05	Neutral nitrogen compounds
1783	23	19	0	1	1	15	341.222	0.000283	Neutral nitrogen compounds
1784	23	19	2	1	0	15	341.162	1.7e-05	Neutral nitrogen compounds
1785	22	18	0	2	0	15	310.164	2.4e-05	Neutral nitrogen compounds
1786	22	17	0	1	0	15	295.146	0.000253	Neutral nitrogen compounds
1787	22	17	1	1	0	15	311.146	2.6e-05	Neutral nitrogen compounds
1788	22	17	0	1	1	15	327.206	0.000184	Neutral nitrogen compounds
1789	21	15	0	1	0	15	281.13	9.7e-05	Neutral nitrogen compounds
1790	21	15	1	1	0	15	297.13	1.6e-05	Neutral nitrogen compounds
1791	21	15	0	1	1	15	313.19	9.1e-05	Neutral nitrogen compounds
1792	20	13	0	1	0	15	267.114	2.7e-05	Neutral nitrogen compounds
1793	20	13	0	1	1	15	299.174	1.8e-05	Neutral nitrogen compounds
1794	48	67	0	1	0	16	657.546	3.2e-05	Neutral nitrogen compounds
1795	47	65	0	1	0	16	643.53	3.6e-05	Neutral nitrogen compounds
1796	46	63	0	1	0	16	629.514	5.7e-05	Neutral nitrogen compounds
1797	45	61	0	1	0	16	615.498	7.8e-05	Neutral nitrogen compounds
1798	44	59	0	1	0	16	601.482	0.000143	Neutral nitrogen compounds
1799	44	59	1	1	0	16	617.482	2.7e-05	Neutral nitrogen compounds
1800	44	59	0	1	1	16	633.542	2.7e-05	Neutral nitrogen compounds
1801	43	57	0	1	0	16	587.466	0.000244	Neutral nitrogen compounds
1802	43	57	1	1	0	16	603.466	2.3e-05	Neutral nitrogen compounds
1803	43	57	0	1	1	16	619.526	2.6e-05	Neutral nitrogen compounds
1804	42	55	0	1	0	16	573.45	0.000392	Neutral nitrogen compounds
1805	42	55	1	1	0	16	589.45	4.8e-05	Neutral nitrogen compounds
1806	42	55	0	1	1	16	605.51	6.9e-05	Neutral nitrogen compounds
1807	41	53	0	1	0	16	559.434	0.000386	Neutral nitrogen compounds
1808	41	53	1	1	0	16	575.434	4.8e-05	Neutral nitrogen compounds
1809	41	53	0	1	1	16	591.494	6.8e-05	Neutral nitrogen compounds
1810	40	51	0	1	0	16	545.418	0.000451	Neutral nitrogen compounds
1811	40	51	1	1	0	16	561.418	9.1e-05	Neutral nitrogen compounds
1812	40	51	0	1	1	16	577.478	0.000124	Neutral nitrogen compounds
1813	39	49	0	1	0	16	531.402	0.000744	Neutral nitrogen compounds
1814	39	49	1	1	0	16	547.402	0.000119	Neutral nitrogen compounds
1815	39	49	0	1	1	16	563.462	0.000129	Neutral nitrogen compounds
1816	38	47	0	1	0	16	517.386	0.00055	Neutral nitrogen compounds
1817	38	47	1	1	0	16	533.386	0.000135	Neutral nitrogen compounds
1818	38	47	0	1	1	16	549.446	0.000187	Neutral nitrogen compounds
1819	38	47	2	1	0	16	549.386	3.7e-05	Neutral nitrogen compounds
1820	37	46	0	2	0	16	518.388	6.1e-05	Neutral nitrogen compounds
1821	37	45	0	1	0	16	503.37	0.00063	Neutral nitrogen compounds
1822	37	45	1	1	0	16	519.37	0.000162	Neutral nitrogen compounds
1823	37	45	0	1	1	16	535.43	0.00022	Neutral nitrogen compounds
1824	37	45	2	1	0	16	535.37	2.9e-05	Neutral nitrogen compounds
1825	36	44	0	2	0	16	504.372	9.1e-05	Neutral nitrogen compounds
1826	36	43	0	1	0	16	489.354	0.000715	Neutral nitrogen compounds
1827	36	43	1	1	0	16	505.354	0.000185	Neutral nitrogen compounds
1828	36	43	0	1	1	16	521.414	0.000252	Neutral nitrogen compounds
1829	36	43	2	1	0	16	521.354	3.3e-05	Neutral nitrogen compounds
1830	35	42	0	2	0	16	490.356	0.000121	Neutral nitrogen compounds
1831	35	41	0	1	0	16	475.338	0.000825	Neutral nitrogen compounds
1832	35	41	1	1	0	16	491.338	0.000213	Neutral nitrogen compounds
1833	35	41	0	1	1	16	507.398	0.000354	Neutral nitrogen compounds
1834	35	41	2	1	0	16	507.338	4.8e-05	Neutral nitrogen compounds
1835	34	40	0	2	0	16	476.34	7.8e-05	Neutral nitrogen compounds
1836	34	39	0	1	0	16	461.322	0.000829	Neutral nitrogen compounds
1837	34	39	1	1	0	16	477.322	0.00019	Neutral nitrogen compounds
1838	34	39	0	1	1	16	493.382	0.000393	Neutral nitrogen compounds
1839	34	39	2	1	0	16	493.322	5.9e-05	Neutral nitrogen compounds
1840	33	38	0	2	0	16	462.324	8.2e-05	Neutral nitrogen compounds
1841	33	37	0	1	0	16	447.306	0.000845	Neutral nitrogen compounds
1842	33	37	1	1	0	16	463.306	0.000214	Neutral nitrogen compounds
1843	33	37	0	1	1	16	479.366	0.000488	Neutral nitrogen compounds
1844	33	37	2	1	0	16	479.306	7.7e-05	Neutral nitrogen compounds
1845	32	36	0	2	0	16	448.308	8.3e-05	Neutral nitrogen compounds
1846	32	35	0	1	0	16	433.29	0.001021	Neutral nitrogen compounds
1847	32	35	1	1	0	16	449.29	0.000218	Neutral nitrogen compounds
1848	32	35	0	1	1	16	465.35	0.000363	Neutral nitrogen compounds
1849	32	35	2	1	0	16	465.29	6.1e-05	Neutral nitrogen compounds
1850	31	34	0	2	0	16	434.292	8e-05	Neutral nitrogen compounds
1851	31	33	0	1	0	16	419.274	0.000863	Neutral nitrogen compounds
1852	31	33	1	1	0	16	435.274	0.00024	Neutral nitrogen compounds
1853	31	33	0	1	1	16	451.334	0.000422	Neutral nitrogen compounds
1854	31	33	2	1	0	16	451.274	5.6e-05	Neutral nitrogen compounds
1855	30	32	0	2	0	16	420.276	0.0001	Neutral nitrogen compounds
1856	30	31	0	1	0	16	405.258	0.000837	Neutral nitrogen compounds
1857	30	31	1	1	0	16	421.258	0.000187	Neutral nitrogen compounds
1858	30	31	0	1	1	16	437.318	0.000301	Neutral nitrogen compounds
1859	30	31	2	1	0	16	437.258	4.4e-05	Neutral nitrogen compounds
1860	29	30	0	2	0	16	406.26	8.6e-05	Neutral nitrogen compounds
1861	29	29	0	1	0	16	391.242	0.000795	Neutral nitrogen compounds
1862	29	29	1	1	0	16	407.242	0.000216	Neutral nitrogen compounds
1863	29	29	0	1	1	16	423.302	0.000343	Neutral nitrogen compounds
1864	29	29	2	1	0	16	423.242	5.3e-05	Neutral nitrogen compounds
1865	28	28	0	2	0	16	392.244	8.3e-05	Neutral nitrogen compounds
1866	28	27	0	1	0	16	377.226	0.000624	Neutral nitrogen compounds
1867	28	27	1	1	0	16	393.226	0.000156	Neutral nitrogen compounds
1868	28	27	0	1	1	16	409.286	0.000215	Neutral nitrogen compounds
1869	28	27	2	1	0	16	409.226	3.5e-05	Neutral nitrogen compounds
1870	27	26	0	2	0	16	378.228	5.1e-05	Neutral nitrogen compounds
1871	27	25	0	1	0	16	363.21	0.00049	Neutral nitrogen compounds
1872	27	25	1	1	0	16	379.21	0.000168	Neutral nitrogen compounds
1873	27	25	0	1	1	16	395.27	0.000268	Neutral nitrogen compounds
1874	27	25	2	1	0	16	395.21	3.1e-05	Neutral nitrogen compounds
1875	26	24	0	2	0	16	364.212	4e-05	Neutral nitrogen compounds
1876	26	23	0	1	0	16	349.194	0.000441	Neutral nitrogen compounds
1877	26	23	1	1	0	16	365.194	0.000101	Neutral nitrogen compounds
1878	26	23	0	1	1	16	381.254	0.000243	Neutral nitrogen compounds
1879	26	23	2	1	0	16	381.194	2.4e-05	Neutral nitrogen compounds
1880	25	22	0	2	0	16	350.196	3.6e-05	Neutral nitrogen compounds
1881	25	21	0	1	0	16	335.178	0.000235	Neutral nitrogen compounds
1882	25	21	1	1	0	16	351.178	6.6e-05	Neutral nitrogen compounds
1883	25	21	0	1	1	16	367.238	0.000136	Neutral nitrogen compounds
1884	25	21	2	1	0	16	367.178	1.9e-05	Neutral nitrogen compounds
1885	24	20	0	2	0	16	336.18	1.9e-05	Neutral nitrogen compounds
1886	24	19	0	1	0	16	321.162	0.000164	Neutral nitrogen compounds
1887	24	19	1	1	0	16	337.162	4.6e-05	Neutral nitrogen compounds
1888	24	19	0	1	1	16	353.222	0.0001	Neutral nitrogen compounds
1889	23	17	0	1	0	16	307.146	7e-05	Neutral nitrogen compounds
1890	23	17	1	1	0	16	323.146	2e-05	Neutral nitrogen compounds
1891	23	17	0	1	1	16	339.206	3.4e-05	Neutral nitrogen compounds
1892	22	15	0	1	0	16	293.13	2.1e-05	Neutral nitrogen compounds
1893	22	15	0	1	1	16	325.19	1.8e-05	Neutral nitrogen compounds
1894	21	13	0	1	0	16	279.114	1.1e-05	Neutral nitrogen compounds
1895	20	11	0	1	0	16	265.098	8e-06	Neutral nitrogen compounds
1896	48	65	0	1	0	17	655.53	2.6e-05	Neutral nitrogen compounds
1897	46	61	0	1	0	17	627.498	5.6e-05	Neutral nitrogen compounds
1898	45	59	0	1	0	17	613.482	8.3e-05	Neutral nitrogen compounds
1899	44	57	0	1	0	17	599.466	0.0001	Neutral nitrogen compounds
1900	44	57	1	1	0	17	615.466	2.4e-05	Neutral nitrogen compounds
1901	44	57	0	1	1	17	631.526	2.7e-05	Neutral nitrogen compounds
1902	43	55	0	1	0	17	585.45	0.00013	Neutral nitrogen compounds
1903	43	55	1	1	0	17	601.45	2.9e-05	Neutral nitrogen compounds
1904	42	53	0	1	0	17	571.434	0.000175	Neutral nitrogen compounds
1905	42	53	1	1	0	17	587.434	4e-05	Neutral nitrogen compounds
1906	41	51	0	1	0	17	557.418	0.000286	Neutral nitrogen compounds
1907	41	51	1	1	0	17	573.418	5.7e-05	Neutral nitrogen compounds
1908	41	51	0	1	1	17	589.478	6.1e-05	Neutral nitrogen compounds
1909	40	49	0	1	0	17	543.402	0.000305	Neutral nitrogen compounds
1910	40	49	1	1	0	17	559.402	6.2e-05	Neutral nitrogen compounds
1911	40	49	0	1	1	17	575.462	7e-05	Neutral nitrogen compounds
1912	39	47	0	1	0	17	529.386	0.000335	Neutral nitrogen compounds
1913	39	47	1	1	0	17	545.386	7.4e-05	Neutral nitrogen compounds
1914	39	47	0	1	1	17	561.446	0.000107	Neutral nitrogen compounds
1915	38	45	0	1	0	17	515.37	0.000414	Neutral nitrogen compounds
1916	38	45	1	1	0	17	531.37	0.000132	Neutral nitrogen compounds
1917	38	45	0	1	1	17	547.43	0.000164	Neutral nitrogen compounds
1918	37	43	0	1	0	17	501.354	0.000565	Neutral nitrogen compounds
1919	37	43	1	1	0	17	517.354	0.000118	Neutral nitrogen compounds
1920	37	43	0	1	1	17	533.414	0.000163	Neutral nitrogen compounds
1921	37	43	2	1	0	17	533.354	3.1e-05	Neutral nitrogen compounds
1922	36	42	0	2	0	17	502.356	7.3e-05	Neutral nitrogen compounds
1923	36	41	0	1	0	17	487.338	0.000815	Neutral nitrogen compounds
1924	36	41	1	1	0	17	503.338	0.000133	Neutral nitrogen compounds
1925	36	41	0	1	1	17	519.398	0.000207	Neutral nitrogen compounds
1926	36	41	2	1	0	17	519.338	2.8e-05	Neutral nitrogen compounds
1927	35	40	0	2	0	17	488.34	6.6e-05	Neutral nitrogen compounds
1928	35	39	0	1	0	17	473.322	0.000469	Neutral nitrogen compounds
1929	35	39	1	1	0	17	489.322	0.000119	Neutral nitrogen compounds
1930	35	39	0	1	1	17	505.382	0.000204	Neutral nitrogen compounds
1931	35	39	2	1	0	17	505.322	2.8e-05	Neutral nitrogen compounds
1932	34	38	0	2	0	17	474.324	9.3e-05	Neutral nitrogen compounds
1933	34	37	0	1	0	17	459.306	0.000788	Neutral nitrogen compounds
1934	34	37	1	1	0	17	475.306	0.000145	Neutral nitrogen compounds
1935	34	37	0	1	1	17	491.366	0.000225	Neutral nitrogen compounds
1936	34	37	2	1	0	17	491.306	3.3e-05	Neutral nitrogen compounds
1937	33	36	0	2	0	17	460.308	6.6e-05	Neutral nitrogen compounds
1938	33	35	0	1	0	17	445.29	0.000636	Neutral nitrogen compounds
1939	33	35	1	1	0	17	461.29	0.000153	Neutral nitrogen compounds
1940	33	35	0	1	1	17	477.35	0.000229	Neutral nitrogen compounds
1941	33	35	2	1	0	17	477.29	3.2e-05	Neutral nitrogen compounds
1942	32	34	0	2	0	17	446.292	7.5e-05	Neutral nitrogen compounds
1943	32	33	0	1	0	17	431.274	0.000519	Neutral nitrogen compounds
1944	32	33	1	1	0	17	447.274	0.000157	Neutral nitrogen compounds
1945	32	33	0	1	1	17	463.334	0.000255	Neutral nitrogen compounds
1946	32	33	2	1	0	17	463.274	4.8e-05	Neutral nitrogen compounds
1947	31	32	0	2	0	17	432.276	7.2e-05	Neutral nitrogen compounds
1948	31	31	0	1	0	17	417.258	0.000513	Neutral nitrogen compounds
1949	31	31	1	1	0	17	433.258	0.000183	Neutral nitrogen compounds
1950	31	31	0	1	1	17	449.318	0.000237	Neutral nitrogen compounds
1951	31	31	2	1	0	17	449.258	3.8e-05	Neutral nitrogen compounds
1952	30	29	0	1	0	17	403.242	0.000423	Neutral nitrogen compounds
1953	30	29	1	1	0	17	419.242	0.000158	Neutral nitrogen compounds
1954	30	29	0	1	1	17	435.302	0.000209	Neutral nitrogen compounds
1955	30	29	2	1	0	17	435.242	4e-05	Neutral nitrogen compounds
1956	29	28	0	2	0	17	404.244	4.6e-05	Neutral nitrogen compounds
1957	29	27	0	1	0	17	389.226	0.000459	Neutral nitrogen compounds
1958	29	27	1	1	0	17	405.226	0.000169	Neutral nitrogen compounds
1959	29	27	0	1	1	17	421.286	0.00021	Neutral nitrogen compounds
1960	29	27	2	1	0	17	421.226	2.5e-05	Neutral nitrogen compounds
1961	28	26	0	2	0	17	390.228	3.9e-05	Neutral nitrogen compounds
1962	28	25	0	1	0	17	375.21	0.000294	Neutral nitrogen compounds
1963	28	25	1	1	0	17	391.21	0.000152	Neutral nitrogen compounds
1964	28	25	0	1	1	17	407.27	0.000194	Neutral nitrogen compounds
1965	28	25	2	1	0	17	407.21	2.9e-05	Neutral nitrogen compounds
1966	27	24	0	2	0	17	376.212	3.2e-05	Neutral nitrogen compounds
1967	27	23	0	1	0	17	361.194	0.000196	Neutral nitrogen compounds
1968	27	23	1	1	0	17	377.194	0.000145	Neutral nitrogen compounds
1969	27	23	0	1	1	17	393.254	0.000147	Neutral nitrogen compounds
1970	27	23	2	1	0	17	393.194	2.4e-05	Neutral nitrogen compounds
1971	26	22	0	2	0	17	362.196	2.4e-05	Neutral nitrogen compounds
1972	26	21	0	1	0	17	347.178	0.000136	Neutral nitrogen compounds
1973	26	21	1	1	0	17	363.178	0.00012	Neutral nitrogen compounds
1974	26	21	0	1	1	17	379.238	0.000128	Neutral nitrogen compounds
1975	25	20	0	2	0	17	348.18	1.5e-05	Neutral nitrogen compounds
1976	25	19	0	1	0	17	333.162	9e-05	Neutral nitrogen compounds
1977	25	19	1	1	0	17	349.162	0.000103	Neutral nitrogen compounds
1978	25	19	0	1	1	17	365.222	8.5e-05	Neutral nitrogen compounds
1979	24	17	0	1	0	17	319.146	4.5e-05	Neutral nitrogen compounds
1980	24	17	1	1	0	17	335.146	3.7e-05	Neutral nitrogen compounds
1981	24	17	0	1	1	17	351.206	4.4e-05	Neutral nitrogen compounds
1982	23	15	0	1	0	17	305.13	1.3e-05	Neutral nitrogen compounds
1983	23	15	1	1	0	17	321.13	1.6e-05	Neutral nitrogen compounds
1984	23	15	0	1	1	17	337.19	1.8e-05	Neutral nitrogen compounds
1985	22	13	0	1	0	17	291.114	1.5e-05	Neutral nitrogen compounds
1986	21	11	0	1	0	17	277.098	9e-06	Neutral nitrogen compounds
1987	48	63	0	1	0	18	653.514	3.1e-05	Neutral nitrogen compounds
1988	47	61	0	1	0	18	639.498	6.7e-05	Neutral nitrogen compounds
1989	46	59	0	1	0	18	625.482	5.3e-05	Neutral nitrogen compounds
1990	45	57	0	1	0	18	611.466	4.9e-05	Neutral nitrogen compounds
1991	44	55	0	1	0	18	597.45	7.5e-05	Neutral nitrogen compounds
1992	43	53	0	1	0	18	583.434	0.00015	Neutral nitrogen compounds
1993	42	51	0	1	0	18	569.418	0.000223	Neutral nitrogen compounds
1994	41	49	0	1	0	18	555.402	0.000247	Neutral nitrogen compounds
1995	41	49	1	1	0	18	571.402	4.2e-05	Neutral nitrogen compounds
1996	41	49	0	1	1	18	587.462	6.3e-05	Neutral nitrogen compounds
1997	40	47	0	1	0	18	541.386	0.000306	Neutral nitrogen compounds
1998	40	47	1	1	0	18	557.386	5.4e-05	Neutral nitrogen compounds
1999	39	45	0	1	0	18	527.37	0.000236	Neutral nitrogen compounds
2000	39	45	1	1	0	18	543.37	6.3e-05	Neutral nitrogen compounds
2001	39	45	0	1	1	18	559.43	8.7e-05	Neutral nitrogen compounds
2002	38	43	0	1	0	18	513.354	0.000281	Neutral nitrogen compounds
2003	38	43	1	1	0	18	529.354	6.6e-05	Neutral nitrogen compounds
2004	38	43	0	1	1	18	545.414	9.7e-05	Neutral nitrogen compounds
2005	37	41	0	1	0	18	499.338	0.000236	Neutral nitrogen compounds
2006	37	41	1	1	0	18	515.338	8.1e-05	Neutral nitrogen compounds
2007	37	41	0	1	1	18	531.398	0.000129	Neutral nitrogen compounds
2008	36	39	0	1	0	18	485.322	0.00026	Neutral nitrogen compounds
2009	36	39	1	1	0	18	501.322	0.000134	Neutral nitrogen compounds
2010	36	39	0	1	1	18	517.382	0.000126	Neutral nitrogen compounds
2011	35	37	1	1	0	18	487.306	0.000151	Neutral nitrogen compounds
2012	35	37	0	1	1	18	503.366	0.000124	Neutral nitrogen compounds
2013	34	35	1	1	0	18	473.29	0.000104	Neutral nitrogen compounds
2014	34	35	0	1	1	18	489.35	0.000122	Neutral nitrogen compounds
2015	33	33	1	1	0	18	459.274	0.000143	Neutral nitrogen compounds
2016	33	33	0	1	1	18	475.334	0.000151	Neutral nitrogen compounds
2017	32	31	0	1	0	18	429.258	0.00032	Neutral nitrogen compounds
2018	32	31	1	1	0	18	445.258	0.0001	Neutral nitrogen compounds
2019	32	31	0	1	1	18	461.318	0.000127	Neutral nitrogen compounds
2020	31	29	0	1	0	18	415.242	0.000343	Neutral nitrogen compounds
2021	31	29	1	1	0	18	431.242	0.000106	Neutral nitrogen compounds
2022	31	29	0	1	1	18	447.302	0.000115	Neutral nitrogen compounds
2023	30	27	1	1	0	18	417.226	9e-05	Neutral nitrogen compounds
2024	30	27	0	1	1	18	433.286	0.000126	Neutral nitrogen compounds
2025	29	25	0	1	0	18	387.21	6e-05	Neutral nitrogen compounds
2026	29	25	1	1	0	18	403.21	7.8e-05	Neutral nitrogen compounds
2027	29	25	0	1	1	18	419.27	0.000107	Neutral nitrogen compounds
2028	28	23	0	1	0	18	373.194	4.3e-05	Neutral nitrogen compounds
2029	28	23	1	1	0	18	389.194	7.5e-05	Neutral nitrogen compounds
2030	28	23	0	1	1	18	405.254	7.7e-05	Neutral nitrogen compounds
2031	27	21	0	1	0	18	359.178	3e-05	Neutral nitrogen compounds
2032	27	21	1	1	0	18	375.178	4e-05	Neutral nitrogen compounds
2033	27	21	0	1	1	18	391.238	5.4e-05	Neutral nitrogen compounds
2034	26	19	0	1	0	18	345.162	2.5e-05	Neutral nitrogen compounds
2035	26	19	1	1	0	18	361.162	1.6e-05	Neutral nitrogen compounds
2036	26	19	0	1	1	18	377.222	2.7e-05	Neutral nitrogen compounds
2037	25	17	0	1	1	18	363.206	1.7e-05	Neutral nitrogen compounds
2038	46	57	0	1	0	19	623.466	2.8e-05	Neutral nitrogen compounds
2039	45	55	0	1	0	19	609.45	5.3e-05	Neutral nitrogen compounds
2040	44	53	0	1	0	19	595.434	5.9e-05	Neutral nitrogen compounds
2041	43	51	0	1	0	19	581.418	8.7e-05	Neutral nitrogen compounds
2042	42	49	0	1	0	19	567.402	8.8e-05	Neutral nitrogen compounds
2043	42	49	1	1	0	19	583.402	2.6e-05	Neutral nitrogen compounds
2044	41	47	0	1	0	19	553.386	0.000118	Neutral nitrogen compounds
2045	40	45	0	1	0	19	539.37	0.000133	Neutral nitrogen compounds
2046	40	45	1	1	0	19	555.37	4.9e-05	Neutral nitrogen compounds
2047	40	45	0	1	1	19	571.43	3.2e-05	Neutral nitrogen compounds
2048	39	43	0	1	0	19	525.354	0.00019	Neutral nitrogen compounds
2049	39	43	0	1	1	19	557.414	6.9e-05	Neutral nitrogen compounds
2050	38	41	0	1	0	19	511.338	0.000179	Neutral nitrogen compounds
2051	38	41	1	1	0	19	527.338	4.3e-05	Neutral nitrogen compounds
2052	38	41	0	1	1	19	543.398	6.7e-05	Neutral nitrogen compounds
2053	37	39	0	1	0	19	497.322	0.000162	Neutral nitrogen compounds
2054	37	39	1	1	0	19	513.322	6.9e-05	Neutral nitrogen compounds
2055	37	39	0	1	1	19	529.382	6.9e-05	Neutral nitrogen compounds
2056	36	37	0	1	0	19	483.306	0.000153	Neutral nitrogen compounds
2057	36	37	1	1	0	19	499.306	5.7e-05	Neutral nitrogen compounds
2058	36	37	0	1	1	19	515.366	7.7e-05	Neutral nitrogen compounds
2059	35	35	0	1	1	19	501.35	0.00011	Neutral nitrogen compounds
2060	34	33	0	1	0	19	455.274	9e-05	Neutral nitrogen compounds
2061	34	33	0	1	1	19	487.334	0.000113	Neutral nitrogen compounds
2062	33	31	0	1	1	19	473.318	7.5e-05	Neutral nitrogen compounds
2063	32	29	0	1	0	19	427.242	0.000266	Neutral nitrogen compounds
2064	32	29	1	1	0	19	443.242	7e-05	Neutral nitrogen compounds
2065	31	27	0	1	0	19	413.226	0.000227	Neutral nitrogen compounds
2066	31	27	1	1	0	19	429.226	3.6e-05	Neutral nitrogen compounds
2067	30	25	1	1	0	19	415.21	3.2e-05	Neutral nitrogen compounds
2068	30	25	0	1	1	19	431.27	5.7e-05	Neutral nitrogen compounds
2069	29	23	0	1	1	19	417.254	5.4e-05	Neutral nitrogen compounds
2070	25	15	1	1	0	19	345.13	1.5e-05	Neutral nitrogen compounds
2071	48	59	0	1	0	20	649.482	3.3e-05	Neutral nitrogen compounds
2072	47	57	0	1	0	20	635.466	4.8e-05	Neutral nitrogen compounds
2073	46	55	0	1	0	20	621.45	6.8e-05	Neutral nitrogen compounds
2074	44	51	0	1	0	20	593.418	7.5e-05	Neutral nitrogen compounds
2075	43	49	0	1	0	20	579.402	5.8e-05	Neutral nitrogen compounds
2076	42	47	0	1	0	20	565.386	9.8e-05	Neutral nitrogen compounds
2077	41	45	0	1	0	20	551.37	0.00011	Neutral nitrogen compounds
2078	40	43	0	1	0	20	537.354	0.000118	Neutral nitrogen compounds
2079	39	41	0	1	0	20	523.338	0.000118	Neutral nitrogen compounds
2080	39	41	0	1	1	20	555.398	4.8e-05	Neutral nitrogen compounds
2081	38	39	0	1	0	20	509.322	9.7e-05	Neutral nitrogen compounds
2082	37	37	0	1	0	20	495.306	9.3e-05	Neutral nitrogen compounds
2083	37	37	0	1	1	20	527.366	4.1e-05	Neutral nitrogen compounds
2084	36	35	0	1	0	20	481.29	5.3e-05	Neutral nitrogen compounds
2085	34	31	0	1	0	20	453.258	0.000171	Neutral nitrogen compounds
2086	28	51	1	1	0	4	417.418	2e-05	Basic nitrogen compounds
2087	27	49	1	1	0	4	403.402	1.9e-05	Basic nitrogen compounds
2088	26	47	1	1	0	4	389.386	2.2e-05	Basic nitrogen compounds
2089	25	45	1	1	0	4	375.37	1.4e-05	Basic nitrogen compounds
2090	24	43	1	1	0	4	361.354	1.8e-05	Basic nitrogen compounds
2091	23	41	1	1	0	4	347.338	1.9e-05	Basic nitrogen compounds
2092	22	39	1	1	0	4	333.322	1.1e-05	Basic nitrogen compounds
2093	21	37	1	1	0	4	319.306	2.2e-05	Basic nitrogen compounds
2094	20	35	1	1	0	4	305.29	1.5e-05	Basic nitrogen compounds
2095	29	51	1	1	0	5	429.418	1.6e-05	Basic nitrogen compounds
2096	27	47	1	1	0	5	401.386	2.5e-05	Basic nitrogen compounds
2097	26	45	1	1	0	5	387.37	2.7e-05	Basic nitrogen compounds
2098	25	43	1	1	0	5	373.354	1.6e-05	Basic nitrogen compounds
2099	24	41	1	1	0	5	359.338	2.7e-05	Basic nitrogen compounds
2100	23	39	1	1	0	5	345.322	1.5e-05	Basic nitrogen compounds
2101	22	37	1	1	0	5	331.306	2.2e-05	Basic nitrogen compounds
2102	21	35	1	1	0	5	317.29	1.2e-05	Basic nitrogen compounds
2103	20	33	1	1	0	5	303.274	1.3e-05	Basic nitrogen compounds
2104	19	31	1	1	0	5	289.258	1.6e-05	Basic nitrogen compounds
2105	19	31	2	1	0	5	305.258	1e-05	Basic nitrogen compounds
2106	18	29	1	1	0	5	275.242	9e-06	Basic nitrogen compounds
2107	18	29	2	1	0	5	291.242	1e-05	Basic nitrogen compounds
2108	17	27	2	1	0	5	277.226	1e-05	Basic nitrogen compounds
2109	16	25	2	1	0	5	263.21	8e-06	Basic nitrogen compounds
2110	13	19	0	1	0	5	189.162	4e-06	Basic nitrogen compounds
2111	33	57	0	1	0	6	467.466	2e-05	Basic nitrogen compounds
2112	32	55	0	1	0	6	453.45	2.5e-05	Basic nitrogen compounds
2113	31	53	0	1	0	6	439.434	3.4e-05	Basic nitrogen compounds
2114	30	51	0	1	0	6	425.418	4.7e-05	Basic nitrogen compounds
2115	30	51	1	1	0	6	441.418	1.3e-05	Basic nitrogen compounds
2116	29	49	0	1	0	6	411.402	2.8e-05	Basic nitrogen compounds
2117	28	47	0	1	0	6	397.386	6.4e-05	Basic nitrogen compounds
2118	28	47	1	1	0	6	413.386	1.9e-05	Basic nitrogen compounds
2119	27	45	0	1	0	6	383.37	7.2e-05	Basic nitrogen compounds
2120	27	45	1	1	0	6	399.37	1.5e-05	Basic nitrogen compounds
2121	26	43	0	1	0	6	369.354	8.8e-05	Basic nitrogen compounds
2122	26	43	1	1	0	6	385.354	2.5e-05	Basic nitrogen compounds
2123	25	41	0	1	0	6	355.338	9.2e-05	Basic nitrogen compounds
2124	25	41	1	1	0	6	371.338	2.7e-05	Basic nitrogen compounds
2125	25	41	2	1	0	6	387.338	1.5e-05	Basic nitrogen compounds
2126	24	39	0	1	0	6	341.322	8.4e-05	Basic nitrogen compounds
2127	24	39	1	1	0	6	357.322	2.2e-05	Basic nitrogen compounds
2128	23	37	0	1	0	6	327.306	9.4e-05	Basic nitrogen compounds
2129	23	37	1	1	0	6	343.306	1.9e-05	Basic nitrogen compounds
2130	23	37	2	1	0	6	359.306	1.7e-05	Basic nitrogen compounds
2131	22	35	0	1	0	6	313.29	9e-05	Basic nitrogen compounds
2132	22	35	1	1	0	6	329.29	2.9e-05	Basic nitrogen compounds
2133	21	33	0	1	0	6	299.274	8.5e-05	Basic nitrogen compounds
2134	21	33	1	1	0	6	315.274	2e-05	Basic nitrogen compounds
2135	21	33	2	1	0	6	331.274	1.3e-05	Basic nitrogen compounds
2136	20	31	0	1	0	6	285.258	9e-05	Basic nitrogen compounds
2137	20	31	1	1	0	6	301.258	1.4e-05	Basic nitrogen compounds
2138	20	31	2	1	0	6	317.258	1.2e-05	Basic nitrogen compounds
2139	19	29	0	1	0	6	271.242	7.6e-05	Basic nitrogen compounds
2140	19	29	1	1	0	6	287.242	1.7e-05	Basic nitrogen compounds
2141	19	29	2	1	0	6	303.242	1.3e-05	Basic nitrogen compounds
2142	18	27	0	1	0	6	257.226	6e-05	Basic nitrogen compounds
2143	18	27	1	1	0	6	273.226	1.4e-05	Basic nitrogen compounds
2144	18	27	2	1	0	6	289.226	1.1e-05	Basic nitrogen compounds
2145	17	25	0	1	0	6	243.21	4.3e-05	Basic nitrogen compounds
2146	17	25	1	1	0	6	259.21	7e-06	Basic nitrogen compounds
2147	17	25	2	1	0	6	275.21	1.6e-05	Basic nitrogen compounds
2148	16	23	0	1	0	6	229.194	3e-05	Basic nitrogen compounds
2149	16	23	1	1	0	6	245.194	8e-06	Basic nitrogen compounds
2150	16	23	2	1	0	6	261.194	1.4e-05	Basic nitrogen compounds
2151	15	21	0	1	0	6	215.178	2e-05	Basic nitrogen compounds
2152	15	21	1	1	0	6	231.178	8e-06	Basic nitrogen compounds
2153	15	21	2	1	0	6	247.178	7e-06	Basic nitrogen compounds
2154	14	19	0	1	0	6	201.162	7e-06	Basic nitrogen compounds
2155	14	19	1	1	0	6	217.162	6e-06	Basic nitrogen compounds
2156	14	19	2	1	0	6	233.162	6e-06	Basic nitrogen compounds
2157	13	17	0	1	0	6	187.146	5e-06	Basic nitrogen compounds
2158	13	17	1	1	0	6	203.146	5e-06	Basic nitrogen compounds
2159	13	17	2	1	0	6	219.146	6e-06	Basic nitrogen compounds
2160	36	61	0	1	0	7	507.498	1.4e-05	Basic nitrogen compounds
2161	35	59	0	1	0	7	493.482	1.7e-05	Basic nitrogen compounds
2162	34	57	0	1	0	7	479.466	2.7e-05	Basic nitrogen compounds
2163	33	55	0	1	0	7	465.45	3.8e-05	Basic nitrogen compounds
2164	32	53	0	1	0	7	451.434	5.2e-05	Basic nitrogen compounds
2165	32	53	1	1	0	7	467.434	1.6e-05	Basic nitrogen compounds
2166	31	51	0	1	0	7	437.418	7.2e-05	Basic nitrogen compounds
2167	31	51	1	1	0	7	453.418	1.9e-05	Basic nitrogen compounds
2168	30	49	0	1	0	7	423.402	0.000101	Basic nitrogen compounds
2169	30	49	1	1	0	7	439.402	2.2e-05	Basic nitrogen compounds
2170	29	47	0	1	0	7	409.386	0.000111	Basic nitrogen compounds
2171	29	47	1	1	0	7	425.386	2.6e-05	Basic nitrogen compounds
2172	28	45	0	1	0	7	395.37	0.000127	Basic nitrogen compounds
2173	28	45	1	1	0	7	411.37	2.2e-05	Basic nitrogen compounds
2174	28	45	2	1	0	7	427.37	1.7e-05	Basic nitrogen compounds
2175	27	43	0	1	0	7	381.354	0.000155	Basic nitrogen compounds
2176	27	43	1	1	0	7	397.354	2.6e-05	Basic nitrogen compounds
2177	27	43	2	1	0	7	413.354	1.5e-05	Basic nitrogen compounds
2178	26	41	0	1	0	7	367.338	0.000171	Basic nitrogen compounds
2179	26	41	1	1	0	7	383.338	3.8e-05	Basic nitrogen compounds
2180	26	41	2	1	0	7	399.338	1.8e-05	Basic nitrogen compounds
2181	25	39	0	1	0	7	353.322	0.000165	Basic nitrogen compounds
2182	25	39	1	1	0	7	369.322	3.5e-05	Basic nitrogen compounds
2183	25	39	2	1	0	7	385.322	1.8e-05	Basic nitrogen compounds
2184	24	37	0	1	0	7	339.306	0.000187	Basic nitrogen compounds
2185	24	37	1	1	0	7	355.306	4.6e-05	Basic nitrogen compounds
2186	24	37	2	1	0	7	371.306	2.4e-05	Basic nitrogen compounds
2187	23	35	0	1	0	7	325.29	0.000198	Basic nitrogen compounds
2188	23	35	1	1	0	7	341.29	3.6e-05	Basic nitrogen compounds
2189	23	35	2	1	0	7	357.29	2e-05	Basic nitrogen compounds
2190	22	33	0	1	0	7	311.274	0.000204	Basic nitrogen compounds
2191	22	33	1	1	0	7	327.274	4.8e-05	Basic nitrogen compounds
2192	22	33	2	1	0	7	343.274	2.4e-05	Basic nitrogen compounds
2193	21	31	0	1	0	7	297.258	0.00021	Basic nitrogen compounds
2194	21	31	1	1	0	7	313.258	4.2e-05	Basic nitrogen compounds
2195	21	31	2	1	0	7	329.258	2.4e-05	Basic nitrogen compounds
2196	20	29	0	1	0	7	283.242	0.00025	Basic nitrogen compounds
2197	20	29	1	1	0	7	299.242	3.9e-05	Basic nitrogen compounds
2198	20	29	2	1	0	7	315.242	1.9e-05	Basic nitrogen compounds
2199	19	27	0	1	0	7	269.226	0.000252	Basic nitrogen compounds
2200	19	27	1	1	0	7	285.226	4.5e-05	Basic nitrogen compounds
2201	19	27	2	1	0	7	301.226	2.4e-05	Basic nitrogen compounds
2202	18	25	0	1	0	7	255.21	0.000139	Basic nitrogen compounds
2203	18	25	1	1	0	7	271.21	3.5e-05	Basic nitrogen compounds
2204	18	25	2	1	0	7	287.21	2.8e-05	Basic nitrogen compounds
2205	17	23	0	1	0	7	241.194	5.4e-05	Basic nitrogen compounds
2206	17	23	1	1	0	7	257.194	3.2e-05	Basic nitrogen compounds
2207	17	23	2	1	0	7	273.194	1.7e-05	Basic nitrogen compounds
2208	16	21	0	1	0	7	227.178	3.7e-05	Basic nitrogen compounds
2209	16	21	1	1	0	7	243.178	2.2e-05	Basic nitrogen compounds
2210	16	21	2	1	0	7	259.178	1.6e-05	Basic nitrogen compounds
2211	15	19	0	1	0	7	213.162	1.5e-05	Basic nitrogen compounds
2212	15	19	1	1	0	7	229.162	1.7e-05	Basic nitrogen compounds
2213	15	19	2	1	0	7	245.162	8e-06	Basic nitrogen compounds
2214	14	17	0	1	0	7	199.146	4e-06	Basic nitrogen compounds
2215	14	17	1	1	0	7	215.146	9e-06	Basic nitrogen compounds
2216	14	17	2	1	0	7	231.146	1.3e-05	Basic nitrogen compounds
2217	13	15	1	1	0	7	201.13	7e-06	Basic nitrogen compounds
2218	13	15	2	1	0	7	217.13	5e-06	Basic nitrogen compounds
2219	12	13	1	1	0	7	187.114	4e-06	Basic nitrogen compounds
2220	35	57	0	1	0	8	491.466	2.9e-05	Basic nitrogen compounds
2221	34	55	0	1	0	8	477.45	3.6e-05	Basic nitrogen compounds
2222	33	53	0	1	0	8	463.434	6e-05	Basic nitrogen compounds
2223	32	51	0	1	0	8	449.418	6.9e-05	Basic nitrogen compounds
2224	31	49	0	1	0	8	435.402	8.9e-05	Basic nitrogen compounds
2225	31	49	1	1	0	8	451.402	2.1e-05	Basic nitrogen compounds
2226	30	47	0	1	0	8	421.386	0.000124	Basic nitrogen compounds
2227	30	47	1	1	0	8	437.386	1.8e-05	Basic nitrogen compounds
2228	30	47	2	1	0	8	453.386	1.5e-05	Basic nitrogen compounds
2229	29	45	0	1	0	8	407.37	0.000154	Basic nitrogen compounds
2230	29	45	1	1	0	8	423.37	2.4e-05	Basic nitrogen compounds
2231	29	45	2	1	0	8	439.37	1.5e-05	Basic nitrogen compounds
2232	28	43	0	1	0	8	393.354	0.000199	Basic nitrogen compounds
2233	28	43	1	1	0	8	409.354	2.3e-05	Basic nitrogen compounds
2234	27	41	0	1	0	8	379.338	0.000208	Basic nitrogen compounds
2235	27	41	1	1	0	8	395.338	2.9e-05	Basic nitrogen compounds
2236	26	39	0	1	0	8	365.322	0.000239	Basic nitrogen compounds
2237	26	39	1	1	0	8	381.322	4e-05	Basic nitrogen compounds
2238	26	39	2	1	0	8	397.322	1.9e-05	Basic nitrogen compounds
2239	25	37	0	1	0	8	351.306	0.00026	Basic nitrogen compounds
2240	25	37	1	1	0	8	367.306	4.2e-05	Basic nitrogen compounds
2241	25	37	2	1	0	8	383.306	2.5e-05	Basic nitrogen compounds
2242	24	35	0	1	0	8	337.29	0.000259	Basic nitrogen compounds
2243	24	35	1	1	0	8	353.29	3.8e-05	Basic nitrogen compounds
2244	24	35	2	1	0	8	369.29	2.8e-05	Basic nitrogen compounds
2245	23	33	0	1	0	8	323.274	0.000271	Basic nitrogen compounds
2246	23	33	1	1	0	8	339.274	4.3e-05	Basic nitrogen compounds
2247	23	33	2	1	0	8	355.274	2.5e-05	Basic nitrogen compounds
2248	22	31	0	1	0	8	309.258	0.000292	Basic nitrogen compounds
2249	22	31	1	1	0	8	325.258	4.1e-05	Basic nitrogen compounds
2250	22	31	2	1	0	8	341.258	2.3e-05	Basic nitrogen compounds
2251	21	29	0	1	0	8	295.242	0.000259	Basic nitrogen compounds
2252	21	29	1	1	0	8	311.242	3.7e-05	Basic nitrogen compounds
2253	21	29	2	1	0	8	327.242	1.7e-05	Basic nitrogen compounds
2254	20	27	0	1	0	8	281.226	0.000236	Basic nitrogen compounds
2255	20	27	1	1	0	8	297.226	3.3e-05	Basic nitrogen compounds
2256	20	27	2	1	0	8	313.226	2.7e-05	Basic nitrogen compounds
2257	19	25	0	1	0	8	267.21	0.000185	Basic nitrogen compounds
2258	19	25	1	1	0	8	283.21	3e-05	Basic nitrogen compounds
2259	19	25	2	1	0	8	299.21	1.8e-05	Basic nitrogen compounds
2260	18	23	0	1	0	8	253.194	9.7e-05	Basic nitrogen compounds
2261	18	23	1	1	0	8	269.194	2.6e-05	Basic nitrogen compounds
2262	18	23	2	1	0	8	285.194	1.7e-05	Basic nitrogen compounds
2263	17	21	0	1	0	8	239.178	2.6e-05	Basic nitrogen compounds
2264	17	21	1	1	0	8	255.178	1.8e-05	Basic nitrogen compounds
2265	17	21	2	1	0	8	271.178	1.2e-05	Basic nitrogen compounds
2266	16	19	0	1	0	8	225.162	1.2e-05	Basic nitrogen compounds
2267	16	19	1	1	0	8	241.162	1.1e-05	Basic nitrogen compounds
2268	16	19	2	1	0	8	257.162	1e-05	Basic nitrogen compounds
2269	15	17	2	1	0	8	243.146	8e-06	Basic nitrogen compounds
2270	14	15	1	1	0	8	213.13	5e-06	Basic nitrogen compounds
2271	14	15	2	1	0	8	229.13	8e-06	Basic nitrogen compounds
2272	13	13	2	1	0	8	215.114	5e-06	Basic nitrogen compounds
2273	37	59	0	1	0	9	517.482	8e-05	Basic nitrogen compounds
2274	36	57	0	1	0	9	503.466	0.000128	Basic nitrogen compounds
2275	35	55	0	1	0	9	489.45	0.000235	Basic nitrogen compounds
2276	34	53	0	1	0	9	475.434	0.000365	Basic nitrogen compounds
2277	33	51	0	1	0	9	461.418	0.000558	Basic nitrogen compounds
2278	32	49	0	1	0	9	447.402	0.000767	Basic nitrogen compounds
2279	31	47	0	1	0	9	433.386	0.001061	Basic nitrogen compounds
2280	31	47	1	1	0	9	449.386	1.4e-05	Basic nitrogen compounds
2281	30	45	0	1	0	9	419.37	0.001401	Basic nitrogen compounds
2282	30	45	1	1	0	9	435.37	2.4e-05	Basic nitrogen compounds
2283	30	45	2	1	0	9	451.37	1.6e-05	Basic nitrogen compounds
2284	29	43	0	1	0	9	405.354	0.001858	Basic nitrogen compounds
2285	29	43	1	1	0	9	421.354	3e-05	Basic nitrogen compounds
2286	28	41	0	1	0	9	391.338	0.002355	Basic nitrogen compounds
2287	28	41	1	1	0	9	407.338	2.6e-05	Basic nitrogen compounds
2288	28	41	2	1	0	9	423.338	2.1e-05	Basic nitrogen compounds
2289	27	39	0	1	0	9	377.322	0.002814	Basic nitrogen compounds
2290	27	39	1	1	0	9	393.322	3.8e-05	Basic nitrogen compounds
2291	27	39	2	1	0	9	409.322	1.6e-05	Basic nitrogen compounds
2292	26	37	0	1	0	9	363.306	0.003455	Basic nitrogen compounds
2293	26	37	1	1	0	9	379.306	3.5e-05	Basic nitrogen compounds
2294	26	37	2	1	0	9	395.306	2.5e-05	Basic nitrogen compounds
2295	25	35	0	1	0	9	349.29	0.004032	Basic nitrogen compounds
2296	25	35	1	1	0	9	365.29	3.4e-05	Basic nitrogen compounds
2297	25	35	2	1	0	9	381.29	2.8e-05	Basic nitrogen compounds
2298	24	33	0	1	0	9	335.274	0.004472	Basic nitrogen compounds
2299	24	33	1	1	0	9	351.274	3.5e-05	Basic nitrogen compounds
2300	24	33	2	1	0	9	367.274	2.9e-05	Basic nitrogen compounds
2301	23	31	0	1	0	9	321.258	0.005154	Basic nitrogen compounds
2302	23	31	1	1	0	9	337.258	4.5e-05	Basic nitrogen compounds
2303	23	31	2	1	0	9	353.258	2.9e-05	Basic nitrogen compounds
2304	22	29	0	1	0	9	307.242	0.005896	Basic nitrogen compounds
2305	22	29	1	1	0	9	323.242	4.3e-05	Basic nitrogen compounds
2306	22	29	2	1	0	9	339.242	2.4e-05	Basic nitrogen compounds
2307	21	27	0	1	0	9	293.226	0.006522	Basic nitrogen compounds
2308	21	27	1	1	0	9	309.226	5e-05	Basic nitrogen compounds
2309	21	27	2	1	0	9	325.226	2.9e-05	Basic nitrogen compounds
2310	20	25	0	1	0	9	279.21	0.007694	Basic nitrogen compounds
2311	20	25	1	1	0	9	295.21	3.4e-05	Basic nitrogen compounds
2312	20	25	2	1	0	9	311.21	2e-05	Basic nitrogen compounds
2313	19	23	0	1	0	9	265.194	0.008875	Basic nitrogen compounds
2314	19	23	1	1	0	9	281.194	3.2e-05	Basic nitrogen compounds
2315	19	23	2	1	0	9	297.194	2.4e-05	Basic nitrogen compounds
2316	18	21	0	1	0	9	251.178	0.006822	Basic nitrogen compounds
2317	18	21	1	1	0	9	267.178	2.3e-05	Basic nitrogen compounds
2318	18	21	2	1	0	9	283.178	1.5e-05	Basic nitrogen compounds
2319	17	19	0	1	0	9	237.162	0.005899	Basic nitrogen compounds
2320	17	19	1	1	0	9	253.162	1.5e-05	Basic nitrogen compounds
2321	17	19	2	1	0	9	269.162	9e-06	Basic nitrogen compounds
2322	16	17	0	1	0	9	223.146	0.006018	Basic nitrogen compounds
2323	16	17	1	1	0	9	239.146	1.2e-05	Basic nitrogen compounds
2324	15	15	0	1	0	9	209.13	0.002782	Basic nitrogen compounds
2325	15	15	1	1	0	9	225.13	8e-06	Basic nitrogen compounds
2326	14	13	0	1	0	9	195.114	0.000546	Basic nitrogen compounds
2327	13	11	0	1	0	9	181.098	9.2e-05	Basic nitrogen compounds
2328	39	61	0	1	0	10	543.498	3.8e-05	Basic nitrogen compounds
2329	38	59	0	1	0	10	529.482	5.1e-05	Basic nitrogen compounds
2330	37	57	0	1	0	10	515.466	8.7e-05	Basic nitrogen compounds
2331	36	55	0	1	0	10	501.45	0.000142	Basic nitrogen compounds
2332	35	53	0	1	0	10	487.434	0.000232	Basic nitrogen compounds
2333	34	51	0	1	0	10	473.418	0.000331	Basic nitrogen compounds
2334	33	49	0	1	0	10	459.402	0.000497	Basic nitrogen compounds
2335	33	49	1	1	0	10	475.402	2.2e-05	Basic nitrogen compounds
2336	32	47	0	1	0	10	445.386	0.000674	Basic nitrogen compounds
2337	32	47	1	1	0	10	461.386	1.5e-05	Basic nitrogen compounds
2338	32	47	2	1	0	10	477.386	1.4e-05	Basic nitrogen compounds
2339	31	45	0	1	0	10	431.37	0.000904	Basic nitrogen compounds
2340	31	45	1	1	0	10	447.37	2e-05	Basic nitrogen compounds
2341	31	45	2	1	0	10	463.37	1.5e-05	Basic nitrogen compounds
2342	30	43	0	1	0	10	417.354	0.001173	Basic nitrogen compounds
2343	30	43	1	1	0	10	433.354	2.6e-05	Basic nitrogen compounds
2344	30	43	2	1	0	10	449.354	1.4e-05	Basic nitrogen compounds
2345	29	41	0	1	0	10	403.338	0.001466	Basic nitrogen compounds
2346	29	41	1	1	0	10	419.338	3.2e-05	Basic nitrogen compounds
2347	29	41	2	1	0	10	435.338	2.7e-05	Basic nitrogen compounds
2348	28	39	0	1	0	10	389.322	0.001767	Basic nitrogen compounds
2349	28	39	1	1	0	10	405.322	2.9e-05	Basic nitrogen compounds
2350	28	39	2	1	0	10	421.322	2.6e-05	Basic nitrogen compounds
2351	27	37	0	1	0	10	375.306	0.002104	Basic nitrogen compounds
2352	27	37	1	1	0	10	391.306	4.2e-05	Basic nitrogen compounds
2353	27	37	2	1	0	10	407.306	2.9e-05	Basic nitrogen compounds
2354	26	35	0	1	0	10	361.29	0.002486	Basic nitrogen compounds
2355	26	35	1	1	0	10	377.29	4.2e-05	Basic nitrogen compounds
2356	26	35	2	1	0	10	393.29	3.8e-05	Basic nitrogen compounds
2357	25	33	0	1	0	10	347.274	0.002781	Basic nitrogen compounds
2358	25	33	1	1	0	10	363.274	4.3e-05	Basic nitrogen compounds
2359	25	33	2	1	0	10	379.274	4.3e-05	Basic nitrogen compounds
2360	24	31	0	1	0	10	333.258	0.003191	Basic nitrogen compounds
2361	24	31	1	1	0	10	349.258	5.7e-05	Basic nitrogen compounds
2362	24	31	2	1	0	10	365.258	4.7e-05	Basic nitrogen compounds
2363	23	29	0	1	0	10	319.242	0.003892	Basic nitrogen compounds
2364	23	29	1	1	0	10	335.242	5.3e-05	Basic nitrogen compounds
2365	23	29	2	1	0	10	351.242	4.6e-05	Basic nitrogen compounds
2366	22	27	0	1	0	10	305.226	0.004229	Basic nitrogen compounds
2367	22	27	1	1	0	10	321.226	5.6e-05	Basic nitrogen compounds
2368	22	27	2	1	0	10	337.226	4.2e-05	Basic nitrogen compounds
2369	21	25	0	1	0	10	291.21	0.004715	Basic nitrogen compounds
2370	21	25	1	1	0	10	307.21	6.1e-05	Basic nitrogen compounds
2371	21	25	2	1	0	10	323.21	3.8e-05	Basic nitrogen compounds
2372	20	23	0	1	0	10	277.194	0.004416	Basic nitrogen compounds
2373	20	23	1	1	0	10	293.194	5.3e-05	Basic nitrogen compounds
2374	20	23	2	1	0	10	309.194	3.6e-05	Basic nitrogen compounds
2375	19	21	0	1	0	10	263.178	0.003328	Basic nitrogen compounds
2376	19	21	1	1	0	10	279.178	5.5e-05	Basic nitrogen compounds
2377	19	21	2	1	0	10	295.178	2.5e-05	Basic nitrogen compounds
2378	18	19	0	1	0	10	249.162	0.001395	Basic nitrogen compounds
2379	18	19	1	1	0	10	265.162	5.4e-05	Basic nitrogen compounds
2380	18	19	2	1	0	10	281.162	1.4e-05	Basic nitrogen compounds
2381	17	17	0	1	0	10	235.146	0.000507	Basic nitrogen compounds
2382	17	17	1	1	0	10	251.146	3.6e-05	Basic nitrogen compounds
2383	17	17	2	1	0	10	267.146	8e-06	Basic nitrogen compounds
2384	16	15	0	1	0	10	221.13	0.000135	Basic nitrogen compounds
2385	16	15	1	1	0	10	237.13	3.1e-05	Basic nitrogen compounds
2386	16	15	2	1	0	10	253.13	8e-06	Basic nitrogen compounds
2387	15	13	0	1	0	10	207.114	2.5e-05	Basic nitrogen compounds
2388	15	13	1	1	0	10	223.114	2.8e-05	Basic nitrogen compounds
2389	14	11	1	1	0	10	209.098	1.4e-05	Basic nitrogen compounds
2390	39	59	0	1	0	11	541.482	2.4e-05	Basic nitrogen compounds
2391	38	57	0	1	0	11	527.466	4.1e-05	Basic nitrogen compounds
2392	37	55	0	1	0	11	513.45	7e-05	Basic nitrogen compounds
2393	36	53	0	1	0	11	499.434	0.00013	Basic nitrogen compounds
2394	35	51	0	1	0	11	485.418	0.000199	Basic nitrogen compounds
2395	34	49	0	1	0	11	471.402	0.000288	Basic nitrogen compounds
2396	33	47	0	1	0	11	457.386	0.000411	Basic nitrogen compounds
2397	32	45	0	1	0	11	443.37	0.000559	Basic nitrogen compounds
2398	32	45	1	1	0	11	459.37	1.5e-05	Basic nitrogen compounds
2399	32	45	2	1	0	11	475.37	1.5e-05	Basic nitrogen compounds
2400	31	43	0	1	0	11	429.354	0.00074	Basic nitrogen compounds
2401	31	43	1	1	0	11	445.354	1.3e-05	Basic nitrogen compounds
2402	31	43	2	1	0	11	461.354	1.6e-05	Basic nitrogen compounds
2403	30	41	0	1	0	11	415.338	0.000909	Basic nitrogen compounds
2404	30	41	1	1	0	11	431.338	2.3e-05	Basic nitrogen compounds
2405	30	41	2	1	0	11	447.338	2.2e-05	Basic nitrogen compounds
2406	29	39	0	1	0	11	401.322	0.001141	Basic nitrogen compounds
2407	29	39	1	1	0	11	417.322	3.7e-05	Basic nitrogen compounds
2408	29	39	2	1	0	11	433.322	2.3e-05	Basic nitrogen compounds
2409	28	37	0	1	0	11	387.306	0.001332	Basic nitrogen compounds
2410	28	37	1	1	0	11	403.306	3.3e-05	Basic nitrogen compounds
2411	28	37	2	1	0	11	419.306	2.5e-05	Basic nitrogen compounds
2412	27	35	0	1	0	11	373.29	0.001646	Basic nitrogen compounds
2413	27	35	1	1	0	11	389.29	4e-05	Basic nitrogen compounds
2414	27	35	2	1	0	11	405.29	2.9e-05	Basic nitrogen compounds
2415	26	33	0	1	0	11	359.274	0.001884	Basic nitrogen compounds
2416	26	33	1	1	0	11	375.274	4.5e-05	Basic nitrogen compounds
2417	26	33	2	1	0	11	391.274	3.8e-05	Basic nitrogen compounds
2418	25	31	0	1	0	11	345.258	0.002071	Basic nitrogen compounds
2419	25	31	1	1	0	11	361.258	4.5e-05	Basic nitrogen compounds
2420	25	31	2	1	0	11	377.258	3.6e-05	Basic nitrogen compounds
2421	24	29	0	1	0	11	331.242	0.00233	Basic nitrogen compounds
2422	24	29	1	1	0	11	347.242	5.4e-05	Basic nitrogen compounds
2423	24	29	2	1	0	11	363.242	3.8e-05	Basic nitrogen compounds
2424	23	27	0	1	0	11	317.226	0.002352	Basic nitrogen compounds
2425	23	27	1	1	0	11	333.226	5.2e-05	Basic nitrogen compounds
2426	23	27	2	1	0	11	349.226	3.5e-05	Basic nitrogen compounds
2427	22	25	0	1	0	11	303.21	0.002021	Basic nitrogen compounds
2428	22	25	1	1	0	11	319.21	4.9e-05	Basic nitrogen compounds
2429	22	25	2	1	0	11	335.21	3e-05	Basic nitrogen compounds
2430	21	23	0	1	0	11	289.194	0.001443	Basic nitrogen compounds
2431	21	23	1	1	0	11	305.194	4.1e-05	Basic nitrogen compounds
2432	21	23	2	1	0	11	321.194	1.8e-05	Basic nitrogen compounds
2433	20	21	0	1	0	11	275.178	0.000636	Basic nitrogen compounds
2434	20	21	1	1	0	11	291.178	3.9e-05	Basic nitrogen compounds
2435	20	21	2	1	0	11	307.178	1.6e-05	Basic nitrogen compounds
2436	19	19	0	1	0	11	261.162	0.000233	Basic nitrogen compounds
2437	19	19	1	1	0	11	277.162	2.4e-05	Basic nitrogen compounds
2438	19	19	2	1	0	11	293.162	1.3e-05	Basic nitrogen compounds
2439	18	17	0	1	0	11	247.146	6.8e-05	Basic nitrogen compounds
2440	18	17	1	1	0	11	263.146	1.5e-05	Basic nitrogen compounds
2441	17	15	0	1	0	11	233.13	2.4e-05	Basic nitrogen compounds
2442	17	15	1	1	0	11	249.13	9e-06	Basic nitrogen compounds
2443	16	13	0	1	0	11	219.114	7e-06	Basic nitrogen compounds
2444	40	59	0	1	0	12	553.482	1.4e-05	Basic nitrogen compounds
2445	37	53	0	1	0	12	511.434	0.000102	Basic nitrogen compounds
2446	36	51	0	1	0	12	497.418	0.000165	Basic nitrogen compounds
2447	35	49	0	1	0	12	483.402	0.000267	Basic nitrogen compounds
2448	34	47	0	1	0	12	469.386	0.000377	Basic nitrogen compounds
2449	34	47	2	1	0	12	501.386	1.5e-05	Basic nitrogen compounds
2450	33	45	0	1	0	12	455.37	0.000554	Basic nitrogen compounds
2451	33	45	1	1	0	12	471.37	1.5e-05	Basic nitrogen compounds
2452	33	45	2	1	0	12	487.37	1.4e-05	Basic nitrogen compounds
2453	32	43	0	1	0	12	441.354	0.000785	Basic nitrogen compounds
2454	32	43	1	1	0	12	457.354	1.8e-05	Basic nitrogen compounds
2455	32	43	2	1	0	12	473.354	1.4e-05	Basic nitrogen compounds
2456	31	41	0	1	0	12	427.338	0.001039	Basic nitrogen compounds
2457	31	41	1	1	0	12	443.338	1.6e-05	Basic nitrogen compounds
2458	30	39	0	1	0	12	413.322	0.00133	Basic nitrogen compounds
2459	30	39	1	1	0	12	429.322	2e-05	Basic nitrogen compounds
2460	30	39	2	1	0	12	445.322	1.5e-05	Basic nitrogen compounds
2461	29	37	0	1	0	12	399.306	0.001687	Basic nitrogen compounds
2462	29	37	1	1	0	12	415.306	2.4e-05	Basic nitrogen compounds
2463	29	37	2	1	0	12	431.306	1.8e-05	Basic nitrogen compounds
2464	28	35	0	1	0	12	385.29	0.002006	Basic nitrogen compounds
2465	28	35	1	1	0	12	401.29	2.5e-05	Basic nitrogen compounds
2466	28	35	2	1	0	12	417.29	1.7e-05	Basic nitrogen compounds
2467	27	33	0	1	0	12	371.274	0.002431	Basic nitrogen compounds
2468	27	33	1	1	0	12	387.274	3.8e-05	Basic nitrogen compounds
2469	27	33	2	1	0	12	403.274	2.3e-05	Basic nitrogen compounds
2470	26	31	0	1	0	12	357.258	0.002879	Basic nitrogen compounds
2471	26	31	1	1	0	12	373.258	3.7e-05	Basic nitrogen compounds
2472	26	31	2	1	0	12	389.258	2.4e-05	Basic nitrogen compounds
2473	25	29	0	1	0	12	343.242	0.003098	Basic nitrogen compounds
2474	25	29	1	1	0	12	359.242	3.8e-05	Basic nitrogen compounds
2475	25	29	2	1	0	12	375.242	1.7e-05	Basic nitrogen compounds
2476	24	27	0	1	0	12	329.226	0.003739	Basic nitrogen compounds
2477	24	27	1	1	0	12	345.226	3.7e-05	Basic nitrogen compounds
2478	24	27	2	1	0	12	361.226	2.1e-05	Basic nitrogen compounds
2479	23	25	0	1	0	12	315.21	0.004614	Basic nitrogen compounds
2480	23	25	1	1	0	12	331.21	2.9e-05	Basic nitrogen compounds
2481	23	25	2	1	0	12	347.21	2e-05	Basic nitrogen compounds
2482	22	23	0	1	0	12	301.194	0.006512	Basic nitrogen compounds
2483	22	23	1	1	0	12	317.194	3.1e-05	Basic nitrogen compounds
2484	21	21	0	1	0	12	287.178	0.01038	Basic nitrogen compounds
2485	21	21	1	1	0	12	303.178	2.1e-05	Basic nitrogen compounds
2486	21	21	2	1	0	12	319.178	1.5e-05	Basic nitrogen compounds
2487	20	19	0	1	0	12	273.162	0.012608	Basic nitrogen compounds
2488	20	19	1	1	0	12	289.162	2.5e-05	Basic nitrogen compounds
2489	20	19	2	1	0	12	305.162	1.5e-05	Basic nitrogen compounds
2490	19	17	0	1	0	12	259.146	0.008414	Basic nitrogen compounds
2491	19	17	1	1	0	12	275.146	2.4e-05	Basic nitrogen compounds
2492	18	15	0	1	0	12	245.13	0.002709	Basic nitrogen compounds
2493	18	15	1	1	0	12	261.13	1.8e-05	Basic nitrogen compounds
2494	17	13	0	1	0	12	231.114	0.000624	Basic nitrogen compounds
2495	17	13	1	1	0	12	247.114	1e-05	Basic nitrogen compounds
2496	16	11	0	1	0	12	217.098	7.9e-05	Basic nitrogen compounds
2497	16	11	1	1	0	12	233.098	9e-06	Basic nitrogen compounds
2498	40	57	0	1	0	13	551.466	1.6e-05	Basic nitrogen compounds
2499	39	55	0	1	0	13	537.45	2.5e-05	Basic nitrogen compounds
2500	38	53	0	1	0	13	523.434	4.6e-05	Basic nitrogen compounds
2501	37	51	0	1	0	13	509.418	8.5e-05	Basic nitrogen compounds
2502	36	49	0	1	0	13	495.402	0.000139	Basic nitrogen compounds
2503	35	47	0	1	0	13	481.386	0.00023	Basic nitrogen compounds
2504	34	45	0	1	0	13	467.37	0.000334	Basic nitrogen compounds
2505	34	45	1	1	0	13	483.37	1.6e-05	Basic nitrogen compounds
2506	33	43	0	1	0	13	453.354	0.000464	Basic nitrogen compounds
2507	33	43	1	1	0	13	469.354	1.4e-05	Basic nitrogen compounds
2508	32	41	0	1	0	13	439.338	0.000646	Basic nitrogen compounds
2509	32	41	1	1	0	13	455.338	1.8e-05	Basic nitrogen compounds
2510	32	41	2	1	0	13	471.338	1.7e-05	Basic nitrogen compounds
2511	31	39	0	1	0	13	425.322	0.0008	Basic nitrogen compounds
2512	31	39	1	1	0	13	441.322	2.1e-05	Basic nitrogen compounds
2513	30	37	0	1	0	13	411.306	0.000374	Basic nitrogen compounds
2514	30	37	1	1	0	13	427.306	2.9e-05	Basic nitrogen compounds
2515	29	35	0	1	0	13	397.29	0.001264	Basic nitrogen compounds
2516	29	35	1	1	0	13	413.29	3.7e-05	Basic nitrogen compounds
2517	29	35	2	1	0	13	429.29	1.4e-05	Basic nitrogen compounds
2518	28	33	0	1	0	13	383.274	0.001528	Basic nitrogen compounds
2519	28	33	1	1	0	13	399.274	3.5e-05	Basic nitrogen compounds
2520	28	33	2	1	0	13	415.274	1.5e-05	Basic nitrogen compounds
2521	27	31	0	1	0	13	369.258	0.001777	Basic nitrogen compounds
2522	27	31	1	1	0	13	385.258	5.3e-05	Basic nitrogen compounds
2523	27	31	2	1	0	13	401.258	2.3e-05	Basic nitrogen compounds
2524	26	29	0	1	0	13	355.242	0.002126	Basic nitrogen compounds
2525	26	29	1	1	0	13	371.242	5.7e-05	Basic nitrogen compounds
2526	26	29	2	1	0	13	387.242	1.5e-05	Basic nitrogen compounds
2527	25	27	0	1	0	13	341.226	0.00239	Basic nitrogen compounds
2528	25	27	1	1	0	13	357.226	6.6e-05	Basic nitrogen compounds
2529	25	27	2	1	0	13	373.226	2e-05	Basic nitrogen compounds
2530	24	25	0	1	0	13	327.21	0.002817	Basic nitrogen compounds
2531	24	25	1	1	0	13	343.21	6.3e-05	Basic nitrogen compounds
2532	24	25	2	1	0	13	359.21	1.5e-05	Basic nitrogen compounds
2533	23	23	0	1	0	13	313.194	0.002661	Basic nitrogen compounds
2534	23	23	1	1	0	13	329.194	7.5e-05	Basic nitrogen compounds
2535	23	23	2	1	0	13	345.194	1.7e-05	Basic nitrogen compounds
2536	22	21	0	1	0	13	299.178	0.00214	Basic nitrogen compounds
2537	22	21	1	1	0	13	315.178	5.5e-05	Basic nitrogen compounds
2538	22	21	2	1	0	13	331.178	1.8e-05	Basic nitrogen compounds
2539	21	19	0	1	0	13	285.162	0.001323	Basic nitrogen compounds
2540	21	19	1	1	0	13	301.162	4.8e-05	Basic nitrogen compounds
2541	20	17	0	1	0	13	271.146	0.000523	Basic nitrogen compounds
2542	20	17	1	1	0	13	287.146	3.2e-05	Basic nitrogen compounds
2543	20	17	2	1	0	13	303.146	1.3e-05	Basic nitrogen compounds
2544	19	15	0	1	0	13	257.13	0.000126	Basic nitrogen compounds
2545	19	15	1	1	0	13	273.13	2.3e-05	Basic nitrogen compounds
2546	18	13	0	1	0	13	243.114	1.4e-05	Basic nitrogen compounds
2547	18	13	1	1	0	13	259.114	8e-06	Basic nitrogen compounds
2548	38	51	0	1	0	14	521.418	4.1e-05	Basic nitrogen compounds
2549	37	49	0	1	0	14	507.402	7.4e-05	Basic nitrogen compounds
2550	36	47	0	1	0	14	493.386	0.000119	Basic nitrogen compounds
2551	36	47	0	1	1	14	525.446	2.2e-05	Basic nitrogen compounds
2552	35	45	0	1	0	14	479.37	0.000181	Basic nitrogen compounds
2553	35	45	0	1	1	14	511.43	1.7e-05	Basic nitrogen compounds
2554	34	43	0	1	0	14	465.354	0.000251	Basic nitrogen compounds
2555	34	43	1	1	0	14	481.354	1.5e-05	Basic nitrogen compounds
2556	34	43	0	1	1	14	497.414	3.4e-05	Basic nitrogen compounds
2557	33	41	0	1	0	14	451.338	0.000359	Basic nitrogen compounds
2558	33	41	1	1	0	14	467.338	2.6e-05	Basic nitrogen compounds
2559	33	41	0	1	1	14	483.398	5.6e-05	Basic nitrogen compounds
2560	32	39	0	1	0	14	437.322	0.000483	Basic nitrogen compounds
2561	32	39	1	1	0	14	453.322	3.8e-05	Basic nitrogen compounds
2562	32	39	0	1	1	14	469.382	7.9e-05	Basic nitrogen compounds
2563	31	37	0	1	0	14	423.306	0.000641	Basic nitrogen compounds
2564	31	37	1	1	0	14	439.306	4.3e-05	Basic nitrogen compounds
2565	31	37	0	1	1	14	455.366	0.000127	Basic nitrogen compounds
2566	30	35	0	1	0	14	409.29	0.000742	Basic nitrogen compounds
2567	30	35	1	1	0	14	425.29	5.7e-05	Basic nitrogen compounds
2568	30	35	0	1	1	14	441.35	0.000153	Basic nitrogen compounds
2569	29	33	0	1	0	14	395.274	0.000974	Basic nitrogen compounds
2570	29	33	1	1	0	14	411.274	2e-05	Basic nitrogen compounds
2571	29	33	0	1	1	14	427.334	0.000194	Basic nitrogen compounds
2572	28	31	0	1	0	14	381.258	0.001141	Basic nitrogen compounds
2573	28	31	1	1	0	14	397.258	0.0001	Basic nitrogen compounds
2574	28	31	0	1	1	14	413.318	0.000254	Basic nitrogen compounds
2575	27	29	0	1	0	14	367.242	0.001374	Basic nitrogen compounds
2576	27	29	1	1	0	14	383.242	0.000126	Basic nitrogen compounds
2577	27	29	0	1	1	14	399.302	0.00035	Basic nitrogen compounds
2578	26	27	0	1	0	14	353.226	0.001366	Basic nitrogen compounds
2579	26	27	1	1	0	14	369.226	0.000149	Basic nitrogen compounds
2580	26	27	0	1	1	14	385.286	0.000426	Basic nitrogen compounds
2581	25	25	0	1	0	14	339.21	0.001281	Basic nitrogen compounds
2582	25	25	1	1	0	14	355.21	0.000178	Basic nitrogen compounds
2583	25	25	0	1	1	14	371.27	0.000564	Basic nitrogen compounds
2584	24	23	0	1	0	14	325.194	0.001109	Basic nitrogen compounds
2585	24	23	1	1	0	14	341.194	0.000203	Basic nitrogen compounds
2586	24	23	0	1	1	14	357.254	0.000743	Basic nitrogen compounds
2587	23	21	0	1	0	14	311.178	0.000831	Basic nitrogen compounds
2588	23	21	1	1	0	14	327.178	0.000219	Basic nitrogen compounds
2589	23	21	0	1	1	14	343.238	0.000918	Basic nitrogen compounds
2590	22	19	0	1	0	14	297.162	0.000522	Basic nitrogen compounds
2591	22	19	1	1	0	14	313.162	0.000178	Basic nitrogen compounds
2592	22	19	0	1	1	14	329.222	0.001056	Basic nitrogen compounds
2593	21	17	0	1	0	14	283.146	0.00023	Basic nitrogen compounds
2594	21	17	1	1	0	14	299.146	0.000129	Basic nitrogen compounds
2595	21	17	0	1	1	14	315.206	0.00082	Basic nitrogen compounds
2596	20	15	0	1	0	14	269.13	7.7e-05	Basic nitrogen compounds
2597	20	15	1	1	0	14	285.13	6.7e-05	Basic nitrogen compounds
2598	20	15	0	1	1	14	301.19	0.000416	Basic nitrogen compounds
2599	19	13	0	1	0	14	255.114	1.3e-05	Basic nitrogen compounds
2600	19	13	1	1	0	14	271.114	2.2e-05	Basic nitrogen compounds
2601	19	13	0	1	1	14	287.174	0.000127	Basic nitrogen compounds
2602	18	11	0	1	1	14	273.158	2.2e-05	Basic nitrogen compounds
2603	43	59	0	1	0	15	589.482	1.6e-05	Basic nitrogen compounds
2604	39	51	0	1	0	15	533.418	1.6e-05	Basic nitrogen compounds
2605	38	49	0	1	0	15	519.402	2.8e-05	Basic nitrogen compounds
2606	37	47	0	1	0	15	505.386	5.4e-05	Basic nitrogen compounds
2607	36	45	0	1	0	15	491.37	8.4e-05	Basic nitrogen compounds
2608	35	43	0	1	0	15	477.354	0.000158	Basic nitrogen compounds
2609	35	43	0	1	1	15	509.414	1.7e-05	Basic nitrogen compounds
2610	34	41	0	1	0	15	463.338	0.000201	Basic nitrogen compounds
2611	34	41	1	1	0	15	479.338	1.8e-05	Basic nitrogen compounds
2612	34	41	0	1	1	15	495.398	3.1e-05	Basic nitrogen compounds
2613	33	39	0	1	0	15	449.322	0.000287	Basic nitrogen compounds
2614	33	39	1	1	0	15	465.322	1.4e-05	Basic nitrogen compounds
2615	33	39	0	1	1	15	481.382	5e-05	Basic nitrogen compounds
2616	32	37	0	1	0	15	435.306	0.000377	Basic nitrogen compounds
2617	32	37	1	1	0	15	451.306	3e-05	Basic nitrogen compounds
2618	32	37	0	1	1	15	467.366	7.1e-05	Basic nitrogen compounds
2619	31	35	0	1	0	15	421.29	0.000505	Basic nitrogen compounds
2620	31	35	1	1	0	15	437.29	3.5e-05	Basic nitrogen compounds
2621	31	35	0	1	1	15	453.35	0.000104	Basic nitrogen compounds
2622	30	33	0	1	0	15	407.274	0.000624	Basic nitrogen compounds
2623	30	33	1	1	0	15	423.274	4.3e-05	Basic nitrogen compounds
2624	30	33	0	1	1	15	439.334	0.000133	Basic nitrogen compounds
2625	29	31	0	1	0	15	393.258	0.000746	Basic nitrogen compounds
2626	29	31	1	1	0	15	409.258	4.3e-05	Basic nitrogen compounds
2627	29	31	0	1	1	15	425.318	0.000158	Basic nitrogen compounds
2628	28	29	0	1	0	15	379.242	0.00079	Basic nitrogen compounds
2629	28	29	1	1	0	15	395.242	5.3e-05	Basic nitrogen compounds
2630	28	29	0	1	1	15	411.302	8e-05	Basic nitrogen compounds
2631	27	27	0	1	0	15	365.226	0.00096	Basic nitrogen compounds
2632	27	27	1	1	0	15	381.226	5.6e-05	Basic nitrogen compounds
2633	27	27	0	1	1	15	397.286	0.000249	Basic nitrogen compounds
2634	26	25	0	1	0	15	351.21	0.001099	Basic nitrogen compounds
2635	26	25	1	1	0	15	367.21	5e-05	Basic nitrogen compounds
2636	26	25	0	1	1	15	383.27	0.00028	Basic nitrogen compounds
2637	25	23	0	1	0	15	337.194	0.001201	Basic nitrogen compounds
2638	25	23	1	1	0	15	353.194	4.6e-05	Basic nitrogen compounds
2639	25	23	0	1	1	15	369.254	0.000249	Basic nitrogen compounds
2640	24	21	0	1	0	15	323.178	0.0015	Basic nitrogen compounds
2641	24	21	1	1	0	15	339.178	3.3e-05	Basic nitrogen compounds
2642	24	21	0	1	1	15	355.238	0.000198	Basic nitrogen compounds
2643	23	19	0	1	0	15	309.162	0.001489	Basic nitrogen compounds
2644	23	19	1	1	0	15	325.162	1.7e-05	Basic nitrogen compounds
2645	23	19	0	1	1	15	341.222	0.00011	Basic nitrogen compounds
2646	22	17	0	1	0	15	295.146	0.000884	Basic nitrogen compounds
2647	22	17	1	1	0	15	311.146	1.3e-05	Basic nitrogen compounds
2648	22	17	0	1	1	15	327.206	4e-05	Basic nitrogen compounds
2649	21	15	0	1	0	15	281.13	0.000312	Basic nitrogen compounds
2650	21	15	1	1	0	15	297.13	9e-06	Basic nitrogen compounds
2651	21	15	0	1	1	15	313.19	1.2e-05	Basic nitrogen compounds
2652	20	13	0	1	0	15	267.114	5.5e-05	Basic nitrogen compounds
2653	41	53	0	1	0	16	559.434	1.9e-05	Basic nitrogen compounds
2654	38	47	0	1	0	16	517.386	2.4e-05	Basic nitrogen compounds
2655	37	45	0	1	0	16	503.37	4.1e-05	Basic nitrogen compounds
2656	36	43	0	1	0	16	489.354	6.9e-05	Basic nitrogen compounds
2657	36	43	0	1	1	16	521.414	2e-05	Basic nitrogen compounds
2658	35	41	0	1	0	16	475.338	0.000106	Basic nitrogen compounds
2659	35	41	0	1	1	16	507.398	1.7e-05	Basic nitrogen compounds
2660	34	39	0	1	0	16	461.322	0.000139	Basic nitrogen compounds
2661	34	39	0	1	1	16	493.382	2.3e-05	Basic nitrogen compounds
2662	33	37	0	1	0	16	447.306	0.000207	Basic nitrogen compounds
2663	33	37	0	1	1	16	479.366	3.4e-05	Basic nitrogen compounds
2664	32	35	0	1	0	16	433.29	0.000274	Basic nitrogen compounds
2665	32	35	1	1	0	16	449.29	2.3e-05	Basic nitrogen compounds
2666	32	35	0	1	1	16	465.35	4.3e-05	Basic nitrogen compounds
2667	31	33	0	1	0	16	419.274	0.000338	Basic nitrogen compounds
2668	31	33	1	1	0	16	435.274	2e-05	Basic nitrogen compounds
2669	31	33	0	1	1	16	451.334	5.8e-05	Basic nitrogen compounds
2670	30	31	0	1	0	16	405.258	0.000402	Basic nitrogen compounds
2671	30	31	1	1	0	16	421.258	2e-05	Basic nitrogen compounds
2672	30	31	0	1	1	16	437.318	6.8e-05	Basic nitrogen compounds
2673	29	29	0	1	0	16	391.242	0.00048	Basic nitrogen compounds
2674	29	29	1	1	0	16	407.242	2.2e-05	Basic nitrogen compounds
2675	29	29	0	1	1	16	423.302	8.8e-05	Basic nitrogen compounds
2676	28	27	0	1	0	16	377.226	0.000542	Basic nitrogen compounds
2677	28	27	1	1	0	16	393.226	2e-05	Basic nitrogen compounds
2678	28	27	0	1	1	16	409.286	8e-05	Basic nitrogen compounds
2679	27	25	0	1	0	16	363.21	0.000565	Basic nitrogen compounds
2680	27	25	1	1	0	16	379.21	2.5e-05	Basic nitrogen compounds
2681	27	25	0	1	1	16	395.27	7.8e-05	Basic nitrogen compounds
2682	26	23	0	1	0	16	349.194	0.000521	Basic nitrogen compounds
2683	26	23	1	1	0	16	365.194	2.3e-05	Basic nitrogen compounds
2684	26	23	0	1	1	16	381.254	6.8e-05	Basic nitrogen compounds
2685	25	21	0	1	0	16	335.178	0.000352	Basic nitrogen compounds
2686	25	21	1	1	0	16	351.178	2.1e-05	Basic nitrogen compounds
2687	25	21	0	1	1	16	367.238	8.5e-05	Basic nitrogen compounds
2688	24	19	0	1	0	16	321.162	0.000187	Basic nitrogen compounds
2689	24	19	0	1	1	16	353.222	7.2e-05	Basic nitrogen compounds
2690	23	17	0	1	0	16	307.146	6.8e-05	Basic nitrogen compounds
2691	23	17	0	1	1	16	339.206	4.8e-05	Basic nitrogen compounds
2692	22	15	0	1	0	16	293.13	1.6e-05	Basic nitrogen compounds
2693	22	15	0	1	1	16	325.19	2.2e-05	Basic nitrogen compounds
2694	40	49	0	1	0	17	543.402	1.6e-05	Basic nitrogen compounds
2695	38	45	0	1	0	17	515.37	3.2e-05	Basic nitrogen compounds
2696	37	43	0	1	0	17	501.354	2.4e-05	Basic nitrogen compounds
2697	37	43	0	1	1	17	533.414	1.5e-05	Basic nitrogen compounds
2698	36	41	0	1	0	17	487.338	4.6e-05	Basic nitrogen compounds
2699	35	39	0	1	0	17	473.322	8e-05	Basic nitrogen compounds
2700	35	39	0	1	1	17	505.382	1.3e-05	Basic nitrogen compounds
2701	34	37	0	1	0	17	459.306	9.3e-05	Basic nitrogen compounds
2702	34	37	0	1	1	17	491.366	1.6e-05	Basic nitrogen compounds
2703	33	35	0	1	0	17	445.29	0.000136	Basic nitrogen compounds
2704	33	35	1	1	0	17	461.29	1.4e-05	Basic nitrogen compounds
2705	33	35	0	1	1	17	477.35	2.3e-05	Basic nitrogen compounds
2706	32	33	0	1	0	17	431.274	0.000182	Basic nitrogen compounds
2707	32	33	1	1	0	17	447.274	1.5e-05	Basic nitrogen compounds
2708	32	33	0	1	1	17	463.334	3.4e-05	Basic nitrogen compounds
2709	31	31	0	1	0	17	417.258	0.000203	Basic nitrogen compounds
2710	31	31	1	1	0	17	433.258	1.6e-05	Basic nitrogen compounds
2711	31	31	0	1	1	17	449.318	5e-05	Basic nitrogen compounds
2712	30	29	0	1	0	17	403.242	0.000246	Basic nitrogen compounds
2713	30	29	1	1	0	17	419.242	2.2e-05	Basic nitrogen compounds
2714	30	29	0	1	1	17	435.302	5.8e-05	Basic nitrogen compounds
2715	29	27	0	1	0	17	389.226	0.000277	Basic nitrogen compounds
2716	29	27	1	1	0	17	405.226	3.5e-05	Basic nitrogen compounds
2717	29	27	0	1	1	17	421.286	8.4e-05	Basic nitrogen compounds
2718	28	25	0	1	0	17	375.21	0.000293	Basic nitrogen compounds
2719	28	25	1	1	0	17	391.21	2.9e-05	Basic nitrogen compounds
2720	28	25	0	1	1	17	407.27	0.000116	Basic nitrogen compounds
2721	27	23	0	1	0	17	361.194	0.000263	Basic nitrogen compounds
2722	27	23	1	1	0	17	377.194	3.7e-05	Basic nitrogen compounds
2723	27	23	0	1	1	17	393.254	0.000167	Basic nitrogen compounds
2724	26	21	0	1	0	17	347.178	0.000208	Basic nitrogen compounds
2725	26	21	1	1	0	17	363.178	3.6e-05	Basic nitrogen compounds
2726	26	21	0	1	1	17	379.238	0.000189	Basic nitrogen compounds
2727	25	19	0	1	0	17	333.162	0.000141	Basic nitrogen compounds
2728	25	19	1	1	0	17	349.162	2.6e-05	Basic nitrogen compounds
2729	25	19	0	1	1	17	365.222	0.000178	Basic nitrogen compounds
2730	24	17	0	1	0	17	319.146	6.8e-05	Basic nitrogen compounds
2731	24	17	1	1	0	17	335.146	1.3e-05	Basic nitrogen compounds
2732	24	17	0	1	1	17	351.206	0.000103	Basic nitrogen compounds
2733	23	15	0	1	0	17	305.13	2.3e-05	Basic nitrogen compounds
2734	23	15	0	1	1	17	337.19	2.9e-05	Basic nitrogen compounds
2735	37	41	0	1	0	18	499.338	2.4e-05	Basic nitrogen compounds
2736	35	37	0	1	0	18	471.306	4.4e-05	Basic nitrogen compounds
2737	34	35	0	1	0	18	457.29	6.3e-05	Basic nitrogen compounds
2738	34	35	0	1	1	18	489.35	2.3e-05	Basic nitrogen compounds
2739	33	33	0	1	0	18	443.274	9.3e-05	Basic nitrogen compounds
2740	33	33	1	1	0	18	459.274	1.4e-05	Basic nitrogen compounds
2741	33	33	0	1	1	18	475.334	3e-05	Basic nitrogen compounds
2742	32	31	0	1	0	18	429.258	0.000105	Basic nitrogen compounds
2743	32	31	0	1	1	18	461.318	3.4e-05	Basic nitrogen compounds
2744	31	29	0	1	0	18	415.242	0.00011	Basic nitrogen compounds
2745	31	29	1	1	0	18	431.242	1.8e-05	Basic nitrogen compounds
2746	31	29	0	1	1	18	447.302	5.3e-05	Basic nitrogen compounds
2747	30	27	0	1	0	18	401.226	0.000129	Basic nitrogen compounds
2748	30	27	1	1	0	18	417.226	1.3e-05	Basic nitrogen compounds
2749	30	27	0	1	1	18	433.286	5.8e-05	Basic nitrogen compounds
2750	29	25	0	1	0	18	387.21	0.000113	Basic nitrogen compounds
2751	29	25	1	1	0	18	403.21	1.8e-05	Basic nitrogen compounds
2752	29	25	0	1	1	18	419.27	6.9e-05	Basic nitrogen compounds
2753	28	23	0	1	0	18	373.194	0.000127	Basic nitrogen compounds
2754	28	23	0	1	1	18	405.254	4.8e-05	Basic nitrogen compounds
2755	27	21	0	1	0	18	359.178	0.00011	Basic nitrogen compounds
2756	27	21	0	1	1	18	391.238	4.9e-05	Basic nitrogen compounds
2757	26	19	0	1	0	18	345.162	5.8e-05	Basic nitrogen compounds
2758	26	19	0	1	1	18	377.222	1.9e-05	Basic nitrogen compounds
2759	34	33	0	1	1	19	487.334	1.8e-05	Basic nitrogen compounds
2760	33	31	0	1	1	19	473.318	1.3e-05	Basic nitrogen compounds
2761	32	29	0	1	1	19	459.302	1.4e-05	Basic nitrogen compounds
2762	31	27	0	1	1	19	445.286	1.4e-05	Basic nitrogen compounds
2763	30	25	0	1	1	19	431.27	1.7e-05	Basic nitrogen compounds
2764	29	23	0	1	1	19	417.254	1.7e-05	Basic nitrogen compounds
2765	28	21	0	1	1	19	403.238	1.3e-05	Basic nitrogen compounds
2766	36	68	0	0	1	3	532.604	1.6e-05	Thiophenic compounds
2767	29	54	0	0	1	3	434.492	1.4e-05	Thiophenic compounds
2768	28	52	0	0	1	3	420.476	5.4e-05	Thiophenic compounds
2769	27	50	0	0	1	3	406.46	7e-05	Thiophenic compounds
2770	26	48	0	0	1	3	392.444	0.000112	Thiophenic compounds
2771	25	46	0	0	1	3	378.428	0.000162	Thiophenic compounds
2772	24	44	0	0	1	3	364.412	0.000263	Thiophenic compounds
2773	23	42	0	0	1	3	350.396	0.00021	Thiophenic compounds
2774	22	40	0	0	1	3	336.38	0.000274	Thiophenic compounds
2775	21	38	0	0	1	3	322.364	0.00031	Thiophenic compounds
2776	20	36	0	0	1	3	308.348	0.000502	Thiophenic compounds
2777	19	34	0	0	1	3	294.332	0.000334	Thiophenic compounds
2778	18	32	0	0	1	3	280.316	0.000477	Thiophenic compounds
2779	17	30	0	0	1	3	266.3	0.000393	Thiophenic compounds
2780	16	28	0	0	1	3	252.284	0.000373	Thiophenic compounds
2781	15	26	0	0	1	3	238.268	0.00023	Thiophenic compounds
2782	14	24	0	0	1	3	224.252	8.3e-05	Thiophenic compounds
2783	13	22	0	0	1	3	210.236	0.0001	Thiophenic compounds
2784	38	70	0	0	1	4	558.62	0.000101	Thiophenic compounds
2785	35	64	0	0	1	4	516.572	1.6e-05	Thiophenic compounds
2786	32	58	0	0	1	4	474.524	1.7e-05	Thiophenic compounds
2787	31	56	0	0	1	4	460.508	1.6e-05	Thiophenic compounds
2788	29	52	0	0	1	4	432.476	2.6e-05	Thiophenic compounds
2789	28	50	0	0	1	4	418.46	0.000152	Thiophenic compounds
2790	27	48	0	0	1	4	404.444	0.00019	Thiophenic compounds
2791	26	46	0	0	1	4	390.428	7.1e-05	Thiophenic compounds
2792	25	44	0	0	1	4	376.412	0.000148	Thiophenic compounds
2793	24	42	0	0	1	4	362.396	0.00037	Thiophenic compounds
2794	23	40	0	0	1	4	348.38	0.000377	Thiophenic compounds
2795	22	38	0	0	1	4	334.364	0.000446	Thiophenic compounds
2796	21	36	0	0	1	4	320.348	0.000702	Thiophenic compounds
2797	20	34	0	0	1	4	306.332	0.000887	Thiophenic compounds
2798	19	32	0	0	1	4	292.316	0.000561	Thiophenic compounds
2799	18	30	0	0	1	4	278.3	0.000624	Thiophenic compounds
2800	17	28	0	0	1	4	264.284	0.000432	Thiophenic compounds
2801	16	26	0	0	1	4	250.268	0.000351	Thiophenic compounds
2802	15	24	0	0	1	4	236.252	0.000289	Thiophenic compounds
2803	14	22	0	0	1	4	222.236	2.9e-05	Thiophenic compounds
2804	13	20	0	0	1	4	208.22	1.1e-05	Thiophenic compounds
2805	12	18	0	0	1	4	194.204	8e-06	Thiophenic compounds
2806	11	16	0	0	1	4	180.188	6e-06	Thiophenic compounds
2807	47	86	0	0	1	5	682.748	3e-05	Thiophenic compounds
2808	44	80	0	0	1	5	640.7	4.3e-05	Thiophenic compounds
2809	42	76	0	0	1	5	612.668	9.7e-05	Thiophenic compounds
2810	41	74	0	0	1	5	598.652	0.000181	Thiophenic compounds
2811	40	72	0	0	1	5	584.636	0.000185	Thiophenic compounds
2812	39	70	0	0	1	5	570.62	0.000429	Thiophenic compounds
2813	38	68	0	0	1	5	556.604	0.000584	Thiophenic compounds
2814	37	66	0	0	1	5	542.588	0.00065	Thiophenic compounds
2815	36	64	0	0	1	5	528.572	0.000856	Thiophenic compounds
2816	35	62	0	0	1	5	514.556	0.001198	Thiophenic compounds
2817	34	60	0	0	1	5	500.54	0.001517	Thiophenic compounds
2818	33	58	0	0	1	5	486.524	0.001968	Thiophenic compounds
2819	32	56	0	0	1	5	472.508	0.002409	Thiophenic compounds
2820	31	54	0	0	1	5	458.492	0.002402	Thiophenic compounds
2821	30	52	0	0	1	5	444.476	0.003513	Thiophenic compounds
2822	29	50	0	0	1	5	430.46	0.00413	Thiophenic compounds
2823	28	48	0	0	1	5	416.444	0.004848	Thiophenic compounds
2824	27	46	0	0	1	5	402.428	0.00537	Thiophenic compounds
2825	26	44	0	0	1	5	388.412	0.006722	Thiophenic compounds
2826	25	42	0	0	1	5	374.396	0.007677	Thiophenic compounds
2827	24	40	0	0	1	5	360.38	0.00868	Thiophenic compounds
2828	23	38	0	0	1	5	346.364	0.009062	Thiophenic compounds
2829	22	36	0	0	1	5	332.348	0.010336	Thiophenic compounds
2830	21	34	0	0	1	5	318.332	0.011241	Thiophenic compounds
2831	20	32	0	0	1	5	304.316	0.011814	Thiophenic compounds
2832	19	30	0	0	1	5	290.3	0.011495	Thiophenic compounds
2833	18	28	0	0	1	5	276.284	0.010357	Thiophenic compounds
2834	17	26	0	0	1	5	262.268	0.008304	Thiophenic compounds
2835	16	24	0	0	1	5	248.252	0.006108	Thiophenic compounds
2836	15	22	0	0	1	5	234.236	0.003047	Thiophenic compounds
2837	14	20	0	0	1	5	220.22	0.00084	Thiophenic compounds
2838	13	18	0	0	1	5	206.204	0.000177	Thiophenic compounds
2839	12	16	0	0	1	5	192.188	2.7e-05	Thiophenic compounds
2840	11	14	0	0	1	5	178.172	3.6e-05	Thiophenic compounds
2841	10	12	0	0	1	5	164.156	4.9e-05	Thiophenic compounds
2842	9	10	0	0	1	5	150.14	0.000127	Thiophenic compounds
2843	8	8	0	0	1	5	136.124	5.5e-05	Thiophenic compounds
2844	7	6	0	0	1	5	122.108	1.9e-05	Thiophenic compounds
2845	48	86	0	0	1	6	694.748	6.4e-05	Thiophenic compounds
2846	47	84	0	0	1	6	680.732	0.000271	Thiophenic compounds
2847	46	82	0	0	1	6	666.716	0.00031	Thiophenic compounds
2848	45	80	0	0	1	6	652.7	0.000453	Thiophenic compounds
2849	44	78	0	0	1	6	638.684	0.000635	Thiophenic compounds
2850	43	76	0	0	1	6	624.668	0.000837	Thiophenic compounds
2851	42	74	0	0	1	6	610.652	0.001292	Thiophenic compounds
2852	41	72	0	0	1	6	596.636	0.001883	Thiophenic compounds
2853	40	70	0	0	1	6	582.62	0.002249	Thiophenic compounds
2854	39	68	0	0	1	6	568.604	0.003142	Thiophenic compounds
2855	38	66	0	0	1	6	554.588	0.003899	Thiophenic compounds
2856	37	64	0	0	1	6	540.572	0.005043	Thiophenic compounds
2857	36	62	0	0	1	6	526.556	0.006783	Thiophenic compounds
2858	35	60	0	0	1	6	512.54	0.009122	Thiophenic compounds
2859	34	58	0	0	1	6	498.524	0.011404	Thiophenic compounds
2860	33	56	0	0	1	6	484.508	0.015313	Thiophenic compounds
2861	32	54	0	0	1	6	470.492	0.021443	Thiophenic compounds
2862	31	52	0	0	1	6	456.476	0.026986	Thiophenic compounds
2863	30	50	0	0	1	6	442.46	0.037202	Thiophenic compounds
2864	29	48	0	0	1	6	428.444	0.047501	Thiophenic compounds
2865	28	46	0	0	1	6	414.428	0.060972	Thiophenic compounds
2866	27	44	0	0	1	6	400.412	0.072418	Thiophenic compounds
2867	26	42	0	0	1	6	386.396	0.092157	Thiophenic compounds
2868	25	40	0	0	1	6	372.38	0.109232	Thiophenic compounds
2869	24	38	0	0	1	6	358.364	0.131248	Thiophenic compounds
2870	23	36	0	0	1	6	344.348	0.148372	Thiophenic compounds
2871	22	34	0	0	1	6	330.332	0.17522	Thiophenic compounds
2872	21	32	0	0	1	6	316.316	0.201292	Thiophenic compounds
2873	20	30	0	0	1	6	302.3	0.228953	Thiophenic compounds
2874	19	28	0	0	1	6	288.284	0.255053	Thiophenic compounds
2875	18	26	0	0	1	6	274.268	0.274744	Thiophenic compounds
2876	17	24	0	0	1	6	260.252	0.290812	Thiophenic compounds
2877	16	22	0	0	1	6	246.236	0.287749	Thiophenic compounds
2878	15	20	0	0	1	6	232.22	0.245824	Thiophenic compounds
2879	14	18	0	0	1	6	218.204	0.157762	Thiophenic compounds
2880	13	16	0	0	1	6	204.188	0.077482	Thiophenic compounds
2881	12	14	0	0	1	6	190.172	0.033459	Thiophenic compounds
2882	11	12	0	0	1	6	176.156	0.006742	Thiophenic compounds
2883	10	10	0	0	1	6	162.14	0.00116	Thiophenic compounds
2884	9	8	0	0	1	6	148.124	0.000276	Thiophenic compounds
2885	8	6	0	0	1	6	134.108	4.2e-05	Thiophenic compounds
2886	48	84	0	0	1	7	692.732	2.1e-05	Thiophenic compounds
2887	47	82	0	0	1	7	678.716	0.000141	Thiophenic compounds
2888	46	80	0	0	1	7	664.7	0.000283	Thiophenic compounds
2889	45	78	0	0	1	7	650.684	0.000391	Thiophenic compounds
2890	44	76	0	0	1	7	636.668	0.000599	Thiophenic compounds
2891	43	74	0	0	1	7	622.652	0.001104	Thiophenic compounds
2892	42	72	0	0	1	7	608.636	0.0014	Thiophenic compounds
2893	41	70	0	0	1	7	594.62	0.001809	Thiophenic compounds
2894	40	68	0	0	1	7	580.604	0.002576	Thiophenic compounds
2895	39	66	0	0	1	7	566.588	0.002612	Thiophenic compounds
2896	38	64	0	0	1	7	552.572	0.003244	Thiophenic compounds
2897	37	62	0	0	1	7	538.556	0.004427	Thiophenic compounds
2898	36	60	0	0	1	7	524.54	0.00536	Thiophenic compounds
2899	35	58	0	0	1	7	510.524	0.006669	Thiophenic compounds
2900	34	56	0	0	1	7	496.508	0.008146	Thiophenic compounds
2901	33	54	0	0	1	7	482.492	0.011295	Thiophenic compounds
2902	32	52	0	0	1	7	468.476	0.014339	Thiophenic compounds
2903	31	50	0	0	1	7	454.46	0.018696	Thiophenic compounds
2904	30	48	0	0	1	7	440.444	0.025285	Thiophenic compounds
2905	29	46	0	0	1	7	426.428	0.031574	Thiophenic compounds
2906	28	44	0	0	1	7	412.412	0.037914	Thiophenic compounds
2907	27	42	0	0	1	7	398.396	0.047261	Thiophenic compounds
2908	26	40	0	0	1	7	384.38	0.05586	Thiophenic compounds
2909	25	38	0	0	1	7	370.364	0.067101	Thiophenic compounds
2910	24	36	0	0	1	7	356.348	0.079538	Thiophenic compounds
2911	23	34	0	0	1	7	342.332	0.088271	Thiophenic compounds
2912	23	34	0	0	2	7	374.392	3.3e-05	Thiophenic compounds
2913	22	32	0	0	1	7	328.316	0.101493	Thiophenic compounds
2914	21	30	0	0	1	7	314.3	0.1141	Thiophenic compounds
2915	21	30	0	0	2	7	346.36	0.000186	Thiophenic compounds
2916	20	28	0	0	1	7	300.284	0.131333	Thiophenic compounds
2917	20	28	0	0	2	7	332.344	0.000281	Thiophenic compounds
2918	19	26	0	0	1	7	286.268	0.138531	Thiophenic compounds
2919	19	26	0	0	2	7	318.328	5.2e-05	Thiophenic compounds
2920	18	24	0	0	1	7	272.252	0.148958	Thiophenic compounds
2921	17	22	0	0	1	7	258.236	0.140937	Thiophenic compounds
2922	16	20	0	0	1	7	244.22	0.124349	Thiophenic compounds
2923	16	20	0	0	2	7	276.28	2.8e-05	Thiophenic compounds
2924	15	18	0	0	1	7	230.204	0.080087	Thiophenic compounds
2925	14	16	0	0	1	7	216.188	0.03068	Thiophenic compounds
2926	14	16	0	0	2	7	248.248	3.8e-05	Thiophenic compounds
2927	13	14	0	0	1	7	202.172	0.007506	Thiophenic compounds
2928	12	12	0	0	1	7	188.156	0.001439	Thiophenic compounds
2929	11	10	0	0	1	7	174.14	0.001591	Thiophenic compounds
2930	10	8	0	0	1	7	160.124	0.001213	Thiophenic compounds
2931	9	6	0	0	1	7	146.108	0.000526	Thiophenic compounds
2932	49	84	0	0	1	8	704.732	4.5e-05	Thiophenic compounds
2933	47	80	0	0	1	8	676.7	2e-05	Thiophenic compounds
2934	46	78	0	0	1	8	662.684	0.000228	Thiophenic compounds
2935	45	76	0	0	1	8	648.668	0.000512	Thiophenic compounds
2936	44	74	0	0	1	8	634.652	0.000773	Thiophenic compounds
2937	43	72	0	0	1	8	620.636	0.000686	Thiophenic compounds
2938	42	70	0	0	1	8	606.62	0.000892	Thiophenic compounds
2939	41	68	0	0	1	8	592.604	0.001542	Thiophenic compounds
2940	40	66	0	0	1	8	578.588	0.001714	Thiophenic compounds
2941	39	64	0	0	1	8	564.572	0.002533	Thiophenic compounds
2942	38	62	0	0	1	8	550.556	0.003031	Thiophenic compounds
2943	37	60	0	0	1	8	536.54	0.003312	Thiophenic compounds
2944	37	60	0	0	2	8	568.6	4.4e-05	Thiophenic compounds
2945	36	58	0	0	1	8	522.524	0.004121	Thiophenic compounds
2946	35	56	0	0	1	8	508.508	0.005349	Thiophenic compounds
2947	35	56	0	0	2	8	540.568	7e-05	Thiophenic compounds
2948	34	54	0	0	1	8	494.492	0.007587	Thiophenic compounds
2949	34	54	0	0	2	8	526.552	9.1e-05	Thiophenic compounds
2950	33	52	0	0	1	8	480.476	0.008347	Thiophenic compounds
2951	33	52	0	0	2	8	512.536	3.6e-05	Thiophenic compounds
2952	32	50	0	0	1	8	466.46	0.011098	Thiophenic compounds
2953	32	50	0	0	2	8	498.52	0.000127	Thiophenic compounds
2954	31	48	0	0	1	8	452.444	0.012665	Thiophenic compounds
2955	31	48	0	0	2	8	484.504	0.000225	Thiophenic compounds
2956	30	46	0	0	1	8	438.428	0.015481	Thiophenic compounds
2957	30	46	0	0	2	8	470.488	0.00038	Thiophenic compounds
2958	29	44	0	0	1	8	424.412	0.020478	Thiophenic compounds
2959	29	44	0	0	2	8	456.472	0.000615	Thiophenic compounds
2960	28	42	0	0	1	8	410.396	0.025462	Thiophenic compounds
2961	28	42	0	0	2	8	442.456	0.000965	Thiophenic compounds
2962	27	40	0	0	1	8	396.38	0.028663	Thiophenic compounds
2963	27	40	0	0	2	8	428.44	0.001551	Thiophenic compounds
2964	26	38	0	0	1	8	382.364	0.033825	Thiophenic compounds
2965	26	38	0	0	2	8	414.424	0.001903	Thiophenic compounds
2966	25	36	0	0	1	8	368.348	0.0379	Thiophenic compounds
2967	25	36	0	0	2	8	400.408	0.003021	Thiophenic compounds
2968	24	34	0	0	1	8	354.332	0.043747	Thiophenic compounds
2969	24	34	0	0	2	8	386.392	0.003412	Thiophenic compounds
2970	23	32	0	0	1	8	340.316	0.050599	Thiophenic compounds
2971	23	32	0	0	2	8	372.376	0.004107	Thiophenic compounds
2972	22	30	0	0	1	8	326.3	0.055899	Thiophenic compounds
2973	22	30	0	0	2	8	358.36	0.005421	Thiophenic compounds
2974	21	28	0	0	1	8	312.284	0.060797	Thiophenic compounds
2975	21	28	0	0	2	8	344.344	0.006395	Thiophenic compounds
2976	20	26	0	0	1	8	298.268	0.063339	Thiophenic compounds
2977	20	26	0	0	2	8	330.328	0.007288	Thiophenic compounds
2978	19	24	0	0	1	8	284.252	0.060058	Thiophenic compounds
2979	19	24	0	0	2	8	316.312	0.007582	Thiophenic compounds
2980	18	22	0	0	1	8	270.236	0.053342	Thiophenic compounds
2981	18	22	0	0	2	8	302.296	0.007051	Thiophenic compounds
2982	17	20	0	0	1	8	256.22	0.038886	Thiophenic compounds
2983	17	20	0	0	2	8	288.28	0.006102	Thiophenic compounds
2984	16	18	0	0	1	8	242.204	0.019767	Thiophenic compounds
2985	16	18	0	0	2	8	274.264	0.004614	Thiophenic compounds
2986	15	16	0	0	1	8	228.188	0.006568	Thiophenic compounds
2987	15	16	0	0	2	8	260.248	0.003506	Thiophenic compounds
2988	14	14	0	0	1	8	214.172	0.001224	Thiophenic compounds
2989	14	14	0	0	2	8	246.232	0.00237	Thiophenic compounds
2990	13	12	0	0	1	8	200.156	0.000518	Thiophenic compounds
2991	13	12	0	0	2	8	232.216	0.000358	Thiophenic compounds
2992	12	10	0	0	1	8	186.14	0.000175	Thiophenic compounds
2993	11	8	0	0	1	8	172.124	4.9e-05	Thiophenic compounds
2994	10	6	0	0	1	8	158.108	1.3e-05	Thiophenic compounds
2995	50	84	0	0	1	9	716.732	0.000101	Thiophenic compounds
2996	49	82	0	0	1	9	702.716	0.00011	Thiophenic compounds
2997	48	80	0	0	1	9	688.7	0.000278	Thiophenic compounds
2998	47	78	0	0	1	9	674.684	0.00031	Thiophenic compounds
2999	46	76	0	0	1	9	660.668	0.000559	Thiophenic compounds
3000	45	74	0	0	1	9	646.652	0.000884	Thiophenic compounds
3001	44	72	0	0	1	9	632.636	0.00126	Thiophenic compounds
3002	43	70	0	0	1	9	618.62	0.001661	Thiophenic compounds
3003	42	68	0	0	1	9	604.604	0.001943	Thiophenic compounds
3004	41	66	0	0	1	9	590.588	0.002302	Thiophenic compounds
3005	40	64	0	0	1	9	576.572	0.003238	Thiophenic compounds
3006	39	62	0	0	1	9	562.556	0.004205	Thiophenic compounds
3007	38	60	0	0	1	9	548.54	0.004922	Thiophenic compounds
3008	37	58	0	0	1	9	534.524	0.00605	Thiophenic compounds
3009	36	56	0	0	1	9	520.508	0.008023	Thiophenic compounds
3010	35	54	0	0	1	9	506.492	0.0104	Thiophenic compounds
3011	34	52	0	0	1	9	492.476	0.012661	Thiophenic compounds
3012	33	50	0	0	1	9	478.46	0.01632	Thiophenic compounds
3013	32	48	0	0	1	9	464.444	0.021072	Thiophenic compounds
3014	31	46	0	0	1	9	450.428	0.028113	Thiophenic compounds
3015	31	46	0	0	2	9	482.488	2.1e-05	Thiophenic compounds
3016	30	44	0	0	1	9	436.412	0.033139	Thiophenic compounds
3017	30	44	0	0	2	9	468.472	0.000125	Thiophenic compounds
3018	29	42	0	0	1	9	422.396	0.041685	Thiophenic compounds
3019	29	42	0	0	2	9	454.456	0.000173	Thiophenic compounds
3020	28	40	0	0	1	9	408.38	0.049241	Thiophenic compounds
3021	28	40	0	0	2	9	440.44	0.000512	Thiophenic compounds
3022	27	38	0	0	1	9	394.364	0.059694	Thiophenic compounds
3023	27	38	0	0	2	9	426.424	0.000646	Thiophenic compounds
3024	26	36	0	0	1	9	380.348	0.068551	Thiophenic compounds
3025	26	36	0	0	2	9	412.408	0.000812	Thiophenic compounds
3026	25	34	0	0	1	9	366.332	0.084534	Thiophenic compounds
3027	25	34	0	0	2	9	398.392	0.001149	Thiophenic compounds
3028	24	32	0	0	1	9	352.316	0.103791	Thiophenic compounds
3029	24	32	0	0	2	9	384.376	0.001385	Thiophenic compounds
3030	23	30	0	0	1	9	338.3	0.119751	Thiophenic compounds
3031	23	30	0	0	2	9	370.36	0.00153	Thiophenic compounds
3032	22	28	0	0	1	9	324.284	0.14442	Thiophenic compounds
3033	22	28	0	0	2	9	356.344	0.001928	Thiophenic compounds
3034	21	26	0	0	1	9	310.268	0.170294	Thiophenic compounds
3035	21	26	0	0	2	9	342.328	0.001913	Thiophenic compounds
3036	20	24	0	0	1	9	296.252	0.20122	Thiophenic compounds
3037	20	24	0	0	2	9	328.312	0.001385	Thiophenic compounds
3038	19	22	0	0	1	9	282.236	0.252535	Thiophenic compounds
3039	19	22	0	0	2	9	314.296	0.001221	Thiophenic compounds
3040	18	20	0	0	1	9	268.22	0.342243	Thiophenic compounds
3041	18	20	0	0	2	9	300.28	0.000976	Thiophenic compounds
3042	17	18	0	0	1	9	254.204	0.487598	Thiophenic compounds
3043	17	18	0	0	2	9	286.264	0.000461	Thiophenic compounds
3044	16	16	0	0	1	9	240.188	0.682022	Thiophenic compounds
3045	16	16	0	0	2	9	272.248	4.3e-05	Thiophenic compounds
3046	15	14	0	0	1	9	226.172	0.8426	Thiophenic compounds
3047	15	14	0	0	2	9	258.232	1.2e-05	Thiophenic compounds
3048	14	12	0	0	1	9	212.156	0.642312	Thiophenic compounds
3049	13	10	0	0	1	9	198.14	0.203329	Thiophenic compounds
3050	13	10	0	0	2	9	230.2	3.5e-05	Thiophenic compounds
3051	12	8	0	0	1	9	184.124	0.018819	Thiophenic compounds
3052	11	6	0	0	1	9	170.108	2.2e-05	Thiophenic compounds
3053	52	86	0	0	1	10	742.748	2.4e-05	Thiophenic compounds
3054	51	84	0	0	1	10	728.732	5.4e-05	Thiophenic compounds
3055	50	82	0	0	1	10	714.716	2.4e-05	Thiophenic compounds
3056	49	80	0	0	1	10	700.7	0.000327	Thiophenic compounds
3057	48	78	0	0	1	10	686.684	0.000242	Thiophenic compounds
3058	47	76	0	0	1	10	672.668	0.000334	Thiophenic compounds
3059	46	74	0	0	1	10	658.652	0.000672	Thiophenic compounds
3060	45	72	0	0	1	10	644.636	0.000887	Thiophenic compounds
3061	44	70	0	0	1	10	630.62	0.001275	Thiophenic compounds
3062	43	68	0	0	1	10	616.604	0.001723	Thiophenic compounds
3063	42	66	0	0	1	10	602.588	0.001905	Thiophenic compounds
3064	41	64	0	0	1	10	588.572	0.002461	Thiophenic compounds
3065	40	62	0	0	1	10	574.556	0.003491	Thiophenic compounds
3066	39	60	0	0	1	10	560.54	0.003303	Thiophenic compounds
3067	38	58	0	0	1	10	546.524	0.003932	Thiophenic compounds
3068	37	56	0	0	1	10	532.508	0.005924	Thiophenic compounds
3069	36	54	0	0	1	10	518.492	0.006843	Thiophenic compounds
3070	35	52	0	0	1	10	504.476	0.009172	Thiophenic compounds
3071	34	50	0	0	1	10	490.46	0.010733	Thiophenic compounds
3072	33	48	0	0	1	10	476.444	0.012801	Thiophenic compounds
3073	33	48	0	0	2	10	508.504	2e-05	Thiophenic compounds
3074	32	46	0	0	1	10	462.428	0.015172	Thiophenic compounds
3075	31	44	0	0	1	10	448.412	0.018687	Thiophenic compounds
3076	31	44	0	0	2	10	480.472	7.6e-05	Thiophenic compounds
3077	30	42	0	0	1	10	434.396	0.024228	Thiophenic compounds
3078	30	42	0	0	2	10	466.456	0.000156	Thiophenic compounds
3079	29	40	0	0	1	10	420.38	0.030491	Thiophenic compounds
3080	29	40	0	0	2	10	452.44	0.000295	Thiophenic compounds
3081	28	38	0	0	1	10	406.364	0.036422	Thiophenic compounds
3082	28	38	0	0	2	10	438.424	0.000402	Thiophenic compounds
3083	27	36	0	0	1	10	392.348	0.043729	Thiophenic compounds
3084	27	36	0	0	2	10	424.408	0.000315	Thiophenic compounds
3085	26	34	0	0	1	10	378.332	0.048665	Thiophenic compounds
3086	26	34	0	0	2	10	410.392	0.000419	Thiophenic compounds
3087	25	32	0	0	1	10	364.316	0.056386	Thiophenic compounds
3088	25	32	0	0	2	10	396.376	0.000459	Thiophenic compounds
3089	24	30	0	0	1	10	350.3	0.067817	Thiophenic compounds
3090	24	30	0	0	2	10	382.36	0.000606	Thiophenic compounds
3091	23	28	0	0	1	10	336.284	0.080139	Thiophenic compounds
3092	23	28	0	0	2	10	368.344	0.000808	Thiophenic compounds
3093	22	26	0	0	1	10	322.268	0.097761	Thiophenic compounds
3094	22	26	0	0	2	10	354.328	0.000703	Thiophenic compounds
3095	21	24	0	0	1	10	308.252	0.122806	Thiophenic compounds
3096	21	24	0	0	2	10	340.312	0.000511	Thiophenic compounds
3097	20	22	0	0	1	10	294.236	0.152991	Thiophenic compounds
3098	20	22	0	0	2	10	326.296	0.000315	Thiophenic compounds
3099	19	20	0	0	1	10	280.22	0.165583	Thiophenic compounds
3100	19	20	0	0	2	10	312.28	0.000255	Thiophenic compounds
3101	18	18	0	0	1	10	266.204	0.143178	Thiophenic compounds
3102	18	18	0	0	2	10	298.264	3.3e-05	Thiophenic compounds
3103	17	16	0	0	1	10	252.188	0.089857	Thiophenic compounds
3104	17	16	0	0	2	10	284.248	1e-05	Thiophenic compounds
3105	16	14	0	0	1	10	238.172	0.034175	Thiophenic compounds
3106	15	12	0	0	1	10	224.156	0.006409	Thiophenic compounds
3107	14	10	0	0	1	10	210.14	0.002045	Thiophenic compounds
3108	13	8	0	0	1	10	196.124	0.002847	Thiophenic compounds
3109	12	6	0	0	1	10	182.108	0.001378	Thiophenic compounds
3110	52	84	0	0	1	11	740.732	5.5e-05	Thiophenic compounds
3111	51	82	0	0	1	11	726.716	4.8e-05	Thiophenic compounds
3112	50	80	0	0	1	11	712.7	5.8e-05	Thiophenic compounds
3113	49	78	0	0	1	11	698.684	0.000309	Thiophenic compounds
3114	48	76	0	0	1	11	684.668	0.000389	Thiophenic compounds
3115	47	74	0	0	1	11	670.652	0.000498	Thiophenic compounds
3116	46	72	0	0	1	11	656.636	0.000614	Thiophenic compounds
3117	45	70	0	0	1	11	642.62	0.000965	Thiophenic compounds
3118	44	68	0	0	1	11	628.604	0.000927	Thiophenic compounds
3119	43	66	0	0	1	11	614.588	0.001476	Thiophenic compounds
3120	42	64	0	0	1	11	600.572	0.001746	Thiophenic compounds
3121	41	62	0	0	1	11	586.556	0.001743	Thiophenic compounds
3122	40	60	0	0	1	11	572.54	0.002228	Thiophenic compounds
3123	39	58	0	0	1	11	558.524	0.002763	Thiophenic compounds
3124	38	56	0	0	1	11	544.508	0.003402	Thiophenic compounds
3125	37	54	0	0	1	11	530.492	0.004688	Thiophenic compounds
3126	37	54	0	0	2	11	562.552	5.1e-05	Thiophenic compounds
3127	36	52	0	0	1	11	516.476	0.005758	Thiophenic compounds
3128	36	52	0	0	2	11	548.536	5.8e-05	Thiophenic compounds
3129	35	50	0	0	1	11	502.46	0.007448	Thiophenic compounds
3130	35	50	0	0	2	11	534.52	0.000127	Thiophenic compounds
3131	34	48	0	0	1	11	488.444	0.008203	Thiophenic compounds
3132	34	48	0	0	2	11	520.504	0.000432	Thiophenic compounds
3133	33	46	0	0	1	11	474.428	0.010573	Thiophenic compounds
3134	33	46	0	0	2	11	506.488	0.000551	Thiophenic compounds
3135	32	44	0	0	1	11	460.412	0.011364	Thiophenic compounds
3136	32	44	0	0	2	11	492.472	0.000794	Thiophenic compounds
3137	31	42	0	0	1	11	446.396	0.013849	Thiophenic compounds
3138	31	42	0	0	2	11	478.456	0.001319	Thiophenic compounds
3139	30	40	0	0	1	11	432.38	0.017943	Thiophenic compounds
3140	30	40	0	0	2	11	464.44	0.001709	Thiophenic compounds
3141	29	38	0	0	1	11	418.364	0.021247	Thiophenic compounds
3142	29	38	0	0	2	11	450.424	0.002226	Thiophenic compounds
3143	28	36	0	0	1	11	404.348	0.024959	Thiophenic compounds
3144	28	36	0	0	2	11	436.408	0.002197	Thiophenic compounds
3145	27	34	0	0	1	11	390.332	0.027674	Thiophenic compounds
3146	27	34	0	0	2	11	422.392	0.003027	Thiophenic compounds
3147	26	32	0	0	1	11	376.316	0.033375	Thiophenic compounds
3148	26	32	0	0	2	11	408.376	0.003554	Thiophenic compounds
3149	25	30	0	0	1	11	362.3	0.038765	Thiophenic compounds
3150	25	30	0	0	2	11	394.36	0.004686	Thiophenic compounds
3151	24	28	0	0	1	11	348.284	0.046224	Thiophenic compounds
3152	24	28	0	0	2	11	380.344	0.005677	Thiophenic compounds
3153	23	26	0	0	1	11	334.268	0.053102	Thiophenic compounds
3154	23	26	0	0	2	11	366.328	0.006855	Thiophenic compounds
3155	22	24	0	0	1	11	320.252	0.0563	Thiophenic compounds
3156	22	24	0	0	2	11	352.312	0.009789	Thiophenic compounds
3157	21	22	0	0	1	11	306.236	0.057703	Thiophenic compounds
3158	21	22	0	0	2	11	338.296	0.012629	Thiophenic compounds
3159	20	20	0	0	1	11	292.22	0.053702	Thiophenic compounds
3160	20	20	0	0	2	11	324.28	0.014643	Thiophenic compounds
3161	19	18	0	0	1	11	278.204	0.051928	Thiophenic compounds
3162	19	18	0	0	2	11	310.264	0.015718	Thiophenic compounds
3163	18	16	0	0	1	11	264.188	0.053395	Thiophenic compounds
3164	18	16	0	0	2	11	296.248	0.015861	Thiophenic compounds
3165	17	14	0	0	1	11	250.172	0.041286	Thiophenic compounds
3166	17	14	0	0	2	11	282.232	0.011087	Thiophenic compounds
3167	16	12	0	0	1	11	236.156	0.017501	Thiophenic compounds
3168	16	12	0	0	2	11	268.216	0.004011	Thiophenic compounds
3169	15	10	0	0	1	11	222.14	0.0033	Thiophenic compounds
3170	15	10	0	0	2	11	254.2	0.00077	Thiophenic compounds
3171	14	8	0	0	1	11	208.124	0.000172	Thiophenic compounds
3172	13	6	0	0	1	11	194.108	0.000103	Thiophenic compounds
3173	53	84	0	0	1	12	752.732	6.4e-05	Thiophenic compounds
3174	52	82	0	0	1	12	738.716	4.7e-05	Thiophenic compounds
3175	51	80	0	0	1	12	724.7	2.5e-05	Thiophenic compounds
3176	50	78	0	0	1	12	710.684	0.000157	Thiophenic compounds
3177	49	76	0	0	1	12	696.668	0.000127	Thiophenic compounds
3178	48	74	0	0	1	12	682.652	0.000293	Thiophenic compounds
3179	47	72	0	0	1	12	668.636	0.000434	Thiophenic compounds
3180	46	70	0	0	1	12	654.62	0.000506	Thiophenic compounds
3181	45	68	0	0	1	12	640.604	0.000753	Thiophenic compounds
3182	44	66	0	0	1	12	626.588	0.000898	Thiophenic compounds
3183	43	64	0	0	1	12	612.572	0.001252	Thiophenic compounds
3184	43	64	0	0	2	12	644.632	5.3e-05	Thiophenic compounds
3185	42	62	0	0	1	12	598.556	0.001869	Thiophenic compounds
3186	41	60	0	0	1	12	584.54	0.001772	Thiophenic compounds
3187	40	58	0	0	1	12	570.524	0.002237	Thiophenic compounds
3188	40	58	0	0	2	12	602.584	0.00014	Thiophenic compounds
3189	39	56	0	0	1	12	556.508	0.002519	Thiophenic compounds
3190	39	56	0	0	2	12	588.568	0.000107	Thiophenic compounds
3191	38	54	0	0	1	12	542.492	0.003428	Thiophenic compounds
3192	38	54	0	0	2	12	574.552	0.000529	Thiophenic compounds
3193	37	52	0	0	1	12	528.476	0.003909	Thiophenic compounds
3194	37	52	0	0	2	12	560.536	0.0006	Thiophenic compounds
3195	36	50	0	0	1	12	514.46	0.005365	Thiophenic compounds
3196	36	50	0	0	2	12	546.52	0.000853	Thiophenic compounds
3197	35	48	0	0	1	12	500.444	0.005217	Thiophenic compounds
3198	35	48	0	0	2	12	532.504	0.001061	Thiophenic compounds
3199	34	46	0	0	1	12	486.428	0.007032	Thiophenic compounds
3200	34	46	0	0	2	12	518.488	0.001261	Thiophenic compounds
3201	33	44	0	0	1	12	472.412	0.007193	Thiophenic compounds
3202	33	44	0	0	2	12	504.472	0.001692	Thiophenic compounds
3203	32	42	0	0	1	12	458.396	0.008856	Thiophenic compounds
3204	32	42	0	0	2	12	490.456	0.001651	Thiophenic compounds
3205	31	40	0	0	1	12	444.38	0.009747	Thiophenic compounds
3206	31	40	0	0	2	12	476.44	0.002028	Thiophenic compounds
3207	30	38	0	0	1	12	430.364	0.012486	Thiophenic compounds
3208	30	38	0	0	2	12	462.424	0.001977	Thiophenic compounds
3209	29	36	0	0	1	12	416.348	0.01548	Thiophenic compounds
3210	29	36	0	0	2	12	448.408	0.002934	Thiophenic compounds
3211	28	34	0	0	1	12	402.332	0.016438	Thiophenic compounds
3212	28	34	0	0	2	12	434.392	0.00335	Thiophenic compounds
3213	27	32	0	0	1	12	388.316	0.0194	Thiophenic compounds
3214	27	32	0	0	2	12	420.376	0.003061	Thiophenic compounds
3215	26	30	0	0	1	12	374.3	0.023331	Thiophenic compounds
3216	26	30	0	0	2	12	406.36	0.003232	Thiophenic compounds
3217	25	28	0	0	1	12	360.284	0.027086	Thiophenic compounds
3218	25	28	0	0	2	12	392.344	0.003595	Thiophenic compounds
3219	24	26	0	0	1	12	346.268	0.031023	Thiophenic compounds
3220	24	26	0	0	2	12	378.328	0.003676	Thiophenic compounds
3221	23	24	0	0	1	12	332.252	0.039976	Thiophenic compounds
3222	23	24	0	0	2	12	364.312	0.00325	Thiophenic compounds
3223	22	22	0	0	1	12	318.236	0.054826	Thiophenic compounds
3224	22	22	0	0	2	12	350.296	0.00289	Thiophenic compounds
3225	21	20	0	0	1	12	304.22	0.074851	Thiophenic compounds
3226	21	20	0	0	2	12	336.28	0.002234	Thiophenic compounds
3227	20	18	0	0	1	12	290.204	0.097412	Thiophenic compounds
3228	20	18	0	0	2	12	322.264	0.001423	Thiophenic compounds
3229	19	16	0	0	1	12	276.188	0.105227	Thiophenic compounds
3230	19	16	0	0	2	12	308.248	0.000724	Thiophenic compounds
3231	18	14	0	0	1	12	262.172	0.072932	Thiophenic compounds
3232	18	14	0	0	2	12	294.232	0.000326	Thiophenic compounds
3233	17	12	0	0	1	12	248.156	0.026169	Thiophenic compounds
3234	17	12	0	0	2	12	280.216	2.8e-05	Thiophenic compounds
3235	16	10	0	0	1	12	234.14	0.002956	Thiophenic compounds
3236	16	10	0	0	2	12	266.2	1.4e-05	Thiophenic compounds
3237	15	8	0	0	1	12	220.124	5.9e-05	Thiophenic compounds
3238	15	8	0	0	2	12	252.184	2.1e-05	Thiophenic compounds
3239	14	6	0	0	1	12	206.108	8.7e-05	Thiophenic compounds
3240	53	82	0	0	1	13	750.716	6.5e-05	Thiophenic compounds
3241	52	80	0	0	1	13	736.7	5.2e-05	Thiophenic compounds
3242	51	78	0	0	1	13	722.684	0.000173	Thiophenic compounds
3243	50	76	0	0	1	13	708.668	0.00016	Thiophenic compounds
3244	49	74	0	0	1	13	694.652	0.000405	Thiophenic compounds
3245	48	72	0	0	1	13	680.636	0.000313	Thiophenic compounds
3246	47	70	0	0	1	13	666.62	0.000135	Thiophenic compounds
3247	46	68	0	0	1	13	652.604	0.000362	Thiophenic compounds
3248	45	66	0	0	1	13	638.588	0.000766	Thiophenic compounds
3249	44	64	0	0	1	13	624.572	0.000945	Thiophenic compounds
3250	43	62	0	0	1	13	610.556	0.001348	Thiophenic compounds
3251	42	60	0	0	1	13	596.54	0.000948	Thiophenic compounds
3252	41	58	0	0	1	13	582.524	0.001797	Thiophenic compounds
3253	41	58	0	0	2	13	614.584	7.6e-05	Thiophenic compounds
3254	40	56	0	0	1	13	568.508	0.002251	Thiophenic compounds
3255	39	54	0	0	1	13	554.492	0.002422	Thiophenic compounds
3256	39	54	0	0	2	13	586.552	0.000181	Thiophenic compounds
3257	38	52	0	0	1	13	540.476	0.002934	Thiophenic compounds
3258	38	52	0	0	2	13	572.536	7.7e-05	Thiophenic compounds
3259	37	50	0	0	1	13	526.46	0.003294	Thiophenic compounds
3260	37	50	0	0	2	13	558.52	0.000285	Thiophenic compounds
3261	36	48	0	0	1	13	512.444	0.003441	Thiophenic compounds
3262	36	48	0	0	2	13	544.504	0.000314	Thiophenic compounds
3263	35	46	0	0	1	13	498.428	0.004534	Thiophenic compounds
3264	35	46	0	0	2	13	530.488	0.000615	Thiophenic compounds
3265	34	44	0	0	1	13	484.412	0.00511	Thiophenic compounds
3266	34	44	0	0	2	13	516.472	0.000743	Thiophenic compounds
3267	33	42	0	0	1	13	470.396	0.00598	Thiophenic compounds
3268	33	42	0	0	2	13	502.456	0.000782	Thiophenic compounds
3269	32	40	0	0	1	13	456.38	0.006471	Thiophenic compounds
3270	32	40	0	0	2	13	488.44	0.001169	Thiophenic compounds
3271	31	38	0	0	1	13	442.364	0.007574	Thiophenic compounds
3272	31	38	0	0	2	13	474.424	0.001081	Thiophenic compounds
3273	30	36	0	0	1	13	428.348	0.009225	Thiophenic compounds
3274	30	36	0	0	2	13	460.408	0.001193	Thiophenic compounds
3275	29	34	0	0	1	13	414.332	0.010522	Thiophenic compounds
3276	29	34	0	0	2	13	446.392	0.001279	Thiophenic compounds
3277	28	32	0	0	1	13	400.316	0.012118	Thiophenic compounds
3278	28	32	0	0	2	13	432.376	0.001413	Thiophenic compounds
3279	27	30	0	0	1	13	386.3	0.013498	Thiophenic compounds
3280	27	30	0	0	2	13	418.36	0.001506	Thiophenic compounds
3281	26	28	0	0	1	13	372.284	0.016073	Thiophenic compounds
3282	26	28	0	0	2	13	404.344	0.001291	Thiophenic compounds
3283	25	26	0	0	1	13	358.268	0.019042	Thiophenic compounds
3284	25	26	0	0	2	13	390.328	0.001278	Thiophenic compounds
3285	24	24	0	0	1	13	344.252	0.022004	Thiophenic compounds
3286	24	24	0	0	2	13	376.312	0.000967	Thiophenic compounds
3287	23	22	0	0	1	13	330.236	0.022824	Thiophenic compounds
3288	23	22	0	0	2	13	362.296	0.001	Thiophenic compounds
3289	22	20	0	0	1	13	316.22	0.020157	Thiophenic compounds
3290	22	20	0	0	2	13	348.28	0.000913	Thiophenic compounds
3291	21	18	0	0	1	13	302.204	0.012953	Thiophenic compounds
3292	21	18	0	0	2	13	334.264	0.000726	Thiophenic compounds
3293	20	16	0	0	1	13	288.188	0.006073	Thiophenic compounds
3294	20	16	0	0	2	13	320.248	0.000826	Thiophenic compounds
3295	19	14	0	0	1	13	274.172	0.001437	Thiophenic compounds
3296	19	14	0	0	2	13	306.232	0.000659	Thiophenic compounds
3297	18	12	0	0	1	13	260.156	0.000251	Thiophenic compounds
3298	18	12	0	0	2	13	292.216	0.000383	Thiophenic compounds
3299	17	10	0	0	1	13	246.14	7.4e-05	Thiophenic compounds
3300	17	10	0	0	2	13	278.2	5.6e-05	Thiophenic compounds
3301	16	8	0	0	1	13	232.124	5.4e-05	Thiophenic compounds
3302	55	84	0	0	1	14	776.732	0.000146	Thiophenic compounds
3303	54	82	0	0	1	14	762.716	7.6e-05	Thiophenic compounds
3304	52	78	0	0	1	14	734.684	0.000325	Thiophenic compounds
3305	50	74	0	0	1	14	706.652	0.000219	Thiophenic compounds
3306	49	72	0	0	1	14	692.636	0.000191	Thiophenic compounds
3307	48	70	0	0	1	14	678.62	0.000523	Thiophenic compounds
3308	47	68	0	0	1	14	664.604	0.00089	Thiophenic compounds
3309	46	66	0	0	1	14	650.588	0.000696	Thiophenic compounds
3310	45	64	0	0	1	14	636.572	0.000873	Thiophenic compounds
3311	45	64	0	0	2	14	668.632	4.7e-05	Thiophenic compounds
3312	44	62	0	0	1	14	622.556	0.001104	Thiophenic compounds
3313	43	60	0	0	1	14	608.54	0.001175	Thiophenic compounds
3314	43	60	0	0	2	14	640.6	2.3e-05	Thiophenic compounds
3315	42	58	0	0	1	14	594.524	0.001576	Thiophenic compounds
3316	42	58	0	0	2	14	626.584	2e-05	Thiophenic compounds
3317	41	56	0	0	1	14	580.508	0.001855	Thiophenic compounds
3318	40	54	0	0	1	14	566.492	0.00211	Thiophenic compounds
3319	39	52	0	0	1	14	552.476	0.002335	Thiophenic compounds
3320	39	52	0	0	2	14	584.536	6.8e-05	Thiophenic compounds
3321	38	50	0	0	1	14	538.46	0.003051	Thiophenic compounds
3322	38	50	0	0	2	14	570.52	4.2e-05	Thiophenic compounds
3323	37	48	0	0	1	14	524.444	0.002951	Thiophenic compounds
3324	37	48	0	0	2	14	556.504	1.7e-05	Thiophenic compounds
3325	36	46	0	0	1	14	510.428	0.003738	Thiophenic compounds
3326	36	46	0	0	2	14	542.488	0.000232	Thiophenic compounds
3327	35	44	0	0	1	14	496.412	0.004011	Thiophenic compounds
3328	35	44	0	0	2	14	528.472	0.000158	Thiophenic compounds
3329	34	42	0	0	1	14	482.396	0.004301	Thiophenic compounds
3330	34	42	0	0	2	14	514.456	0.000552	Thiophenic compounds
3331	33	40	0	0	1	14	468.38	0.005001	Thiophenic compounds
3332	33	40	0	0	2	14	500.44	0.00045	Thiophenic compounds
3333	32	38	0	0	1	14	454.364	0.005048	Thiophenic compounds
3334	32	38	0	0	2	14	486.424	0.000484	Thiophenic compounds
3335	31	36	0	0	1	14	440.348	0.00577	Thiophenic compounds
3336	31	36	0	0	2	14	472.408	0.000749	Thiophenic compounds
3337	30	34	0	0	1	14	426.332	0.006289	Thiophenic compounds
3338	30	34	0	0	2	14	458.392	0.000775	Thiophenic compounds
3339	29	32	0	0	1	14	412.316	0.007169	Thiophenic compounds
3340	29	32	0	0	2	14	444.376	0.000866	Thiophenic compounds
3341	28	30	0	0	1	14	398.3	0.007573	Thiophenic compounds
3342	28	30	0	0	2	14	430.36	0.001131	Thiophenic compounds
3343	27	28	0	0	1	14	384.284	0.008606	Thiophenic compounds
3344	27	28	0	0	2	14	416.344	0.001411	Thiophenic compounds
3345	26	26	0	0	1	14	370.268	0.00999	Thiophenic compounds
3346	26	26	0	0	2	14	402.328	0.001439	Thiophenic compounds
3347	25	24	0	0	1	14	356.252	0.01071	Thiophenic compounds
3348	25	24	0	0	2	14	388.312	0.001555	Thiophenic compounds
3349	24	22	0	0	1	14	342.236	0.011026	Thiophenic compounds
3350	24	22	0	0	2	14	374.296	0.001675	Thiophenic compounds
3351	23	20	0	0	1	14	328.22	0.009751	Thiophenic compounds
3352	23	20	0	0	2	14	360.28	0.001878	Thiophenic compounds
3353	22	18	0	0	1	14	314.204	0.009088	Thiophenic compounds
3354	22	18	0	0	2	14	346.264	0.002206	Thiophenic compounds
3355	21	16	0	0	1	14	300.188	0.007984	Thiophenic compounds
3356	21	16	0	0	2	14	332.248	0.001792	Thiophenic compounds
3357	20	14	0	0	1	14	286.172	0.004973	Thiophenic compounds
3358	20	14	0	0	2	14	318.232	0.001068	Thiophenic compounds
3359	19	12	0	0	1	14	272.156	0.001935	Thiophenic compounds
3360	19	12	0	0	2	14	304.216	0.000261	Thiophenic compounds
3361	18	10	0	0	1	14	258.14	0.000362	Thiophenic compounds
3362	55	82	0	0	1	15	774.716	5.6e-05	Thiophenic compounds
3363	54	80	0	0	1	15	760.7	4e-05	Thiophenic compounds
3364	53	78	0	0	1	15	746.684	0.000141	Thiophenic compounds
3365	52	76	0	0	1	15	732.668	0.00013	Thiophenic compounds
3366	51	74	0	0	1	15	718.652	0.000189	Thiophenic compounds
3367	50	72	0	0	1	15	704.636	0.000269	Thiophenic compounds
3368	49	70	0	0	1	15	690.62	0.000776	Thiophenic compounds
3369	48	68	0	0	1	15	676.604	0.000759	Thiophenic compounds
3370	47	66	0	0	1	15	662.588	0.00072	Thiophenic compounds
3371	46	64	0	0	1	15	648.572	0.001133	Thiophenic compounds
3372	46	64	0	0	2	15	680.632	9.1e-05	Thiophenic compounds
3373	45	62	0	0	1	15	634.556	0.000965	Thiophenic compounds
3374	44	60	0	0	1	15	620.54	0.001183	Thiophenic compounds
3375	43	58	0	0	1	15	606.524	0.001645	Thiophenic compounds
3376	43	58	0	0	2	15	638.584	0.000168	Thiophenic compounds
3377	42	56	0	0	1	15	592.508	0.001942	Thiophenic compounds
3378	42	56	0	0	2	15	624.568	0.000103	Thiophenic compounds
3379	41	54	0	0	1	15	578.492	0.002253	Thiophenic compounds
3380	41	54	0	0	2	15	610.552	1.9e-05	Thiophenic compounds
3381	40	52	0	0	1	15	564.476	0.002532	Thiophenic compounds
3382	40	52	0	0	2	15	596.536	0.000272	Thiophenic compounds
3383	39	50	0	0	1	15	550.46	0.002659	Thiophenic compounds
3384	39	50	0	0	2	15	582.52	0.000135	Thiophenic compounds
3385	38	48	0	0	1	15	536.444	0.003123	Thiophenic compounds
3386	38	48	0	0	2	15	568.504	0.000247	Thiophenic compounds
3387	37	46	0	0	1	15	522.428	0.003226	Thiophenic compounds
3388	37	46	0	0	2	15	554.488	0.000336	Thiophenic compounds
3389	36	44	0	0	1	15	508.412	0.002454	Thiophenic compounds
3390	36	44	0	0	2	15	540.472	0.000442	Thiophenic compounds
3391	35	42	0	0	1	15	494.396	0.002966	Thiophenic compounds
3392	35	42	0	0	2	15	526.456	0.000492	Thiophenic compounds
3393	34	40	0	0	1	15	480.38	0.00282	Thiophenic compounds
3394	34	40	0	0	2	15	512.44	0.000874	Thiophenic compounds
3395	33	38	0	0	1	15	466.364	0.002813	Thiophenic compounds
3396	33	38	0	0	2	15	498.424	0.001102	Thiophenic compounds
3397	32	36	0	0	1	15	452.348	0.003177	Thiophenic compounds
3398	32	36	0	0	2	15	484.408	0.00116	Thiophenic compounds
3399	31	34	0	0	1	15	438.332	0.00352	Thiophenic compounds
3400	31	34	0	0	2	15	470.392	0.001061	Thiophenic compounds
3401	30	32	0	0	1	15	424.316	0.003254	Thiophenic compounds
3402	30	32	0	0	2	15	456.376	0.001108	Thiophenic compounds
3403	29	30	0	0	1	15	410.3	0.003207	Thiophenic compounds
3404	29	30	0	0	2	15	442.36	0.001333	Thiophenic compounds
3405	28	28	0	0	1	15	396.284	0.003774	Thiophenic compounds
3406	28	28	0	0	2	15	428.344	0.001145	Thiophenic compounds
3407	27	26	0	0	1	15	382.268	0.004107	Thiophenic compounds
3408	27	26	0	0	2	15	414.328	0.001335	Thiophenic compounds
3409	26	24	0	0	1	15	368.252	0.003809	Thiophenic compounds
3410	26	24	0	0	2	15	400.312	0.001218	Thiophenic compounds
3411	25	22	0	0	1	15	354.236	0.003217	Thiophenic compounds
3412	25	22	0	0	2	15	386.296	0.000611	Thiophenic compounds
3413	24	20	0	0	1	15	340.22	0.0026	Thiophenic compounds
3414	24	20	0	0	2	15	372.28	0.000326	Thiophenic compounds
3415	23	18	0	0	1	15	326.204	0.002192	Thiophenic compounds
3416	23	18	0	0	2	15	358.264	0.000227	Thiophenic compounds
3417	22	16	0	0	1	15	312.188	0.001125	Thiophenic compounds
3418	22	16	0	0	2	15	344.248	3.5e-05	Thiophenic compounds
3419	21	14	0	0	1	15	298.172	0.000312	Thiophenic compounds
3420	54	78	0	0	1	16	758.684	4.9e-05	Thiophenic compounds
3421	52	74	0	0	1	16	730.652	0.000234	Thiophenic compounds
3422	51	72	0	0	1	16	716.636	0.000361	Thiophenic compounds
3423	49	68	0	0	1	16	688.604	0.000699	Thiophenic compounds
3424	48	66	0	0	1	16	674.588	0.000719	Thiophenic compounds
3425	47	64	0	0	1	16	660.572	0.000771	Thiophenic compounds
3426	46	62	0	0	1	16	646.556	0.000709	Thiophenic compounds
3427	45	60	0	0	1	16	632.54	0.001327	Thiophenic compounds
3428	45	60	0	0	2	16	664.6	6.3e-05	Thiophenic compounds
3429	44	58	0	0	1	16	618.524	0.001042	Thiophenic compounds
3430	43	56	0	0	1	16	604.508	0.001395	Thiophenic compounds
3431	42	54	0	0	1	16	590.492	0.001348	Thiophenic compounds
3432	42	54	0	0	2	16	622.552	0.000119	Thiophenic compounds
3433	41	52	0	0	1	16	576.476	0.001635	Thiophenic compounds
3434	41	52	0	0	2	16	608.536	4e-05	Thiophenic compounds
3435	40	50	0	0	1	16	562.46	0.001393	Thiophenic compounds
3436	40	50	0	0	2	16	594.52	0.000114	Thiophenic compounds
3437	39	48	0	0	1	16	548.444	0.001805	Thiophenic compounds
3438	39	48	0	0	2	16	580.504	0.000174	Thiophenic compounds
3439	38	46	0	0	1	16	534.428	0.001552	Thiophenic compounds
3440	38	46	0	0	2	16	566.488	0.000283	Thiophenic compounds
3441	37	44	0	0	1	16	520.412	0.001889	Thiophenic compounds
3442	37	44	0	0	2	16	552.472	0.000262	Thiophenic compounds
3443	36	42	0	0	1	16	506.396	0.001539	Thiophenic compounds
3444	36	42	0	0	2	16	538.456	0.000312	Thiophenic compounds
3445	35	40	0	0	1	16	492.38	0.001555	Thiophenic compounds
3446	35	40	0	0	2	16	524.44	0.000439	Thiophenic compounds
3447	34	38	0	0	1	16	478.364	0.001985	Thiophenic compounds
3448	34	38	0	0	2	16	510.424	0.00047	Thiophenic compounds
3449	33	36	0	0	1	16	464.348	0.001839	Thiophenic compounds
3450	33	36	0	0	2	16	496.408	0.00038	Thiophenic compounds
3451	32	34	0	0	1	16	450.332	0.001941	Thiophenic compounds
3452	32	34	0	0	2	16	482.392	0.00068	Thiophenic compounds
3453	31	32	0	0	1	16	436.316	0.001641	Thiophenic compounds
3454	31	32	0	0	2	16	468.376	0.000629	Thiophenic compounds
3455	30	30	0	0	1	16	422.3	0.001985	Thiophenic compounds
3456	30	30	0	0	2	16	454.36	0.00025	Thiophenic compounds
3457	29	28	0	0	1	16	408.284	0.001744	Thiophenic compounds
3458	29	28	0	0	2	16	440.344	0.000166	Thiophenic compounds
3459	28	26	0	0	1	16	394.268	0.001544	Thiophenic compounds
3460	28	26	0	0	2	16	426.328	0.00022	Thiophenic compounds
3461	27	24	0	0	1	16	380.252	0.001288	Thiophenic compounds
3462	27	24	0	0	2	16	412.312	0.000175	Thiophenic compounds
3463	26	22	0	0	1	16	366.236	0.000949	Thiophenic compounds
3464	26	22	0	0	2	16	398.296	1.4e-05	Thiophenic compounds
3465	25	20	0	0	1	16	352.22	0.000565	Thiophenic compounds
3466	25	20	0	0	2	16	384.28	4.4e-05	Thiophenic compounds
3467	24	18	0	0	1	16	338.204	0.000276	Thiophenic compounds
3468	24	18	0	0	2	16	370.264	0.000124	Thiophenic compounds
3469	23	16	0	0	1	16	324.188	4.7e-05	Thiophenic compounds
3470	22	14	0	0	2	16	342.232	1.3e-05	Thiophenic compounds
3471	20	10	0	0	1	16	282.14	1.8e-05	Thiophenic compounds
3472	56	80	0	0	1	17	784.7	9.5e-05	Thiophenic compounds
3473	55	78	0	0	1	17	770.684	4.8e-05	Thiophenic compounds
3474	54	76	0	0	1	17	756.668	0.000159	Thiophenic compounds
3475	53	74	0	0	1	17	742.652	0.000152	Thiophenic compounds
3476	52	72	0	0	1	17	728.636	0.000168	Thiophenic compounds
3477	51	70	0	0	1	17	714.62	0.000166	Thiophenic compounds
3478	50	68	0	0	1	17	700.604	0.000575	Thiophenic compounds
3479	49	66	0	0	1	17	686.588	0.000488	Thiophenic compounds
3480	48	64	0	0	1	17	672.572	0.000467	Thiophenic compounds
3481	47	62	0	0	1	17	658.556	0.000582	Thiophenic compounds
3482	46	60	0	0	1	17	644.54	0.000773	Thiophenic compounds
3483	45	58	0	0	1	17	630.524	0.00076	Thiophenic compounds
3484	45	58	0	0	2	17	662.584	2.5e-05	Thiophenic compounds
3485	44	56	0	0	1	17	616.508	0.000787	Thiophenic compounds
3486	44	56	0	0	2	17	648.568	8.4e-05	Thiophenic compounds
3487	43	54	0	0	1	17	602.492	0.001026	Thiophenic compounds
3488	42	52	0	0	1	17	588.476	0.000955	Thiophenic compounds
3489	42	52	0	0	2	17	620.536	0.000138	Thiophenic compounds
3490	41	50	0	0	1	17	574.46	0.001131	Thiophenic compounds
3491	41	50	0	0	2	17	606.52	3.6e-05	Thiophenic compounds
3492	40	48	0	0	1	17	560.444	0.000857	Thiophenic compounds
3493	40	48	0	0	2	17	592.504	0.000121	Thiophenic compounds
3494	39	46	0	0	1	17	546.428	0.000924	Thiophenic compounds
3495	38	44	0	0	1	17	532.412	0.001315	Thiophenic compounds
3496	38	44	0	0	2	17	564.472	9.6e-05	Thiophenic compounds
3497	37	42	0	0	1	17	518.396	0.00108	Thiophenic compounds
3498	37	42	0	0	2	17	550.456	0.000125	Thiophenic compounds
3499	36	40	0	0	1	17	504.38	0.001083	Thiophenic compounds
3500	36	40	0	0	2	17	536.44	0.000259	Thiophenic compounds
3501	35	38	0	0	1	17	490.364	0.000956	Thiophenic compounds
3502	35	38	0	0	2	17	522.424	0.000135	Thiophenic compounds
3503	34	36	0	0	1	17	476.348	0.000945	Thiophenic compounds
3504	34	36	0	0	2	17	508.408	3.7e-05	Thiophenic compounds
3505	33	34	0	0	1	17	462.332	0.001491	Thiophenic compounds
3506	33	34	0	0	2	17	494.392	0.000171	Thiophenic compounds
3507	32	32	0	0	1	17	448.316	0.000867	Thiophenic compounds
3508	32	32	0	0	2	17	480.376	0.000354	Thiophenic compounds
3509	31	30	0	0	1	17	434.3	0.000521	Thiophenic compounds
3510	31	30	0	0	2	17	466.36	2.3e-05	Thiophenic compounds
3511	30	28	0	0	1	17	420.284	0.000317	Thiophenic compounds
3512	30	28	0	0	2	17	452.344	6.3e-05	Thiophenic compounds
3513	29	26	0	0	1	17	406.268	0.000573	Thiophenic compounds
3514	28	24	0	0	1	17	392.252	0.000263	Thiophenic compounds
3515	27	22	0	0	1	17	378.236	0.000185	Thiophenic compounds
3516	27	22	0	0	2	17	410.296	1.5e-05	Thiophenic compounds
3517	26	20	0	0	1	17	364.22	0.000155	Thiophenic compounds
3518	25	18	0	0	1	17	350.204	5.8e-05	Thiophenic compounds
3519	24	16	0	0	1	17	336.188	4.6e-05	Thiophenic compounds
3520	23	14	0	0	1	17	322.172	4.2e-05	Thiophenic compounds
3521	21	10	0	0	1	17	294.14	2.3e-05	Thiophenic compounds
3522	56	78	0	0	1	18	782.684	7e-05	Thiophenic compounds
3523	54	74	0	0	1	18	754.652	0.000136	Thiophenic compounds
3524	53	72	0	0	1	18	740.636	6.8e-05	Thiophenic compounds
3525	52	70	0	0	1	18	726.62	0.000228	Thiophenic compounds
3526	51	68	0	0	1	18	712.604	2.3e-05	Thiophenic compounds
3527	50	66	0	0	1	18	698.588	0.000207	Thiophenic compounds
3528	49	64	0	0	1	18	684.572	0.000489	Thiophenic compounds
3529	48	62	0	0	1	18	670.556	0.000624	Thiophenic compounds
3530	47	60	0	0	1	18	656.54	0.000257	Thiophenic compounds
3531	46	58	0	0	1	18	642.524	0.000404	Thiophenic compounds
3532	45	56	0	0	1	18	628.508	0.000444	Thiophenic compounds
3533	44	54	0	0	1	18	614.492	0.001057	Thiophenic compounds
3534	43	52	0	0	1	18	600.476	0.000602	Thiophenic compounds
3535	42	50	0	0	1	18	586.46	0.00071	Thiophenic compounds
3536	41	48	0	0	1	18	572.444	0.000762	Thiophenic compounds
3537	41	48	0	0	2	18	604.504	0.000188	Thiophenic compounds
3538	40	46	0	0	1	18	558.428	0.000712	Thiophenic compounds
3539	40	46	0	0	2	18	590.488	1.8e-05	Thiophenic compounds
3540	39	44	0	0	1	18	544.412	0.000804	Thiophenic compounds
3541	38	42	0	0	1	18	530.396	0.000871	Thiophenic compounds
3542	38	42	0	0	2	18	562.456	6.3e-05	Thiophenic compounds
3543	37	40	0	0	1	18	516.38	0.000742	Thiophenic compounds
3544	37	40	0	0	2	18	548.44	9.5e-05	Thiophenic compounds
3545	36	38	0	0	1	18	502.364	0.000591	Thiophenic compounds
3546	36	38	0	0	2	18	534.424	0.000157	Thiophenic compounds
3547	35	36	0	0	1	18	488.348	0.000306	Thiophenic compounds
3548	35	36	0	0	2	18	520.408	9.6e-05	Thiophenic compounds
3549	34	34	0	0	1	18	474.332	0.000423	Thiophenic compounds
3550	34	34	0	0	2	18	506.392	5.2e-05	Thiophenic compounds
3551	33	32	0	0	1	18	460.316	0.00023	Thiophenic compounds
3552	33	32	0	0	2	18	492.376	7.5e-05	Thiophenic compounds
3553	32	30	0	0	1	18	446.3	0.000148	Thiophenic compounds
3554	32	30	0	0	2	18	478.36	0.000126	Thiophenic compounds
3555	31	28	0	0	1	18	432.284	8.8e-05	Thiophenic compounds
3556	31	28	0	0	2	18	464.344	4.8e-05	Thiophenic compounds
3557	30	26	0	0	1	18	418.268	6.7e-05	Thiophenic compounds
3558	30	26	0	0	2	18	450.328	3.5e-05	Thiophenic compounds
3559	28	22	0	0	1	18	390.236	1.4e-05	Thiophenic compounds
3560	28	22	0	0	2	18	422.296	1.4e-05	Thiophenic compounds
3561	23	12	0	0	1	18	320.156	1.3e-05	Thiophenic compounds
3562	56	76	0	0	1	19	780.668	9.6e-05	Thiophenic compounds
3563	54	72	0	0	1	19	752.636	7.7e-05	Thiophenic compounds
3564	52	68	0	0	1	19	724.604	0.000318	Thiophenic compounds
3565	51	66	0	0	1	19	710.588	2.2e-05	Thiophenic compounds
3566	50	64	0	0	1	19	696.572	0.000238	Thiophenic compounds
3567	49	62	0	0	1	19	682.556	0.000374	Thiophenic compounds
3568	48	60	0	0	1	19	668.54	8.2e-05	Thiophenic compounds
3569	47	58	0	0	1	19	654.524	0.000303	Thiophenic compounds
3570	46	56	0	0	1	19	640.508	0.000302	Thiophenic compounds
3571	45	54	0	0	1	19	626.492	0.000665	Thiophenic compounds
3572	44	52	0	0	1	19	612.476	0.00071	Thiophenic compounds
3573	43	50	0	0	1	19	598.46	0.000623	Thiophenic compounds
3574	42	48	0	0	1	19	584.444	0.000702	Thiophenic compounds
3575	42	48	0	0	2	19	616.504	3.6e-05	Thiophenic compounds
3576	41	46	0	0	1	19	570.428	0.000537	Thiophenic compounds
3577	40	44	0	0	1	19	556.412	0.000733	Thiophenic compounds
3578	40	44	0	0	2	19	588.472	0.000111	Thiophenic compounds
3579	39	42	0	0	1	19	542.396	0.000705	Thiophenic compounds
3580	39	42	0	0	2	19	574.456	0.000108	Thiophenic compounds
3581	38	40	0	0	1	19	528.38	0.000226	Thiophenic compounds
3582	38	40	0	0	2	19	560.44	6.2e-05	Thiophenic compounds
3583	37	38	0	0	1	19	514.364	0.000184	Thiophenic compounds
3584	37	38	0	0	2	19	546.424	1.7e-05	Thiophenic compounds
3585	36	36	0	0	1	19	500.348	0.000225	Thiophenic compounds
3586	36	36	0	0	2	19	532.408	3.1e-05	Thiophenic compounds
3587	35	34	0	0	1	19	486.332	9.9e-05	Thiophenic compounds
3588	34	32	0	0	1	19	472.316	8.7e-05	Thiophenic compounds
3589	34	32	0	0	2	19	504.376	2.7e-05	Thiophenic compounds
3590	56	74	0	0	1	20	778.652	2.4e-05	Thiophenic compounds
3591	55	72	0	0	1	20	764.636	2.3e-05	Thiophenic compounds
3592	53	68	0	0	1	20	736.604	0.000164	Thiophenic compounds
3593	52	66	0	0	1	20	722.588	0.000104	Thiophenic compounds
3594	51	64	0	0	1	20	708.572	0.000136	Thiophenic compounds
3595	50	62	0	0	1	20	694.556	0.000221	Thiophenic compounds
3596	49	60	0	0	1	20	680.54	9.1e-05	Thiophenic compounds
3597	48	58	0	0	1	20	666.524	0.000372	Thiophenic compounds
3598	47	56	0	0	1	20	652.508	0.000156	Thiophenic compounds
3599	45	52	0	0	1	20	624.476	0.000481	Thiophenic compounds
3600	44	50	0	0	1	20	610.46	0.000217	Thiophenic compounds
3601	43	48	0	0	1	20	596.444	0.000309	Thiophenic compounds
3602	42	46	0	0	1	20	582.428	0.000161	Thiophenic compounds
3603	42	46	0	0	2	20	614.488	2e-05	Thiophenic compounds
3604	41	44	0	0	1	20	568.412	0.000216	Thiophenic compounds
3605	41	44	0	0	2	20	600.472	2.1e-05	Thiophenic compounds
3606	40	42	0	0	1	20	554.396	7.1e-05	Thiophenic compounds
3607	39	40	0	0	1	20	540.38	0.000319	Thiophenic compounds
3608	38	38	0	0	2	20	558.424	1.9e-05	Thiophenic compounds
3609	37	36	0	0	1	20	512.348	1.7e-05	Thiophenic compounds
3610	37	36	0	0	2	20	544.408	1.7e-05	Thiophenic compounds
3611	35	32	0	0	2	20	516.376	1.6e-05	Thiophenic compounds
3612	30	22	0	0	2	20	446.296	1.5e-05	Thiophenic compounds
3613	55	70	0	0	1	21	762.62	7.3e-05	Thiophenic compounds
3614	54	68	0	0	1	21	748.604	2.6e-05	Thiophenic compounds
3615	53	66	0	0	1	21	734.588	2.3e-05	Thiophenic compounds
3616	52	64	0	0	1	21	720.572	0.000123	Thiophenic compounds
3617	51	62	0	0	1	21	706.556	9.4e-05	Thiophenic compounds
3618	49	58	0	0	1	21	678.524	2.7e-05	Thiophenic compounds
3619	48	56	0	0	1	21	664.508	0.000111	Thiophenic compounds
3620	47	54	0	0	1	21	650.492	0.000117	Thiophenic compounds
3621	46	52	0	0	1	21	636.476	3.5e-05	Thiophenic compounds
3622	44	48	0	0	1	21	608.444	2.2e-05	Thiophenic compounds
3623	43	46	0	0	1	21	594.428	4.4e-05	Thiophenic compounds
3624	42	44	0	0	1	21	580.412	6.5e-05	Thiophenic compounds
3625	42	44	0	0	2	21	612.472	4.1e-05	Thiophenic compounds
3626	41	42	0	0	1	21	566.396	2.3e-05	Thiophenic compounds
3627	40	40	0	0	1	21	552.38	4e-05	Thiophenic compounds
3628	39	38	0	0	1	21	538.364	1.6e-05	Thiophenic compounds
3629	38	36	0	0	1	21	524.348	1.8e-05	Thiophenic compounds
3630	54	66	0	0	1	22	746.588	7.3e-05	Thiophenic compounds
3631	52	62	0	0	1	22	718.556	5.2e-05	Thiophenic compounds
3632	51	60	0	0	1	22	704.54	4.9e-05	Thiophenic compounds
3633	50	58	0	0	1	22	690.524	5.9e-05	Thiophenic compounds
3634	48	54	0	0	1	22	662.492	2.7e-05	Thiophenic compounds
3635	47	52	0	0	1	22	648.476	9.4e-05	Thiophenic compounds
3636	46	50	0	0	1	22	634.46	1.9e-05	Thiophenic compounds
3637	44	46	0	0	1	22	606.428	2.5e-05	Thiophenic compounds
3638	42	42	0	0	1	22	578.396	3.5e-05	Thiophenic compounds
3639	56	68	0	0	1	23	772.604	5.2e-05	Thiophenic compounds
3640	54	64	0	0	1	23	744.572	6.8e-05	Thiophenic compounds
3641	50	56	0	0	1	23	688.508	2.4e-05	Thiophenic compounds
3642	48	96	0	0	1	1	704.828	1e-05	Sulfidic compounds
3643	47	94	0	0	1	1	690.812	9e-06	Sulfidic compounds
3644	46	92	0	0	1	1	676.796	1.7e-05	Sulfidic compounds
3645	44	88	0	0	1	1	648.764	7.6e-05	Sulfidic compounds
3646	43	86	0	0	1	1	634.748	0.000163	Sulfidic compounds
3647	42	84	0	0	1	1	620.732	0.000225	Sulfidic compounds
3648	41	82	0	0	1	1	606.716	0.000354	Sulfidic compounds
3649	40	80	0	0	1	1	592.7	0.000515	Sulfidic compounds
3650	39	78	0	0	1	1	578.684	0.000646	Sulfidic compounds
3651	38	76	0	0	1	1	564.668	0.000883	Sulfidic compounds
3652	37	74	0	0	1	1	550.652	0.001311	Sulfidic compounds
3653	36	72	0	0	1	1	536.636	0.00155	Sulfidic compounds
3654	35	70	0	0	1	1	522.62	0.00233	Sulfidic compounds
3655	34	68	0	0	1	1	508.604	0.003561	Sulfidic compounds
3656	33	66	0	0	1	1	494.588	0.00483	Sulfidic compounds
3657	32	64	0	0	1	1	480.572	0.007543	Sulfidic compounds
3658	31	62	0	0	1	1	466.556	0.010431	Sulfidic compounds
3659	30	60	0	0	1	1	452.54	0.013804	Sulfidic compounds
3660	29	58	0	0	1	1	438.524	0.017184	Sulfidic compounds
3661	28	56	0	0	1	1	424.508	0.0221	Sulfidic compounds
3662	27	54	0	0	1	1	410.492	0.027108	Sulfidic compounds
3663	26	52	0	0	1	1	396.476	0.035172	Sulfidic compounds
3664	25	50	0	0	1	1	382.46	0.041904	Sulfidic compounds
3665	24	48	0	0	1	1	368.444	0.05114	Sulfidic compounds
3666	23	46	0	0	1	1	354.428	0.057721	Sulfidic compounds
3667	22	44	0	0	1	1	340.412	0.065095	Sulfidic compounds
3668	21	42	0	0	1	1	326.396	0.074607	Sulfidic compounds
3669	20	40	0	0	1	1	312.38	0.080175	Sulfidic compounds
3670	19	38	0	0	1	1	298.364	0.081671	Sulfidic compounds
3671	18	36	0	0	1	1	284.348	0.079812	Sulfidic compounds
3672	17	34	0	0	1	1	270.332	0.067753	Sulfidic compounds
3673	16	32	0	0	1	1	256.316	0.047159	Sulfidic compounds
3674	15	30	0	0	1	1	242.3	0.026839	Sulfidic compounds
3675	14	28	0	0	1	1	228.284	0.011258	Sulfidic compounds
3676	13	26	0	0	1	1	214.268	0.004191	Sulfidic compounds
3677	12	24	0	0	1	1	200.252	0.001222	Sulfidic compounds
3678	11	22	0	0	1	1	186.236	0.000515	Sulfidic compounds
3679	10	20	0	0	1	1	172.22	0.000124	Sulfidic compounds
3680	9	18	0	0	1	1	158.204	4e-06	Sulfidic compounds
3681	50	98	0	0	1	2	730.844	1e-05	Sulfidic compounds
3682	49	96	0	0	1	2	716.828	2.6e-05	Sulfidic compounds
3683	46	90	0	0	1	2	674.78	2.3e-05	Sulfidic compounds
3684	45	88	0	0	1	2	660.764	7.9e-05	Sulfidic compounds
3685	44	86	0	0	1	2	646.748	0.000167	Sulfidic compounds
3686	43	84	0	0	1	2	632.732	0.000254	Sulfidic compounds
3687	42	82	0	0	1	2	618.716	0.000357	Sulfidic compounds
3688	41	80	0	0	1	2	604.7	0.000552	Sulfidic compounds
3689	40	78	0	0	1	2	590.684	0.000776	Sulfidic compounds
3690	39	76	0	0	1	2	576.668	0.001003	Sulfidic compounds
3691	38	74	0	0	1	2	562.652	0.001301	Sulfidic compounds
3692	37	72	0	0	1	2	548.636	0.001689	Sulfidic compounds
3693	36	70	0	0	1	2	534.62	0.002186	Sulfidic compounds
3694	35	68	0	0	1	2	520.604	0.003176	Sulfidic compounds
3695	34	66	0	0	1	2	506.588	0.004324	Sulfidic compounds
3696	33	64	0	0	1	2	492.572	0.00587	Sulfidic compounds
3697	32	62	0	0	1	2	478.556	0.007929	Sulfidic compounds
3698	31	60	0	0	1	2	464.54	0.01097	Sulfidic compounds
3699	30	58	0	0	1	2	450.524	0.013494	Sulfidic compounds
3700	29	56	0	0	1	2	436.508	0.016242	Sulfidic compounds
3701	28	54	0	0	1	2	422.492	0.020248	Sulfidic compounds
3702	27	52	0	0	1	2	408.476	0.024795	Sulfidic compounds
3703	26	50	0	0	1	2	394.46	0.030438	Sulfidic compounds
3704	25	48	0	0	1	2	380.444	0.036255	Sulfidic compounds
3705	24	46	0	0	1	2	366.428	0.041661	Sulfidic compounds
3706	23	44	0	0	1	2	352.412	0.046394	Sulfidic compounds
3707	22	42	0	0	1	2	338.396	0.052	Sulfidic compounds
3708	21	40	0	0	1	2	324.38	0.0581	Sulfidic compounds
3709	20	38	0	0	1	2	310.364	0.061524	Sulfidic compounds
3710	19	36	0	0	1	2	296.348	0.060159	Sulfidic compounds
3711	18	34	0	0	1	2	282.332	0.054104	Sulfidic compounds
3712	17	32	0	0	1	2	268.316	0.040263	Sulfidic compounds
3713	16	30	0	0	1	2	254.3	0.025963	Sulfidic compounds
3714	15	28	0	0	1	2	240.284	0.013265	Sulfidic compounds
3715	14	26	0	0	1	2	226.268	0.004876	Sulfidic compounds
3716	13	24	0	0	1	2	212.252	0.001595	Sulfidic compounds
3717	12	22	0	0	1	2	198.236	0.000332	Sulfidic compounds
3718	11	20	0	0	1	2	184.22	0.000167	Sulfidic compounds
3719	10	18	0	0	1	2	170.204	4.5e-05	Sulfidic compounds
3720	50	96	0	0	1	3	728.828	9e-06	Sulfidic compounds
3721	49	94	0	0	1	3	714.812	1.9e-05	Sulfidic compounds
3722	48	92	0	0	1	3	700.796	5.4e-05	Sulfidic compounds
3723	47	90	0	0	1	3	686.78	5.2e-05	Sulfidic compounds
3724	46	88	0	0	1	3	672.764	0.000214	Sulfidic compounds
3725	45	86	0	0	1	3	658.748	0.000308	Sulfidic compounds
3726	44	84	0	0	1	3	644.732	0.000428	Sulfidic compounds
3727	43	82	0	0	1	3	630.716	0.000655	Sulfidic compounds
3728	42	80	0	0	1	3	616.7	0.000772	Sulfidic compounds
3729	41	78	0	0	1	3	602.684	0.000875	Sulfidic compounds
3730	40	76	0	0	1	3	588.668	0.001274	Sulfidic compounds
3731	39	74	0	0	1	3	574.652	0.001676	Sulfidic compounds
3732	38	72	0	0	1	3	560.636	0.002063	Sulfidic compounds
3733	37	70	0	0	1	3	546.62	0.00278	Sulfidic compounds
3734	36	68	0	0	1	3	532.604	0.004	Sulfidic compounds
3735	35	66	0	0	1	3	518.588	0.005384	Sulfidic compounds
3736	34	64	0	0	1	3	504.572	0.007105	Sulfidic compounds
3737	33	62	0	0	1	3	490.556	0.010122	Sulfidic compounds
3738	32	60	0	0	1	3	476.54	0.013216	Sulfidic compounds
3739	31	58	0	0	1	3	462.524	0.016897	Sulfidic compounds
3740	30	56	0	0	1	3	448.508	0.020776	Sulfidic compounds
3741	29	54	0	0	1	3	434.492	0.026196	Sulfidic compounds
3742	28	52	0	0	1	3	420.476	0.032132	Sulfidic compounds
3743	27	50	0	0	1	3	406.46	0.03849	Sulfidic compounds
3744	26	48	0	0	1	3	392.444	0.046577	Sulfidic compounds
3745	25	46	0	0	1	3	378.428	0.054683	Sulfidic compounds
3746	24	44	0	0	1	3	364.412	0.063602	Sulfidic compounds
3747	23	42	0	0	1	3	350.396	0.068832	Sulfidic compounds
3748	22	40	0	0	1	3	336.38	0.079592	Sulfidic compounds
3749	21	38	0	0	1	3	322.364	0.090561	Sulfidic compounds
3750	20	36	0	0	1	3	308.348	0.092736	Sulfidic compounds
3751	19	34	0	0	1	3	294.332	0.089643	Sulfidic compounds
3752	18	32	0	0	1	3	280.316	0.080684	Sulfidic compounds
3753	17	30	0	0	1	3	266.3	0.058129	Sulfidic compounds
3754	16	28	0	0	1	3	252.284	0.039189	Sulfidic compounds
3755	15	26	0	0	1	3	238.268	0.019421	Sulfidic compounds
3756	14	24	0	0	1	3	224.252	0.006878	Sulfidic compounds
3757	13	22	0	0	1	3	210.236	0.001743	Sulfidic compounds
3758	12	20	0	0	1	3	196.22	0.000189	Sulfidic compounds
3759	11	18	0	0	1	3	182.204	3e-05	Sulfidic compounds
3760	10	16	0	0	1	3	168.188	5e-06	Sulfidic compounds
3761	52	98	0	0	1	4	754.844	0.000242	Sulfidic compounds
3762	51	96	0	0	1	4	740.828	0.000213	Sulfidic compounds
3763	50	94	0	0	1	4	726.812	0.000382	Sulfidic compounds
3764	49	92	0	0	1	4	712.796	0.000508	Sulfidic compounds
3765	48	90	0	0	1	4	698.78	0.000618	Sulfidic compounds
3766	47	88	0	0	1	4	684.764	0.000957	Sulfidic compounds
3767	46	86	0	0	1	4	670.748	0.000972	Sulfidic compounds
3768	45	84	0	0	1	4	656.732	0.001214	Sulfidic compounds
3769	44	82	0	0	1	4	642.716	0.001532	Sulfidic compounds
3770	43	80	0	0	1	4	628.7	0.001922	Sulfidic compounds
3771	42	78	0	0	1	4	614.684	0.002405	Sulfidic compounds
3772	41	76	0	0	1	4	600.668	0.002859	Sulfidic compounds
3773	40	74	0	0	1	4	586.652	0.003569	Sulfidic compounds
3774	39	72	0	0	1	4	572.636	0.00407	Sulfidic compounds
3775	38	70	0	0	1	4	558.62	0.005474	Sulfidic compounds
3776	37	68	0	0	1	4	544.604	0.006927	Sulfidic compounds
3777	36	66	0	0	1	4	530.588	0.008498	Sulfidic compounds
3778	35	64	0	0	1	4	516.572	0.010835	Sulfidic compounds
3779	34	62	0	0	1	4	502.556	0.013448	Sulfidic compounds
3780	33	60	0	0	1	4	488.54	0.016207	Sulfidic compounds
3781	32	58	0	0	1	4	474.524	0.019917	Sulfidic compounds
3782	31	56	0	0	1	4	460.508	0.023172	Sulfidic compounds
3783	30	54	0	0	1	4	446.492	0.028172	Sulfidic compounds
3784	29	52	0	0	1	4	432.476	0.03257	Sulfidic compounds
3785	28	50	0	0	1	4	418.46	0.036265	Sulfidic compounds
3786	27	48	0	0	1	4	404.444	0.042214	Sulfidic compounds
3787	26	46	0	0	1	4	390.428	0.047049	Sulfidic compounds
3788	25	44	0	0	1	4	376.412	0.052578	Sulfidic compounds
3789	24	42	0	0	1	4	362.396	0.058645	Sulfidic compounds
3790	23	40	0	0	1	4	348.38	0.066089	Sulfidic compounds
3791	22	38	0	0	1	4	334.364	0.07202	Sulfidic compounds
3792	21	36	0	0	1	4	320.348	0.077589	Sulfidic compounds
3793	20	34	0	0	1	4	306.332	0.079313	Sulfidic compounds
3794	19	32	0	0	1	4	292.316	0.075027	Sulfidic compounds
3795	18	30	0	0	1	4	278.3	0.063157	Sulfidic compounds
3796	17	28	0	0	1	4	264.284	0.044404	Sulfidic compounds
3797	16	26	0	0	1	4	250.268	0.026279	Sulfidic compounds
3798	15	24	0	0	1	4	236.252	0.011203	Sulfidic compounds
3799	14	22	0	0	1	4	222.236	0.003239	Sulfidic compounds
3800	13	20	0	0	1	4	208.22	0.000472	Sulfidic compounds
3801	12	18	0	0	1	4	194.204	0.000113	Sulfidic compounds
3802	11	16	0	0	1	4	180.188	1e-05	Sulfidic compounds
3803	53	98	0	0	1	5	766.844	0.000205	Sulfidic compounds
3804	52	96	0	0	1	5	752.828	0.000434	Sulfidic compounds
3805	51	94	0	0	1	5	738.812	0.000391	Sulfidic compounds
3806	50	92	0	0	1	5	724.796	0.000618	Sulfidic compounds
3807	49	90	0	0	1	5	710.78	0.000803	Sulfidic compounds
3808	48	88	0	0	1	5	696.764	0.000783	Sulfidic compounds
3809	47	86	0	0	1	5	682.748	0.000958	Sulfidic compounds
3810	46	84	0	0	1	5	668.732	0.001431	Sulfidic compounds
3811	45	82	0	0	1	5	654.716	0.001538	Sulfidic compounds
3812	44	80	0	0	1	5	640.7	0.001916	Sulfidic compounds
3813	43	78	0	0	1	5	626.684	0.002201	Sulfidic compounds
3814	42	76	0	0	1	5	612.668	0.003051	Sulfidic compounds
3815	41	74	0	0	1	5	598.652	0.003381	Sulfidic compounds
3816	40	72	0	0	1	5	584.636	0.004196	Sulfidic compounds
3817	39	70	0	0	1	5	570.62	0.005174	Sulfidic compounds
3818	38	68	0	0	1	5	556.604	0.005793	Sulfidic compounds
3819	37	66	0	0	1	5	542.588	0.008017	Sulfidic compounds
3820	36	64	0	0	1	5	528.572	0.00956	Sulfidic compounds
3821	35	62	0	0	1	5	514.556	0.012653	Sulfidic compounds
3822	34	60	0	0	1	5	500.54	0.015187	Sulfidic compounds
3823	33	58	0	0	1	5	486.524	0.017637	Sulfidic compounds
3824	32	56	0	0	1	5	472.508	0.021236	Sulfidic compounds
3825	31	54	0	0	1	5	458.492	0.024364	Sulfidic compounds
3826	30	52	0	0	1	5	444.476	0.030353	Sulfidic compounds
3827	29	50	0	0	1	5	430.46	0.033762	Sulfidic compounds
3828	28	48	0	0	1	5	416.444	0.037666	Sulfidic compounds
3829	27	46	0	0	1	5	402.428	0.044403	Sulfidic compounds
3830	26	44	0	0	1	5	388.412	0.047128	Sulfidic compounds
3831	25	42	0	0	1	5	374.396	0.053946	Sulfidic compounds
3832	24	40	0	0	1	5	360.38	0.060756	Sulfidic compounds
3833	23	38	0	0	1	5	346.364	0.067742	Sulfidic compounds
3834	22	36	0	0	1	5	332.348	0.076671	Sulfidic compounds
3835	21	34	0	0	1	5	318.332	0.08337	Sulfidic compounds
3836	20	32	0	0	1	5	304.316	0.086389	Sulfidic compounds
3837	19	30	0	0	1	5	290.3	0.085348	Sulfidic compounds
3838	18	28	0	0	1	5	276.284	0.077605	Sulfidic compounds
3839	17	26	0	0	1	5	262.268	0.060679	Sulfidic compounds
3840	16	24	0	0	1	5	248.252	0.039978	Sulfidic compounds
3841	15	22	0	0	1	5	234.236	0.019971	Sulfidic compounds
3842	14	20	0	0	1	5	220.22	0.007317	Sulfidic compounds
3843	13	18	0	0	1	5	206.204	0.001278	Sulfidic compounds
3844	12	16	0	0	1	5	192.188	0.000243	Sulfidic compounds
3845	11	14	0	0	1	5	178.172	6.9e-05	Sulfidic compounds
3846	10	12	0	0	1	5	164.156	4.7e-05	Sulfidic compounds
3847	52	94	0	0	1	6	750.812	0.000502	Sulfidic compounds
3848	51	92	0	0	1	6	736.796	0.000639	Sulfidic compounds
3849	50	90	0	0	1	6	722.78	0.000635	Sulfidic compounds
3850	49	88	0	0	1	6	708.764	0.00068	Sulfidic compounds
3851	48	86	0	0	1	6	694.748	0.000814	Sulfidic compounds
3852	47	84	0	0	1	6	680.732	0.001246	Sulfidic compounds
3853	46	82	0	0	1	6	666.716	0.001316	Sulfidic compounds
3854	45	80	0	0	1	6	652.7	0.001585	Sulfidic compounds
3855	44	78	0	0	1	6	638.684	0.002068	Sulfidic compounds
3856	43	76	0	0	1	6	624.668	0.002598	Sulfidic compounds
3857	42	74	0	0	1	6	610.652	0.002923	Sulfidic compounds
3858	41	72	0	0	1	6	596.636	0.003263	Sulfidic compounds
3859	40	70	0	0	1	6	582.62	0.004312	Sulfidic compounds
3860	39	68	0	0	1	6	568.604	0.004909	Sulfidic compounds
3861	38	66	0	0	1	6	554.588	0.005652	Sulfidic compounds
3862	37	64	0	0	1	6	540.572	0.006593	Sulfidic compounds
3863	36	62	0	0	1	6	526.556	0.00832	Sulfidic compounds
3864	35	60	0	0	1	6	512.54	0.010859	Sulfidic compounds
3865	34	58	0	0	1	6	498.524	0.013186	Sulfidic compounds
3866	33	56	0	0	1	6	484.508	0.01444	Sulfidic compounds
3867	32	54	0	0	1	6	470.492	0.01695	Sulfidic compounds
3868	31	52	0	0	1	6	456.476	0.019747	Sulfidic compounds
3869	31	52	0	0	2	6	488.536	2.2e-05	Sulfidic compounds
3870	30	50	0	0	1	6	442.46	0.020253	Sulfidic compounds
3871	30	50	0	0	2	6	474.52	1.3e-05	Sulfidic compounds
3872	29	48	0	0	1	6	428.444	0.022233	Sulfidic compounds
3873	29	48	0	0	2	6	460.504	2.6e-05	Sulfidic compounds
3874	28	46	0	0	1	6	414.428	0.024402	Sulfidic compounds
3875	28	46	0	0	2	6	446.488	3e-05	Sulfidic compounds
3876	27	44	0	0	1	6	400.412	0.028223	Sulfidic compounds
3877	27	44	0	0	2	6	432.472	1.1e-05	Sulfidic compounds
3878	26	42	0	0	1	6	386.396	0.032863	Sulfidic compounds
3879	26	42	0	0	2	6	418.456	5e-06	Sulfidic compounds
3880	25	40	0	0	1	6	372.38	0.036626	Sulfidic compounds
3881	24	38	0	0	1	6	358.364	0.042668	Sulfidic compounds
3882	23	36	0	0	1	6	344.348	0.046168	Sulfidic compounds
3883	23	36	0	0	2	6	376.408	1.5e-05	Sulfidic compounds
3884	22	34	0	0	1	6	330.332	0.053369	Sulfidic compounds
3885	22	34	0	0	2	6	362.392	2.3e-05	Sulfidic compounds
3886	21	32	0	0	1	6	316.316	0.056163	Sulfidic compounds
3887	21	32	0	0	2	6	348.376	5e-06	Sulfidic compounds
3888	20	30	0	0	1	6	302.3	0.05877	Sulfidic compounds
3889	20	30	0	0	2	6	334.36	1.7e-05	Sulfidic compounds
3890	19	28	0	0	1	6	288.284	0.060921	Sulfidic compounds
3891	19	28	0	0	2	6	320.344	1.6e-05	Sulfidic compounds
3892	18	26	0	0	1	6	274.268	0.061451	Sulfidic compounds
3893	18	26	0	0	2	6	306.328	2.8e-05	Sulfidic compounds
3894	17	24	0	0	1	6	260.252	0.057221	Sulfidic compounds
3895	17	24	0	0	2	6	292.312	6e-06	Sulfidic compounds
3896	16	22	0	0	1	6	246.236	0.043612	Sulfidic compounds
3897	15	20	0	0	1	6	232.22	0.021072	Sulfidic compounds
3898	14	18	0	0	1	6	218.204	0.005299	Sulfidic compounds
3899	13	16	0	0	1	6	204.188	0.000326	Sulfidic compounds
3900	12	14	0	0	1	6	190.172	1.4e-05	Sulfidic compounds
3901	11	12	0	0	1	6	176.156	5e-06	Sulfidic compounds
3902	54	96	0	0	1	7	776.828	0.000322	Sulfidic compounds
3903	53	94	0	0	1	7	762.812	0.000412	Sulfidic compounds
3904	52	92	0	0	1	7	748.796	0.000384	Sulfidic compounds
3905	50	88	0	0	1	7	720.764	0.000586	Sulfidic compounds
3906	49	86	0	0	1	7	706.748	0.000725	Sulfidic compounds
3907	48	84	0	0	1	7	692.732	0.000936	Sulfidic compounds
3908	47	82	0	0	1	7	678.716	0.001196	Sulfidic compounds
3909	46	80	0	0	1	7	664.7	0.001332	Sulfidic compounds
3910	45	78	0	0	1	7	650.684	0.001575	Sulfidic compounds
3911	44	76	0	0	1	7	636.668	0.001849	Sulfidic compounds
3912	43	74	0	0	1	7	622.652	0.001836	Sulfidic compounds
3913	42	72	0	0	1	7	608.636	0.002347	Sulfidic compounds
3914	41	70	0	0	1	7	594.62	0.002506	Sulfidic compounds
3915	41	70	0	0	2	7	626.68	2.7e-05	Sulfidic compounds
3916	40	68	0	0	1	7	580.604	0.003106	Sulfidic compounds
3917	40	68	0	0	2	7	612.664	5.1e-05	Sulfidic compounds
3918	39	66	0	0	1	7	566.588	0.00359	Sulfidic compounds
3919	39	66	0	0	2	7	598.648	1.6e-05	Sulfidic compounds
3920	38	64	0	0	1	7	552.572	0.004083	Sulfidic compounds
3921	38	64	0	0	2	7	584.632	0.000162	Sulfidic compounds
3922	37	62	0	0	1	7	538.556	0.005015	Sulfidic compounds
3923	37	62	0	0	2	7	570.616	0.000192	Sulfidic compounds
3924	36	60	0	0	1	7	524.54	0.00547	Sulfidic compounds
3925	36	60	0	0	2	7	556.6	0.000247	Sulfidic compounds
3926	35	58	0	0	1	7	510.524	0.006428	Sulfidic compounds
3927	35	58	0	0	2	7	542.584	0.000439	Sulfidic compounds
3928	34	56	0	0	1	7	496.508	0.007492	Sulfidic compounds
3929	34	56	0	0	2	7	528.568	0.000338	Sulfidic compounds
3930	33	54	0	0	1	7	482.492	0.008236	Sulfidic compounds
3931	33	54	0	0	2	7	514.552	0.000544	Sulfidic compounds
3932	32	52	0	0	1	7	468.476	0.009026	Sulfidic compounds
3933	32	52	0	0	2	7	500.536	0.000607	Sulfidic compounds
3934	31	50	0	0	1	7	454.46	0.010982	Sulfidic compounds
3935	31	50	0	0	2	7	486.52	0.000738	Sulfidic compounds
3936	30	48	0	0	1	7	440.444	0.011992	Sulfidic compounds
3937	30	48	0	0	2	7	472.504	0.000852	Sulfidic compounds
3938	29	46	0	0	1	7	426.428	0.013406	Sulfidic compounds
3939	29	46	0	0	2	7	458.488	0.000891	Sulfidic compounds
3940	28	44	0	0	1	7	412.412	0.014309	Sulfidic compounds
3941	28	44	0	0	2	7	444.472	0.000972	Sulfidic compounds
3942	27	42	0	0	1	7	398.396	0.017308	Sulfidic compounds
3943	27	42	0	0	2	7	430.456	0.000901	Sulfidic compounds
3944	26	40	0	0	1	7	384.38	0.01973	Sulfidic compounds
3945	26	40	0	0	2	7	416.44	0.000837	Sulfidic compounds
3946	25	38	0	0	1	7	370.364	0.022828	Sulfidic compounds
3947	25	38	0	0	2	7	402.424	0.000906	Sulfidic compounds
3948	24	36	0	0	1	7	356.348	0.025728	Sulfidic compounds
3949	24	36	0	0	2	7	388.408	0.0007	Sulfidic compounds
3950	23	34	0	0	1	7	342.332	0.029201	Sulfidic compounds
3951	23	34	0	0	2	7	374.392	0.000691	Sulfidic compounds
3952	22	32	0	0	1	7	328.316	0.033779	Sulfidic compounds
3953	22	32	0	0	2	7	360.376	0.00068	Sulfidic compounds
3954	21	30	0	0	1	7	314.3	0.037941	Sulfidic compounds
3955	21	30	0	0	2	7	346.36	0.000477	Sulfidic compounds
3956	20	28	0	0	1	7	300.284	0.039136	Sulfidic compounds
3957	20	28	0	0	2	7	332.344	0.000493	Sulfidic compounds
3958	19	26	0	0	1	7	286.268	0.036452	Sulfidic compounds
3959	19	26	0	0	2	7	318.328	0.000456	Sulfidic compounds
3960	18	24	0	0	1	7	272.252	0.030737	Sulfidic compounds
3961	18	24	0	0	2	7	304.312	0.000317	Sulfidic compounds
3962	17	22	0	0	1	7	258.236	0.019341	Sulfidic compounds
3963	17	22	0	0	2	7	290.296	0.000281	Sulfidic compounds
3964	16	20	0	0	1	7	244.22	0.008488	Sulfidic compounds
3965	16	20	0	0	2	7	276.28	0.000114	Sulfidic compounds
3966	15	18	0	0	1	7	230.204	0.001378	Sulfidic compounds
3967	15	18	0	0	2	7	262.264	8.8e-05	Sulfidic compounds
3968	14	16	0	0	1	7	216.188	0.000109	Sulfidic compounds
3969	14	16	0	0	2	7	248.248	1.1e-05	Sulfidic compounds
3970	13	14	0	0	1	7	202.172	1.1e-05	Sulfidic compounds
3971	54	94	0	0	1	8	774.812	0.000363	Sulfidic compounds
3972	53	92	0	0	1	8	760.796	0.000381	Sulfidic compounds
3973	52	90	0	0	1	8	746.78	0.000353	Sulfidic compounds
3974	50	86	0	0	1	8	718.748	0.000641	Sulfidic compounds
3975	49	84	0	0	1	8	704.732	0.00075	Sulfidic compounds
3976	48	82	0	0	1	8	690.716	0.000821	Sulfidic compounds
3977	47	80	0	0	1	8	676.7	0.000892	Sulfidic compounds
3978	46	78	0	0	1	8	662.684	0.001013	Sulfidic compounds
3979	45	76	0	0	1	8	648.668	0.001369	Sulfidic compounds
3980	44	74	0	0	1	8	634.652	0.001333	Sulfidic compounds
3981	43	72	0	0	1	8	620.636	0.001645	Sulfidic compounds
3982	43	72	0	0	2	8	652.696	1e-05	Sulfidic compounds
3983	42	70	0	0	1	8	606.62	0.001696	Sulfidic compounds
3984	41	68	0	0	1	8	592.604	0.001921	Sulfidic compounds
3985	41	68	0	0	2	8	624.664	3.1e-05	Sulfidic compounds
3986	40	66	0	0	1	8	578.588	0.002497	Sulfidic compounds
3987	40	66	0	0	2	8	610.648	3.1e-05	Sulfidic compounds
3988	39	64	0	0	1	8	564.572	0.00242	Sulfidic compounds
3989	39	64	0	0	2	8	596.632	0.000189	Sulfidic compounds
3990	38	62	0	0	1	8	550.556	0.003016	Sulfidic compounds
3991	38	62	0	0	2	8	582.616	0.00017	Sulfidic compounds
3992	37	60	0	0	1	8	536.54	0.003474	Sulfidic compounds
3993	37	60	0	0	2	8	568.6	0.000193	Sulfidic compounds
3994	36	58	0	0	1	8	522.524	0.003856	Sulfidic compounds
3995	36	58	0	0	2	8	554.584	0.000368	Sulfidic compounds
3996	35	56	0	0	1	8	508.508	0.004268	Sulfidic compounds
3997	35	56	0	0	2	8	540.568	0.000309	Sulfidic compounds
3998	34	54	0	0	1	8	494.492	0.004935	Sulfidic compounds
3999	34	54	0	0	2	8	526.552	0.000415	Sulfidic compounds
4000	33	52	0	0	1	8	480.476	0.005425	Sulfidic compounds
4001	33	52	0	0	2	8	512.536	0.000587	Sulfidic compounds
4002	32	50	0	0	1	8	466.46	0.005707	Sulfidic compounds
4003	32	50	0	0	2	8	498.52	0.000613	Sulfidic compounds
4004	31	48	0	0	1	8	452.444	0.006724	Sulfidic compounds
4005	31	48	0	0	2	8	484.504	0.000693	Sulfidic compounds
4006	30	46	0	0	1	8	438.428	0.008065	Sulfidic compounds
4007	30	46	0	0	2	8	470.488	0.000773	Sulfidic compounds
4008	29	44	0	0	1	8	424.412	0.008632	Sulfidic compounds
4009	29	44	0	0	2	8	456.472	0.00074	Sulfidic compounds
4010	28	42	0	0	1	8	410.396	0.009564	Sulfidic compounds
4011	28	42	0	0	2	8	442.456	0.00053	Sulfidic compounds
4012	27	40	0	0	1	8	396.38	0.011619	Sulfidic compounds
4013	27	40	0	0	2	8	428.44	0.000642	Sulfidic compounds
4014	26	38	0	0	1	8	382.364	0.013638	Sulfidic compounds
4015	26	38	0	0	2	8	414.424	0.000628	Sulfidic compounds
4016	25	36	0	0	1	8	368.348	0.015501	Sulfidic compounds
4017	25	36	0	0	2	8	400.408	0.000501	Sulfidic compounds
4018	24	34	0	0	1	8	354.332	0.017106	Sulfidic compounds
4019	24	34	0	0	2	8	386.392	0.000472	Sulfidic compounds
4020	23	32	0	0	1	8	340.316	0.018459	Sulfidic compounds
4021	23	32	0	0	2	8	372.376	0.000403	Sulfidic compounds
4022	22	30	0	0	1	8	326.3	0.019511	Sulfidic compounds
4023	22	30	0	0	2	8	358.36	0.000344	Sulfidic compounds
4024	21	28	0	0	1	8	312.284	0.018354	Sulfidic compounds
4025	21	28	0	0	2	8	344.344	0.00035	Sulfidic compounds
4026	20	26	0	0	1	8	298.268	0.015909	Sulfidic compounds
4027	20	26	0	0	2	8	330.328	0.000313	Sulfidic compounds
4028	19	24	0	0	1	8	284.252	0.010985	Sulfidic compounds
4029	19	24	0	0	2	8	316.312	0.000252	Sulfidic compounds
4030	18	22	0	0	1	8	270.236	0.006709	Sulfidic compounds
4031	18	22	0	0	2	8	302.296	0.000183	Sulfidic compounds
4032	17	20	0	0	1	8	256.22	0.002756	Sulfidic compounds
4033	17	20	0	0	2	8	288.28	4.8e-05	Sulfidic compounds
4034	16	18	0	0	1	8	242.204	0.000821	Sulfidic compounds
4035	16	18	0	0	2	8	274.264	6e-06	Sulfidic compounds
4036	15	16	0	0	1	8	228.188	0.000154	Sulfidic compounds
4037	14	14	0	0	1	8	214.172	2.3e-05	Sulfidic compounds
4038	13	12	0	0	1	8	200.156	4e-06	Sulfidic compounds
4039	54	92	0	0	1	9	772.796	0.000184	Sulfidic compounds
4040	53	90	0	0	1	9	758.78	0.000313	Sulfidic compounds
4041	52	88	0	0	1	9	744.764	0.000383	Sulfidic compounds
4042	50	84	0	0	1	9	716.732	0.000541	Sulfidic compounds
4043	49	82	0	0	1	9	702.716	0.000479	Sulfidic compounds
4044	48	80	0	0	1	9	688.7	0.000555	Sulfidic compounds
4045	47	78	0	0	1	9	674.684	0.000674	Sulfidic compounds
4046	46	76	0	0	1	9	660.668	0.000754	Sulfidic compounds
4047	45	74	0	0	1	9	646.652	0.000829	Sulfidic compounds
4048	44	72	0	0	1	9	632.636	0.000831	Sulfidic compounds
4049	43	70	0	0	1	9	618.62	0.001138	Sulfidic compounds
4050	43	70	0	0	2	9	650.68	1.6e-05	Sulfidic compounds
4051	42	68	0	0	1	9	604.604	0.001276	Sulfidic compounds
4052	42	68	0	0	2	9	636.664	3.4e-05	Sulfidic compounds
4053	41	66	0	0	1	9	590.588	0.001323	Sulfidic compounds
4054	41	66	0	0	2	9	622.648	2.4e-05	Sulfidic compounds
4055	40	64	0	0	1	9	576.572	0.001329	Sulfidic compounds
4056	40	64	0	0	2	9	608.632	5.1e-05	Sulfidic compounds
4057	39	62	0	0	1	9	562.556	0.001525	Sulfidic compounds
4058	39	62	0	0	2	9	594.616	0.000213	Sulfidic compounds
4059	38	60	0	0	1	9	548.54	0.001944	Sulfidic compounds
4060	38	60	0	0	2	9	580.6	0.000108	Sulfidic compounds
4061	37	58	0	0	1	9	534.524	0.001865	Sulfidic compounds
4062	37	58	0	0	2	9	566.584	0.000313	Sulfidic compounds
4063	36	56	0	0	1	9	520.508	0.002249	Sulfidic compounds
4064	36	56	0	0	2	9	552.568	0.000312	Sulfidic compounds
4065	35	54	0	0	1	9	506.492	0.002466	Sulfidic compounds
4066	35	54	0	0	2	9	538.552	0.000358	Sulfidic compounds
4067	34	52	0	0	1	9	492.476	0.002781	Sulfidic compounds
4068	34	52	0	0	2	9	524.536	0.00052	Sulfidic compounds
4069	33	50	0	0	1	9	478.46	0.003092	Sulfidic compounds
4070	33	50	0	0	2	9	510.52	0.00057	Sulfidic compounds
4071	32	48	0	0	1	9	464.444	0.003272	Sulfidic compounds
4072	32	48	0	0	2	9	496.504	0.000555	Sulfidic compounds
4073	31	46	0	0	1	9	450.428	0.003617	Sulfidic compounds
4074	31	46	0	0	2	9	482.488	0.000599	Sulfidic compounds
4075	30	44	0	0	1	9	436.412	0.004595	Sulfidic compounds
4076	30	44	0	0	2	9	468.472	0.00064	Sulfidic compounds
4077	29	42	0	0	1	9	422.396	0.00554	Sulfidic compounds
4078	29	42	0	0	2	9	454.456	0.000564	Sulfidic compounds
4079	28	40	0	0	1	9	408.38	0.00627	Sulfidic compounds
4080	28	40	0	0	2	9	440.44	0.000492	Sulfidic compounds
4081	27	38	0	0	1	9	394.364	0.006765	Sulfidic compounds
4082	27	38	0	0	2	9	426.424	0.000425	Sulfidic compounds
4083	26	36	0	0	1	9	380.348	0.00702	Sulfidic compounds
4084	26	36	0	0	2	9	412.408	0.000405	Sulfidic compounds
4085	25	34	0	0	1	9	366.332	0.007157	Sulfidic compounds
4086	25	34	0	0	2	9	398.392	0.00038	Sulfidic compounds
4087	24	32	0	0	1	9	352.316	0.007584	Sulfidic compounds
4088	24	32	0	0	2	9	384.376	0.000294	Sulfidic compounds
4089	23	30	0	0	1	9	338.3	0.007439	Sulfidic compounds
4090	23	30	0	0	2	9	370.36	0.000273	Sulfidic compounds
4091	22	28	0	0	1	9	324.284	0.006857	Sulfidic compounds
4092	22	28	0	0	2	9	356.344	0.000125	Sulfidic compounds
4093	21	26	0	0	1	9	310.268	0.00563	Sulfidic compounds
4094	21	26	0	0	2	9	342.328	0.000153	Sulfidic compounds
4095	20	24	0	0	1	9	296.252	0.004085	Sulfidic compounds
4096	20	24	0	0	2	9	328.312	3.7e-05	Sulfidic compounds
4097	19	22	0	0	1	9	282.236	0.002621	Sulfidic compounds
4098	19	22	0	0	2	9	314.296	4e-06	Sulfidic compounds
4099	18	20	0	0	1	9	268.22	0.00154	Sulfidic compounds
4100	17	18	0	0	1	9	254.204	0.000817	Sulfidic compounds
4101	16	16	0	0	1	9	240.188	0.000279	Sulfidic compounds
4102	15	14	0	0	1	9	226.172	0.00013	Sulfidic compounds
4103	14	12	0	0	1	9	212.156	1.7e-05	Sulfidic compounds
4104	54	90	0	0	1	10	770.78	7.8e-05	Sulfidic compounds
4105	52	86	0	0	1	10	742.748	0.000255	Sulfidic compounds
4106	51	84	0	0	1	10	728.732	0.00024	Sulfidic compounds
4107	50	82	0	0	1	10	714.716	0.000216	Sulfidic compounds
4108	49	80	0	0	1	10	700.7	0.000281	Sulfidic compounds
4109	47	76	0	0	1	10	672.668	0.000353	Sulfidic compounds
4110	46	74	0	0	1	10	658.652	0.000442	Sulfidic compounds
4111	45	72	0	0	1	10	644.636	0.000475	Sulfidic compounds
4112	44	70	0	0	1	10	630.62	0.000653	Sulfidic compounds
4113	43	68	0	0	1	10	616.604	0.00067	Sulfidic compounds
4114	43	68	0	0	2	10	648.664	9e-06	Sulfidic compounds
4115	42	66	0	0	1	10	602.588	0.000793	Sulfidic compounds
4116	42	66	0	0	2	10	634.648	5.5e-05	Sulfidic compounds
4117	41	64	0	0	1	10	588.572	0.000676	Sulfidic compounds
4118	41	64	0	0	2	10	620.632	8.8e-05	Sulfidic compounds
4119	40	62	0	0	1	10	574.556	0.000926	Sulfidic compounds
4120	40	62	0	0	2	10	606.616	4.2e-05	Sulfidic compounds
4121	39	60	0	0	1	10	560.54	0.000825	Sulfidic compounds
4122	39	60	0	0	2	10	592.6	0.000112	Sulfidic compounds
4123	38	58	0	0	1	10	546.524	0.0011	Sulfidic compounds
4124	38	58	0	0	2	10	578.584	0.000249	Sulfidic compounds
4125	37	56	0	0	1	10	532.508	0.000939	Sulfidic compounds
4126	37	56	0	0	2	10	564.568	0.000337	Sulfidic compounds
4127	36	54	0	0	1	10	518.492	0.001248	Sulfidic compounds
4128	36	54	0	0	2	10	550.552	0.00039	Sulfidic compounds
4129	35	52	0	0	1	10	504.476	0.001367	Sulfidic compounds
4130	35	52	0	0	2	10	536.536	0.000407	Sulfidic compounds
4131	34	50	0	0	1	10	490.46	0.001454	Sulfidic compounds
4132	34	50	0	0	2	10	522.52	0.000514	Sulfidic compounds
4133	33	48	0	0	1	10	476.444	0.001599	Sulfidic compounds
4134	33	48	0	0	2	10	508.504	0.00056	Sulfidic compounds
4135	32	46	0	0	1	10	462.428	0.001423	Sulfidic compounds
4136	32	46	0	0	2	10	494.488	0.000492	Sulfidic compounds
4137	31	44	0	0	1	10	448.412	0.001805	Sulfidic compounds
4138	31	44	0	0	2	10	480.472	0.000576	Sulfidic compounds
4139	30	42	0	0	1	10	434.396	0.001853	Sulfidic compounds
4140	30	42	0	0	2	10	466.456	0.00055	Sulfidic compounds
4141	29	40	0	0	1	10	420.38	0.002195	Sulfidic compounds
4142	29	40	0	0	2	10	452.44	0.000534	Sulfidic compounds
4143	28	38	0	0	1	10	406.364	0.002129	Sulfidic compounds
4144	28	38	0	0	2	10	438.424	0.000426	Sulfidic compounds
4145	27	36	0	0	1	10	392.348	0.002351	Sulfidic compounds
4146	27	36	0	0	2	10	424.408	0.000394	Sulfidic compounds
4147	26	34	0	0	1	10	378.332	0.002523	Sulfidic compounds
4148	26	34	0	0	2	10	410.392	0.000398	Sulfidic compounds
4149	25	32	0	0	1	10	364.316	0.002511	Sulfidic compounds
4150	25	32	0	0	2	10	396.376	0.000266	Sulfidic compounds
4151	24	30	0	0	1	10	350.3	0.002847	Sulfidic compounds
4152	24	30	0	0	2	10	382.36	0.000223	Sulfidic compounds
4153	23	28	0	0	1	10	336.284	0.00267	Sulfidic compounds
4154	23	28	0	0	2	10	368.344	0.000119	Sulfidic compounds
4155	22	26	0	0	1	10	322.268	0.00278	Sulfidic compounds
4156	22	26	0	0	2	10	354.328	0.000133	Sulfidic compounds
4157	21	24	0	0	1	10	308.252	0.002368	Sulfidic compounds
4158	21	24	0	0	2	10	340.312	0.000109	Sulfidic compounds
4159	20	22	0	0	1	10	294.236	0.001771	Sulfidic compounds
4160	20	22	0	0	2	10	326.296	9e-05	Sulfidic compounds
4161	19	20	0	0	1	10	280.22	0.001131	Sulfidic compounds
4162	19	20	0	0	2	10	312.28	5.3e-05	Sulfidic compounds
4163	18	18	0	0	1	10	266.204	0.000547	Sulfidic compounds
4164	18	18	0	0	2	10	298.264	3e-05	Sulfidic compounds
4165	17	16	0	0	1	10	252.188	0.000253	Sulfidic compounds
4166	16	14	0	0	1	10	238.172	0.000148	Sulfidic compounds
4167	15	12	0	0	1	10	224.156	1.9e-05	Sulfidic compounds
4168	54	88	0	0	1	11	768.764	1.7e-05	Sulfidic compounds
4169	52	84	0	0	1	11	740.732	0.000161	Sulfidic compounds
4170	51	82	0	0	1	11	726.716	0.000115	Sulfidic compounds
4171	50	80	0	0	1	11	712.7	6.3e-05	Sulfidic compounds
4172	48	76	0	0	1	11	684.668	0.000207	Sulfidic compounds
4173	46	72	0	0	1	11	656.636	0.000242	Sulfidic compounds
4174	45	70	0	0	1	11	642.62	0.000279	Sulfidic compounds
4175	45	70	0	0	2	11	674.68	1.7e-05	Sulfidic compounds
4176	44	68	0	0	1	11	628.604	0.000222	Sulfidic compounds
4177	44	68	0	0	2	11	660.664	2.7e-05	Sulfidic compounds
4178	43	66	0	0	1	11	614.588	0.000335	Sulfidic compounds
4179	43	66	0	0	2	11	646.648	1.7e-05	Sulfidic compounds
4180	42	64	0	0	1	11	600.572	0.000389	Sulfidic compounds
4181	42	64	0	0	2	11	632.632	3.4e-05	Sulfidic compounds
4182	41	62	0	0	1	11	586.556	0.000383	Sulfidic compounds
4183	41	62	0	0	2	11	618.616	4.5e-05	Sulfidic compounds
4184	40	60	0	0	1	11	572.54	0.000474	Sulfidic compounds
4185	40	60	0	0	2	11	604.6	0.000169	Sulfidic compounds
4186	39	58	0	0	1	11	558.524	0.000538	Sulfidic compounds
4187	39	58	0	0	2	11	590.584	0.000141	Sulfidic compounds
4188	38	56	0	0	1	11	544.508	0.00052	Sulfidic compounds
4189	38	56	0	0	2	11	576.568	0.000237	Sulfidic compounds
4190	37	54	0	0	1	11	530.492	0.000561	Sulfidic compounds
4191	37	54	0	0	2	11	562.552	0.000275	Sulfidic compounds
4192	36	52	0	0	1	11	516.476	0.000551	Sulfidic compounds
4193	36	52	0	0	2	11	548.536	0.000335	Sulfidic compounds
4194	35	50	0	0	1	11	502.46	0.000671	Sulfidic compounds
4195	35	50	0	0	2	11	534.52	0.000395	Sulfidic compounds
4196	34	48	0	0	1	11	488.444	0.000706	Sulfidic compounds
4197	34	48	0	0	2	11	520.504	0.000411	Sulfidic compounds
4198	33	46	0	0	1	11	474.428	0.000715	Sulfidic compounds
4199	33	46	0	0	2	11	506.488	0.000456	Sulfidic compounds
4200	32	44	0	0	1	11	460.412	0.00072	Sulfidic compounds
4201	32	44	0	0	2	11	492.472	0.00059	Sulfidic compounds
4202	31	42	0	0	1	11	446.396	0.000806	Sulfidic compounds
4203	31	42	0	0	2	11	478.456	0.000545	Sulfidic compounds
4204	30	40	0	0	1	11	432.38	0.000875	Sulfidic compounds
4205	30	40	0	0	2	11	464.44	0.000611	Sulfidic compounds
4206	29	38	0	0	1	11	418.364	0.000967	Sulfidic compounds
4207	29	38	0	0	2	11	450.424	0.000544	Sulfidic compounds
4208	28	36	0	0	1	11	404.348	0.000945	Sulfidic compounds
4209	28	36	0	0	2	11	436.408	0.000649	Sulfidic compounds
4210	27	34	0	0	1	11	390.332	0.001152	Sulfidic compounds
4211	27	34	0	0	2	11	422.392	0.000401	Sulfidic compounds
4212	26	32	0	0	1	11	376.316	0.001202	Sulfidic compounds
4213	26	32	0	0	2	11	408.376	0.000372	Sulfidic compounds
4214	25	30	0	0	1	11	362.3	0.001326	Sulfidic compounds
4215	25	30	0	0	2	11	394.36	0.000268	Sulfidic compounds
4216	24	28	0	0	1	11	348.284	0.001312	Sulfidic compounds
4217	24	28	0	0	2	11	380.344	0.000288	Sulfidic compounds
4218	23	26	0	0	1	11	334.268	0.001371	Sulfidic compounds
4219	23	26	0	0	2	11	366.328	0.000162	Sulfidic compounds
4220	22	24	0	0	1	11	320.252	0.001514	Sulfidic compounds
4221	22	24	0	0	2	11	352.312	0.000123	Sulfidic compounds
4222	21	22	0	0	1	11	306.236	0.001736	Sulfidic compounds
4223	21	22	0	0	2	11	338.296	9.3e-05	Sulfidic compounds
4224	20	20	0	0	1	11	292.22	0.002165	Sulfidic compounds
4225	20	20	0	0	2	11	324.28	1.5e-05	Sulfidic compounds
4226	19	18	0	0	1	11	278.204	0.001911	Sulfidic compounds
4227	19	18	0	0	2	11	310.264	1.3e-05	Sulfidic compounds
4228	18	16	0	0	1	11	264.188	0.001302	Sulfidic compounds
4229	17	14	0	0	1	11	250.172	0.000453	Sulfidic compounds
4230	16	12	0	0	1	11	236.156	5.8e-05	Sulfidic compounds
4231	54	86	0	0	1	12	766.748	3.2e-05	Sulfidic compounds
4232	52	82	0	0	1	12	738.716	1e-05	Sulfidic compounds
4233	51	80	0	0	1	12	724.7	4e-05	Sulfidic compounds
4234	50	78	0	0	1	12	710.684	4.6e-05	Sulfidic compounds
4235	48	74	0	0	1	12	682.652	5.4e-05	Sulfidic compounds
4236	47	72	0	0	1	12	668.636	2.5e-05	Sulfidic compounds
4237	46	70	0	0	1	12	654.62	2.1e-05	Sulfidic compounds
4238	45	68	0	0	1	12	640.604	0.000125	Sulfidic compounds
4239	44	66	0	0	1	12	626.588	0.000154	Sulfidic compounds
4240	44	66	0	0	2	12	658.648	1.4e-05	Sulfidic compounds
4241	43	64	0	0	1	12	612.572	3.8e-05	Sulfidic compounds
4242	42	62	0	0	1	12	598.556	9.4e-05	Sulfidic compounds
4243	42	62	0	0	2	12	630.616	2.5e-05	Sulfidic compounds
4244	41	60	0	0	1	12	584.54	0.000143	Sulfidic compounds
4245	41	60	0	0	2	12	616.6	7.9e-05	Sulfidic compounds
4246	40	58	0	0	1	12	570.524	0.000244	Sulfidic compounds
4247	40	58	0	0	2	12	602.584	1.5e-05	Sulfidic compounds
4248	39	56	0	0	1	12	556.508	0.000139	Sulfidic compounds
4249	39	56	0	0	2	12	588.568	0.000124	Sulfidic compounds
4250	38	54	0	0	1	12	542.492	0.000157	Sulfidic compounds
4251	38	54	0	0	2	12	574.552	0.000161	Sulfidic compounds
4252	37	52	0	0	1	12	528.476	0.00034	Sulfidic compounds
4253	37	52	0	0	2	12	560.536	0.000232	Sulfidic compounds
4254	36	50	0	0	1	12	514.46	0.000221	Sulfidic compounds
4255	36	50	0	0	2	12	546.52	0.000253	Sulfidic compounds
4256	35	48	0	0	1	12	500.444	0.000276	Sulfidic compounds
4257	35	48	0	0	2	12	532.504	0.000337	Sulfidic compounds
4258	34	46	0	0	1	12	486.428	0.000324	Sulfidic compounds
4259	34	46	0	0	2	12	518.488	0.000342	Sulfidic compounds
4260	33	44	0	0	1	12	472.412	0.000318	Sulfidic compounds
4261	33	44	0	0	2	12	504.472	0.000405	Sulfidic compounds
4262	32	42	0	0	1	12	458.396	0.000387	Sulfidic compounds
4263	32	42	0	0	2	12	490.456	0.000354	Sulfidic compounds
4264	31	40	0	0	1	12	444.38	0.000417	Sulfidic compounds
4265	31	40	0	0	2	12	476.44	0.000427	Sulfidic compounds
4266	30	38	0	0	1	12	430.364	0.000491	Sulfidic compounds
4267	30	38	0	0	2	12	462.424	0.000339	Sulfidic compounds
4268	29	36	0	0	1	12	416.348	0.000405	Sulfidic compounds
4269	29	36	0	0	2	12	448.408	0.000311	Sulfidic compounds
4270	28	34	0	0	1	12	402.332	0.000531	Sulfidic compounds
4271	28	34	0	0	2	12	434.392	0.000239	Sulfidic compounds
4272	27	32	0	0	1	12	388.316	0.000487	Sulfidic compounds
4273	27	32	0	0	2	12	420.376	0.000151	Sulfidic compounds
4274	26	30	0	0	1	12	374.3	0.000561	Sulfidic compounds
4275	26	30	0	0	2	12	406.36	0.000148	Sulfidic compounds
4276	25	28	0	0	1	12	360.284	0.000549	Sulfidic compounds
4277	25	28	0	0	2	12	392.344	0.000104	Sulfidic compounds
4278	24	26	0	0	1	12	346.268	0.000598	Sulfidic compounds
4279	24	26	0	0	2	12	378.328	5.2e-05	Sulfidic compounds
4280	23	24	0	0	1	12	332.252	0.000591	Sulfidic compounds
4281	23	24	0	0	2	12	364.312	1.1e-05	Sulfidic compounds
4282	22	22	0	0	1	12	318.236	0.000498	Sulfidic compounds
4283	22	22	0	0	2	12	350.296	2.4e-05	Sulfidic compounds
4284	21	20	0	0	1	12	304.22	0.000304	Sulfidic compounds
4285	20	18	0	0	1	12	290.204	0.000141	Sulfidic compounds
4286	19	16	0	0	1	12	276.188	7e-06	Sulfidic compounds
4287	18	14	0	0	1	12	262.172	1e-05	Sulfidic compounds
4288	17	12	0	0	1	12	248.156	5e-06	Sulfidic compounds
4289	51	78	0	0	1	13	722.684	2.4e-05	Sulfidic compounds
4290	45	66	0	0	1	13	638.588	1.1e-05	Sulfidic compounds
4291	44	64	0	0	2	13	656.632	9e-06	Sulfidic compounds
4292	43	62	0	0	1	13	610.556	2.4e-05	Sulfidic compounds
4293	43	62	0	0	2	13	642.616	2.8e-05	Sulfidic compounds
4294	42	60	0	0	2	13	628.6	3.2e-05	Sulfidic compounds
4295	41	58	0	0	1	13	582.524	8e-06	Sulfidic compounds
4296	41	58	0	0	2	13	614.584	2.4e-05	Sulfidic compounds
4297	40	56	0	0	1	13	568.508	4.3e-05	Sulfidic compounds
4298	40	56	0	0	2	13	600.568	7.9e-05	Sulfidic compounds
4299	39	54	0	0	1	13	554.492	5.3e-05	Sulfidic compounds
4300	39	54	0	0	2	13	586.552	0.000155	Sulfidic compounds
4301	38	52	0	0	1	13	540.476	6.6e-05	Sulfidic compounds
4302	38	52	0	0	2	13	572.536	5.3e-05	Sulfidic compounds
4303	37	50	0	0	1	13	526.46	0.0001	Sulfidic compounds
4304	37	50	0	0	2	13	558.52	0.000165	Sulfidic compounds
4305	36	48	0	0	1	13	512.444	0.000122	Sulfidic compounds
4306	36	48	0	0	2	13	544.504	8.9e-05	Sulfidic compounds
4307	35	46	0	0	1	13	498.428	8.7e-05	Sulfidic compounds
4308	35	46	0	0	2	13	530.488	0.000154	Sulfidic compounds
4309	34	44	0	0	1	13	484.412	0.00017	Sulfidic compounds
4310	34	44	0	0	2	13	516.472	0.000213	Sulfidic compounds
4311	33	42	0	0	1	13	470.396	0.000168	Sulfidic compounds
4312	33	42	0	0	2	13	502.456	0.000245	Sulfidic compounds
4313	32	40	0	0	1	13	456.38	0.000152	Sulfidic compounds
4314	32	40	0	0	2	13	488.44	0.000203	Sulfidic compounds
4315	31	38	0	0	1	13	442.364	0.000147	Sulfidic compounds
4316	31	38	0	0	2	13	474.424	0.000182	Sulfidic compounds
4317	30	36	0	0	1	13	428.348	0.000116	Sulfidic compounds
4318	30	36	0	0	2	13	460.408	0.000143	Sulfidic compounds
4319	29	34	0	0	1	13	414.332	0.000171	Sulfidic compounds
4320	29	34	0	0	2	13	446.392	0.000212	Sulfidic compounds
4321	28	32	0	0	1	13	400.316	0.000197	Sulfidic compounds
4322	28	32	0	0	2	13	432.376	0.000217	Sulfidic compounds
4323	27	30	0	0	1	13	386.3	0.000254	Sulfidic compounds
4324	27	30	0	0	2	13	418.36	0.000111	Sulfidic compounds
4325	26	28	0	0	1	13	372.284	0.000175	Sulfidic compounds
4326	26	28	0	0	2	13	404.344	2.5e-05	Sulfidic compounds
4327	25	26	0	0	1	13	358.268	0.000259	Sulfidic compounds
4328	25	26	0	0	2	13	390.328	6e-06	Sulfidic compounds
4329	24	24	0	0	1	13	344.252	0.000186	Sulfidic compounds
4330	24	24	0	0	2	13	376.312	5e-06	Sulfidic compounds
4331	23	22	0	0	1	13	330.236	6.4e-05	Sulfidic compounds
4332	23	22	0	0	2	13	362.296	1e-05	Sulfidic compounds
4333	22	20	0	0	1	13	316.22	7e-06	Sulfidic compounds
4334	21	18	0	0	2	13	334.264	4e-06	Sulfidic compounds
4335	20	16	0	0	1	13	288.188	7e-06	Sulfidic compounds
4336	54	82	0	0	1	14	762.716	1.3e-05	Sulfidic compounds
4337	52	78	0	0	1	14	734.684	9e-06	Sulfidic compounds
4338	47	68	0	0	1	14	664.604	9e-06	Sulfidic compounds
4339	45	64	0	0	2	14	668.632	1.5e-05	Sulfidic compounds
4340	44	62	0	0	1	14	622.556	9e-06	Sulfidic compounds
4341	44	62	0	0	2	14	654.616	1.4e-05	Sulfidic compounds
4342	42	58	0	0	1	14	594.524	2.2e-05	Sulfidic compounds
4343	42	58	0	0	2	14	626.584	4.3e-05	Sulfidic compounds
4344	41	56	0	0	2	14	612.568	8e-06	Sulfidic compounds
4345	40	54	0	0	2	14	598.552	8.7e-05	Sulfidic compounds
4346	39	52	0	0	1	14	552.476	3e-05	Sulfidic compounds
4347	39	52	0	0	2	14	584.536	1.4e-05	Sulfidic compounds
4348	38	50	0	0	1	14	538.46	7e-06	Sulfidic compounds
4349	38	50	0	0	2	14	570.52	0.000124	Sulfidic compounds
4350	37	48	0	0	1	14	524.444	2.8e-05	Sulfidic compounds
4351	37	48	0	0	2	14	556.504	4.1e-05	Sulfidic compounds
4352	36	46	0	0	1	14	510.428	4.1e-05	Sulfidic compounds
4353	36	46	0	0	2	14	542.488	6.3e-05	Sulfidic compounds
4354	35	44	0	0	1	14	496.412	1.7e-05	Sulfidic compounds
4355	35	44	0	0	2	14	528.472	4.4e-05	Sulfidic compounds
4356	34	42	0	0	1	14	482.396	7e-05	Sulfidic compounds
4357	34	42	0	0	2	14	514.456	0.000155	Sulfidic compounds
4358	33	40	0	0	1	14	468.38	3.5e-05	Sulfidic compounds
4359	33	40	0	0	2	14	500.44	9e-05	Sulfidic compounds
4360	32	38	0	0	1	14	454.364	2.8e-05	Sulfidic compounds
4361	32	38	0	0	2	14	486.424	8.9e-05	Sulfidic compounds
4362	31	36	0	0	1	14	440.348	7.4e-05	Sulfidic compounds
4363	31	36	0	0	2	14	472.408	7.4e-05	Sulfidic compounds
4364	30	34	0	0	1	14	426.332	6.6e-05	Sulfidic compounds
4365	30	34	0	0	2	14	458.392	0.000134	Sulfidic compounds
4366	29	32	0	0	1	14	412.316	5.4e-05	Sulfidic compounds
4367	29	32	0	0	2	14	444.376	4.4e-05	Sulfidic compounds
4368	28	30	0	0	1	14	398.3	7e-05	Sulfidic compounds
4369	28	30	0	0	2	14	430.36	2e-05	Sulfidic compounds
4370	27	28	0	0	1	14	384.284	4.7e-05	Sulfidic compounds
4371	27	28	0	0	2	14	416.344	4.5e-05	Sulfidic compounds
4372	26	26	0	0	1	14	370.268	2.6e-05	Sulfidic compounds
4373	26	26	0	0	2	14	402.328	2.6e-05	Sulfidic compounds
4374	25	24	0	0	1	14	356.252	1.7e-05	Sulfidic compounds
4375	25	24	0	0	2	14	388.312	7e-06	Sulfidic compounds
4376	24	22	0	0	1	14	342.236	7e-06	Sulfidic compounds
4377	23	20	0	0	1	14	328.22	6e-06	Sulfidic compounds
4378	23	20	0	0	2	14	360.28	9e-06	Sulfidic compounds
4379	21	16	0	0	1	14	300.188	1.5e-05	Sulfidic compounds
4380	40	52	0	0	1	15	564.476	1.3e-05	Sulfidic compounds
4381	38	48	0	0	2	15	568.504	1.9e-05	Sulfidic compounds
4382	37	46	0	0	2	15	554.488	7e-06	Sulfidic compounds
4383	36	44	0	0	2	15	540.472	7e-06	Sulfidic compounds
4384	35	42	0	0	2	15	526.456	1.6e-05	Sulfidic compounds
4385	34	40	0	0	1	15	480.38	1.2e-05	Sulfidic compounds
4386	33	38	0	0	2	15	498.424	7e-06	Sulfidic compounds
4387	32	36	0	0	1	15	452.348	3.2e-05	Sulfidic compounds
4388	32	36	0	0	2	15	484.408	6e-06	Sulfidic compounds
4389	31	34	0	0	2	15	470.392	2.6e-05	Sulfidic compounds
4390	30	32	0	0	2	15	456.376	1.1e-05	Sulfidic compounds
4391	29	30	0	0	2	15	442.36	6e-06	Sulfidic compounds
4392	28	28	0	0	1	15	396.284	7e-06	Sulfidic compounds
4393	20	14	1	0	0	14	270.112	6.1e-05	Acidic fraction
4394	20	14	2	0	0	14	286.112	5.1e-05	Acidic fraction
4395	21	16	1	0	0	14	284.128	0.000154	Acidic fraction
4396	21	16	2	0	0	14	300.128	0.000159	Acidic fraction
4397	22	18	1	0	0	14	298.144	0.000286	Acidic fraction
4398	22	18	2	0	0	14	314.144	0.000106	Acidic fraction
4399	23	20	1	0	0	14	312.16	0.000389	Acidic fraction
4400	23	20	2	0	0	14	328.16	0.000145	Acidic fraction
4401	24	22	1	0	0	14	326.176	0.000495	Acidic fraction
4402	24	22	2	0	0	14	342.176	0.000197	Acidic fraction
4403	25	24	1	0	0	14	340.192	0.000528	Acidic fraction
4404	25	24	2	0	0	14	356.192	0.000302	Acidic fraction
4405	26	26	1	0	0	14	354.208	0.000595	Acidic fraction
4406	26	26	2	0	0	14	370.208	0.000217	Acidic fraction
4407	27	28	1	0	0	14	368.224	0.000568	Acidic fraction
4408	27	28	2	0	0	14	384.224	0.000257	Acidic fraction
4409	28	30	1	0	0	14	382.24	0.000471	Acidic fraction
4410	28	30	2	0	0	14	398.24	0.000235	Acidic fraction
4411	29	32	2	0	0	14	412.256	0.000199	Acidic fraction
4412	30	34	2	0	0	14	426.272	0.000233	Acidic fraction
4413	31	36	2	0	0	14	440.288	0.000135	Acidic fraction
4414	32	38	2	0	0	14	454.304	0.000122	Acidic fraction
4415	33	40	2	0	0	14	468.32	7.7e-05	Acidic fraction
4416	35	44	2	0	0	14	496.352	5.6e-05	Acidic fraction
4417	19	14	1	0	0	13	258.112	8.7e-05	Acidic fraction
4418	19	14	2	0	0	13	274.112	9.4e-05	Acidic fraction
4419	20	16	1	0	0	13	272.128	0.000236	Acidic fraction
4420	20	16	2	0	0	13	288.128	0.000296	Acidic fraction
4421	21	18	1	0	0	13	286.144	0.00052	Acidic fraction
4422	21	18	2	0	0	13	302.144	0.000523	Acidic fraction
4423	22	20	1	0	0	13	300.16	0.000782	Acidic fraction
4424	22	20	2	0	0	13	316.16	0.000681	Acidic fraction
4425	23	22	1	0	0	13	314.176	0.000923	Acidic fraction
4426	23	22	2	0	0	13	330.176	0.000696	Acidic fraction
4427	24	24	1	0	0	13	328.192	0.001018	Acidic fraction
4428	24	24	2	0	0	13	344.192	0.00063	Acidic fraction
4429	25	26	1	0	0	13	342.208	0.001006	Acidic fraction
4430	25	26	2	0	0	13	358.208	0.000579	Acidic fraction
4431	26	28	1	0	0	13	356.224	0.001056	Acidic fraction
4432	26	28	2	0	0	13	372.224	0.000475	Acidic fraction
4433	27	30	1	0	0	13	370.24	0.000881	Acidic fraction
4434	27	30	2	0	0	13	386.24	0.00041	Acidic fraction
4435	28	32	1	0	0	13	384.256	0.000802	Acidic fraction
4436	28	32	2	0	0	13	400.256	0.000311	Acidic fraction
4437	29	34	1	0	0	13	398.272	0.000673	Acidic fraction
4438	29	34	2	0	0	13	414.272	0.0003	Acidic fraction
4439	30	36	2	0	0	13	428.288	0.000246	Acidic fraction
4440	31	38	2	0	0	13	442.304	0.000183	Acidic fraction
4441	17	12	1	0	0	12	232.096	6.1e-05	Acidic fraction
4442	17	12	2	0	0	12	248.096	3.6e-05	Acidic fraction
4443	18	14	1	0	0	12	246.112	0.000213	Acidic fraction
4444	18	14	2	0	0	12	262.112	0.000111	Acidic fraction
4445	19	16	1	0	0	12	260.128	0.000512	Acidic fraction
4446	19	16	2	0	0	12	276.128	0.00016	Acidic fraction
4447	20	18	1	0	0	12	274.144	0.000472	Acidic fraction
4448	20	18	2	0	0	12	290.144	0.000248	Acidic fraction
4449	21	20	1	0	0	12	288.16	0.001117	Acidic fraction
4450	21	20	2	0	0	12	304.16	0.0003	Acidic fraction
4451	22	22	1	0	0	12	302.176	0.001314	Acidic fraction
4452	22	22	2	0	0	12	318.176	0.000315	Acidic fraction
4453	23	24	1	0	0	12	316.192	0.001372	Acidic fraction
4454	23	24	2	0	0	12	332.192	0.000367	Acidic fraction
4455	24	26	1	0	0	12	330.208	0.001416	Acidic fraction
4456	24	26	2	0	0	12	346.208	0.000384	Acidic fraction
4457	25	28	1	0	0	12	344.224	0.001404	Acidic fraction
4458	25	28	2	0	0	12	360.224	0.000395	Acidic fraction
4459	26	30	1	0	0	12	358.24	0.001406	Acidic fraction
4460	26	30	2	0	0	12	374.24	0.000364	Acidic fraction
4461	27	32	1	0	0	12	372.256	0.001358	Acidic fraction
4462	28	34	1	0	0	12	386.272	0.001144	Acidic fraction
4463	29	36	1	0	0	12	400.288	0.001061	Acidic fraction
4464	30	38	1	0	0	12	414.304	0.000793	Acidic fraction
4465	31	40	1	0	0	12	428.32	0.000703	Acidic fraction
4466	32	42	1	0	0	12	442.336	0.000527	Acidic fraction
4467	33	44	1	0	0	12	456.352	0.0004	Acidic fraction
4468	33	44	2	0	0	12	472.352	0.000115	Acidic fraction
4469	34	46	1	0	0	12	470.368	0.000301	Acidic fraction
4470	35	48	1	0	0	12	484.384	0.000172	Acidic fraction
4471	36	50	1	0	0	12	498.4	9.4e-05	Acidic fraction
4472	37	52	1	0	0	12	512.416	5.6e-05	Acidic fraction
4473	16	12	1	0	0	11	220.096	3.8e-05	Acidic fraction
4474	17	14	1	0	0	11	234.112	0.000199	Acidic fraction
4475	17	14	2	0	0	11	250.112	2.9e-05	Acidic fraction
4476	18	16	1	0	0	11	248.128	0.000766	Acidic fraction
4477	18	16	2	0	0	11	264.128	0.000128	Acidic fraction
4478	19	18	1	0	0	11	262.144	0.001543	Acidic fraction
4479	19	18	2	0	0	11	278.144	0.000257	Acidic fraction
4480	20	20	1	0	0	11	276.16	0.001854	Acidic fraction
4481	20	20	2	0	0	11	292.16	0.000418	Acidic fraction
4482	21	22	1	0	0	11	290.176	0.0023	Acidic fraction
4483	21	22	2	0	0	11	306.176	0.000548	Acidic fraction
4484	22	24	1	0	0	11	304.192	0.002192	Acidic fraction
4485	22	24	2	0	0	11	320.192	0.000607	Acidic fraction
4486	23	26	1	0	0	11	318.208	0.00231	Acidic fraction
4487	23	26	2	0	0	11	334.208	0.000599	Acidic fraction
4488	24	28	1	0	0	11	332.224	0.002141	Acidic fraction
4489	24	28	2	0	0	11	348.224	0.000635	Acidic fraction
4490	25	30	1	0	0	11	346.24	0.002045	Acidic fraction
4491	25	30	2	0	0	11	362.24	0.000664	Acidic fraction
4492	26	32	1	0	0	11	360.256	0.001908	Acidic fraction
4493	26	32	2	0	0	11	376.256	0.000553	Acidic fraction
4494	27	34	1	0	0	11	374.272	0.001675	Acidic fraction
4495	27	34	2	0	0	11	390.272	0.000503	Acidic fraction
4496	28	36	1	0	0	11	388.288	0.001374	Acidic fraction
4497	28	36	2	0	0	11	404.288	0.000444	Acidic fraction
4498	29	38	1	0	0	11	402.304	0.00129	Acidic fraction
4499	29	38	2	0	0	11	418.304	0.00036	Acidic fraction
4500	30	40	1	0	0	11	416.32	0.000989	Acidic fraction
4501	30	40	2	0	0	11	432.32	0.000275	Acidic fraction
4502	31	42	1	0	0	11	430.336	0.000825	Acidic fraction
4503	31	42	2	0	0	11	446.336	0.000191	Acidic fraction
4504	32	44	1	0	0	11	444.352	0.000625	Acidic fraction
4505	32	44	2	0	0	11	460.352	0.000103	Acidic fraction
4506	33	46	1	0	0	11	458.368	0.000425	Acidic fraction
4507	33	46	2	0	0	11	474.368	9.9e-05	Acidic fraction
4508	34	48	1	0	0	11	472.384	0.00033	Acidic fraction
4509	34	48	2	0	0	11	488.384	9.7e-05	Acidic fraction
4510	35	50	1	0	0	11	486.4	0.000212	Acidic fraction
4511	36	52	1	0	0	11	500.416	0.000141	Acidic fraction
4512	36	52	2	0	0	11	516.416	5.7e-05	Acidic fraction
4513	37	54	1	0	0	11	514.432	0.000118	Acidic fraction
4514	38	56	1	0	0	11	528.448	6.9e-05	Acidic fraction
4515	15	12	1	0	0	10	208.096	3.7e-05	Acidic fraction
4516	15	12	2	0	0	10	224.096	3.7e-05	Acidic fraction
4517	16	14	1	0	0	10	222.112	0.000114	Acidic fraction
4518	16	14	2	0	0	10	238.112	6.7e-05	Acidic fraction
4519	17	16	1	0	0	10	236.128	0.000205	Acidic fraction
4520	17	16	2	0	0	10	252.128	0.000239	Acidic fraction
4521	18	18	1	0	0	10	250.144	0.000655	Acidic fraction
4522	18	18	2	0	0	10	266.144	0.000599	Acidic fraction
4523	19	20	1	0	0	10	264.16	0.00146	Acidic fraction
4524	19	20	2	0	0	10	280.16	0.000854	Acidic fraction
4525	20	22	1	0	0	10	278.176	0.002045	Acidic fraction
4526	20	22	2	0	0	10	294.176	0.00104	Acidic fraction
4527	21	24	1	0	0	10	292.192	0.002324	Acidic fraction
4528	21	24	2	0	0	10	308.192	0.001098	Acidic fraction
4529	22	26	1	0	0	10	306.208	0.002524	Acidic fraction
4530	22	26	2	0	0	10	322.208	0.001144	Acidic fraction
4531	23	28	1	0	0	10	320.224	0.002491	Acidic fraction
4532	23	28	2	0	0	10	336.224	0.001136	Acidic fraction
4533	24	30	1	0	0	10	334.24	0.002374	Acidic fraction
4534	24	30	2	0	0	10	350.24	0.001034	Acidic fraction
4535	25	32	1	0	0	10	348.256	0.002323	Acidic fraction
4536	25	32	2	0	0	10	364.256	0.000992	Acidic fraction
4537	26	34	1	0	0	10	362.272	0.002177	Acidic fraction
4538	26	34	2	0	0	10	378.272	0.000809	Acidic fraction
4539	27	36	1	0	0	10	376.288	0.002087	Acidic fraction
4540	27	36	2	0	0	10	392.288	0.000638	Acidic fraction
4541	28	38	1	0	0	10	390.304	0.001772	Acidic fraction
4542	28	38	2	0	0	10	406.304	0.000561	Acidic fraction
4543	29	40	1	0	0	10	404.32	0.001556	Acidic fraction
4544	29	40	2	0	0	10	420.32	0.000484	Acidic fraction
4545	30	42	1	0	0	10	418.336	0.00123	Acidic fraction
4546	30	42	2	0	0	10	434.336	0.000392	Acidic fraction
4547	31	44	1	0	0	10	432.352	0.001036	Acidic fraction
4548	31	44	2	0	0	10	448.352	0.000235	Acidic fraction
4549	32	46	1	0	0	10	446.368	0.000806	Acidic fraction
4550	32	46	2	0	0	10	462.368	0.00018	Acidic fraction
4551	33	48	1	0	0	10	460.384	0.000566	Acidic fraction
4552	33	48	2	0	0	10	476.384	0.000133	Acidic fraction
4553	34	50	1	0	0	10	474.4	0.000368	Acidic fraction
4554	34	50	2	0	0	10	490.4	0.000125	Acidic fraction
4555	35	52	1	0	0	10	488.416	0.000263	Acidic fraction
4556	36	54	1	0	0	10	502.432	0.000177	Acidic fraction
4557	37	56	1	0	0	10	516.448	0.000113	Acidic fraction
4558	39	60	1	0	0	10	544.48	6.8e-05	Acidic fraction
4559	14	12	1	0	0	9	196.096	4.4e-05	Acidic fraction
4560	14	12	2	0	0	9	212.096	8.7e-05	Acidic fraction
4561	15	14	1	0	0	9	210.112	0.00027	Acidic fraction
4562	15	14	2	0	0	9	226.112	0.000213	Acidic fraction
4563	16	16	1	0	0	9	224.128	0.000645	Acidic fraction
4564	16	16	2	0	0	9	240.128	0.000329	Acidic fraction
4565	17	18	1	0	0	9	238.144	0.001069	Acidic fraction
4566	17	18	2	0	0	9	254.144	0.000614	Acidic fraction
4567	18	20	1	0	0	9	252.16	0.001953	Acidic fraction
4568	18	20	2	0	0	9	268.16	0.001055	Acidic fraction
4569	19	22	1	0	0	9	266.176	0.002969	Acidic fraction
4570	19	22	2	0	0	9	282.176	0.001198	Acidic fraction
4571	20	24	1	0	0	9	280.192	0.00343	Acidic fraction
4572	20	24	2	0	0	9	296.192	0.001261	Acidic fraction
4573	21	26	1	0	0	9	294.208	0.003369	Acidic fraction
4574	21	26	2	0	0	9	310.208	0.00141	Acidic fraction
4575	22	28	1	0	0	9	308.224	0.003658	Acidic fraction
4576	22	28	2	0	0	9	324.224	0.001375	Acidic fraction
4577	23	30	1	0	0	9	322.24	0.003463	Acidic fraction
4578	23	30	2	0	0	9	338.24	0.00128	Acidic fraction
4579	24	32	1	0	0	9	336.256	0.003392	Acidic fraction
4580	24	32	2	0	0	9	352.256	0.004477	Acidic fraction
4581	25	34	1	0	0	9	350.272	0.003308	Acidic fraction
4582	25	34	2	0	0	9	366.272	0.001155	Acidic fraction
4583	26	36	1	0	0	9	364.288	0.003315	Acidic fraction
4584	26	36	2	0	0	9	380.288	0.001036	Acidic fraction
4585	27	38	1	0	0	9	378.304	0.003216	Acidic fraction
4586	27	38	2	0	0	9	394.304	0.000884	Acidic fraction
4587	28	40	1	0	0	9	392.32	0.002716	Acidic fraction
4588	28	40	2	0	0	9	408.32	0.000806	Acidic fraction
4589	29	42	1	0	0	9	406.336	0.002174	Acidic fraction
4590	29	42	2	0	0	9	422.336	0.000569	Acidic fraction
4591	30	44	1	0	0	9	420.352	0.001719	Acidic fraction
4592	30	44	2	0	0	9	436.352	0.000494	Acidic fraction
4593	31	46	1	0	0	9	434.368	0.001449	Acidic fraction
4594	31	46	2	0	0	9	450.368	0.000306	Acidic fraction
4595	32	48	1	0	0	9	448.384	0.000993	Acidic fraction
4596	32	48	2	0	0	9	464.384	0.000252	Acidic fraction
4597	33	50	1	0	0	9	462.4	0.000748	Acidic fraction
4598	33	50	2	0	0	9	478.4	0.000104	Acidic fraction
4599	34	52	1	0	0	9	476.416	0.000527	Acidic fraction
4600	34	52	2	0	0	9	492.416	8.2e-05	Acidic fraction
4601	35	54	1	0	0	9	490.432	0.000311	Acidic fraction
4602	35	54	2	0	0	9	506.432	6.5e-05	Acidic fraction
4603	36	56	1	0	0	9	504.448	0.000183	Acidic fraction
4604	37	58	1	0	0	9	518.464	0.000167	Acidic fraction
4605	38	60	1	0	0	9	532.48	8.4e-05	Acidic fraction
4606	13	12	1	0	0	8	184.096	4.4e-05	Acidic fraction
4607	14	14	1	0	0	8	198.112	0.000173	Acidic fraction
4608	14	14	2	0	0	8	214.112	8.2e-05	Acidic fraction
4609	15	16	1	0	0	8	212.128	0.000625	Acidic fraction
4610	15	16	2	0	0	8	228.128	0.000209	Acidic fraction
4611	16	18	1	0	0	8	226.144	0.00134	Acidic fraction
4612	16	18	2	0	0	8	242.144	0.000522	Acidic fraction
4613	17	20	1	0	0	8	240.16	0.001687	Acidic fraction
4614	17	20	2	0	0	8	256.16	0.000663	Acidic fraction
4615	18	22	1	0	0	8	254.176	0.002175	Acidic fraction
4616	18	22	2	0	0	8	270.176	0.000953	Acidic fraction
4617	19	24	1	0	0	8	268.192	0.003428	Acidic fraction
4618	19	24	2	0	0	8	284.192	0.001173	Acidic fraction
4619	20	26	1	0	0	8	282.208	0.00342	Acidic fraction
4620	20	26	2	0	0	8	298.208	0.001422	Acidic fraction
4621	21	28	1	0	0	8	296.224	0.003952	Acidic fraction
4622	21	28	2	0	0	8	312.224	0.001658	Acidic fraction
4623	22	30	1	0	0	8	310.24	0.004712	Acidic fraction
4624	22	30	2	0	0	8	326.24	0.001908	Acidic fraction
4625	23	32	1	0	0	8	324.256	0.004849	Acidic fraction
4626	23	32	2	0	0	8	340.256	0.00176	Acidic fraction
4627	24	34	1	0	0	8	338.272	0.004659	Acidic fraction
4628	24	34	2	0	0	8	354.272	0.001812	Acidic fraction
4629	25	36	1	0	0	8	352.288	0.00466	Acidic fraction
4630	25	36	2	0	0	8	368.288	0.001622	Acidic fraction
4631	26	38	1	0	0	8	366.304	0.004335	Acidic fraction
4632	26	38	2	0	0	8	382.304	0.001362	Acidic fraction
4633	27	40	1	0	0	8	380.32	0.003973	Acidic fraction
4634	27	40	2	0	0	8	396.32	0.001065	Acidic fraction
4635	28	42	1	0	0	8	394.336	0.00335	Acidic fraction
4636	28	42	2	0	0	8	410.336	0.001096	Acidic fraction
4637	29	44	1	0	0	8	408.352	0.002804	Acidic fraction
4638	29	44	2	0	0	8	424.352	0.000813	Acidic fraction
4639	30	46	1	0	0	8	422.368	0.002175	Acidic fraction
4640	30	46	2	0	0	8	438.368	0.000617	Acidic fraction
4641	31	48	1	0	0	8	436.384	0.001653	Acidic fraction
4642	31	48	2	0	0	8	452.384	0.000414	Acidic fraction
4643	32	50	1	0	0	8	450.4	0.001179	Acidic fraction
4644	32	50	2	0	0	8	466.4	0.000252	Acidic fraction
4645	33	52	1	0	0	8	464.416	0.000813	Acidic fraction
4646	33	52	2	0	0	8	480.416	0.000139	Acidic fraction
4647	34	54	1	0	0	8	478.432	0.000581	Acidic fraction
4648	34	54	2	0	0	8	494.432	0.000103	Acidic fraction
4649	35	56	1	0	0	8	492.448	0.000391	Acidic fraction
4650	35	56	2	0	0	8	508.448	9.4e-05	Acidic fraction
4651	36	58	1	0	0	8	506.464	0.000241	Acidic fraction
4652	36	58	2	0	0	8	522.464	6.3e-05	Acidic fraction
4653	37	60	1	0	0	8	520.48	0.000157	Acidic fraction
4654	38	62	1	0	0	8	534.496	0.000109	Acidic fraction
4655	39	64	1	0	0	8	548.512	6.8e-05	Acidic fraction
4656	12	12	1	0	0	7	172.096	2e-05	Acidic fraction
4657	13	14	1	0	0	7	186.112	2.2e-05	Acidic fraction
4658	13	14	2	0	0	7	202.112	2.6e-05	Acidic fraction
4659	14	16	1	0	0	7	200.128	3.5e-05	Acidic fraction
4660	14	16	2	0	0	7	216.128	7.3e-05	Acidic fraction
4661	15	18	1	0	0	7	214.144	0.000152	Acidic fraction
4662	15	18	2	0	0	7	230.144	0.000372	Acidic fraction
4663	16	20	1	0	0	7	228.16	0.000314	Acidic fraction
4664	16	20	2	0	0	7	244.16	0.000934	Acidic fraction
4665	17	22	1	0	0	7	242.176	0.000871	Acidic fraction
4666	17	22	2	0	0	7	258.176	0.002065	Acidic fraction
4667	18	24	1	0	0	7	256.192	0.001959	Acidic fraction
4668	18	24	2	0	0	7	272.192	0.003647	Acidic fraction
4669	19	26	1	0	0	7	270.208	0.003203	Acidic fraction
4670	19	26	2	0	0	7	286.208	0.004186	Acidic fraction
4671	20	28	1	0	0	7	284.224	0.004166	Acidic fraction
4672	20	28	2	0	0	7	300.224	0.004005	Acidic fraction
4673	21	30	1	0	0	7	298.24	0.004125	Acidic fraction
4674	21	30	2	0	0	7	314.24	0.003367	Acidic fraction
4675	22	32	1	0	0	7	312.256	0.004521	Acidic fraction
4676	22	32	2	0	0	7	328.256	0.002597	Acidic fraction
4677	23	34	1	0	0	7	326.272	0.004731	Acidic fraction
4678	23	34	2	0	0	7	342.272	0.002388	Acidic fraction
4679	24	36	1	0	0	7	340.288	0.004118	Acidic fraction
4680	24	36	2	0	0	7	356.288	0.002486	Acidic fraction
4681	25	38	1	0	0	7	354.304	0.004054	Acidic fraction
4682	25	38	2	0	0	7	370.304	0.002284	Acidic fraction
4683	26	40	1	0	0	7	368.32	0.003675	Acidic fraction
4684	26	40	2	0	0	7	384.32	0.001864	Acidic fraction
4685	27	42	1	0	0	7	382.336	0.003402	Acidic fraction
4686	27	42	2	0	0	7	398.336	0.001608	Acidic fraction
4687	28	44	1	0	0	7	396.352	0.0029	Acidic fraction
4688	28	44	2	0	0	7	412.352	0.001373	Acidic fraction
4689	29	46	1	0	0	7	410.368	0.001143	Acidic fraction
4690	29	46	2	0	0	7	426.368	0.00121	Acidic fraction
4691	30	48	1	0	0	7	424.384	0.001893	Acidic fraction
4692	30	48	2	0	0	7	440.384	0.000836	Acidic fraction
4693	31	50	1	0	0	7	438.4	0.001543	Acidic fraction
4694	31	50	2	0	0	7	454.4	0.000506	Acidic fraction
4695	32	52	1	0	0	7	452.416	0.001034	Acidic fraction
4696	32	52	2	0	0	7	468.416	0.000493	Acidic fraction
4697	33	54	1	0	0	7	466.432	0.000743	Acidic fraction
4698	33	54	2	0	0	7	482.432	0.000229	Acidic fraction
4699	34	56	1	0	0	7	480.448	0.000517	Acidic fraction
4700	34	56	2	0	0	7	496.448	0.000141	Acidic fraction
4701	35	58	1	0	0	7	494.464	0.000313	Acidic fraction
4702	35	58	2	0	0	7	510.464	7.4e-05	Acidic fraction
4703	36	60	1	0	0	7	508.48	0.000151	Acidic fraction
4704	37	62	1	0	0	7	522.496	0.000141	Acidic fraction
4705	38	64	1	0	0	7	536.512	7e-05	Acidic fraction
4706	40	68	1	0	0	7	564.544	7.1e-05	Acidic fraction
4707	11	12	1	0	0	6	160.096	1.4e-05	Acidic fraction
4708	11	12	2	0	0	6	176.096	2.9e-05	Acidic fraction
4709	12	14	1	0	0	6	174.112	1.5e-05	Acidic fraction
4710	12	14	2	0	0	6	190.112	5.3e-05	Acidic fraction
4711	13	16	1	0	0	6	188.128	7.3e-05	Acidic fraction
4712	13	16	2	0	0	6	204.128	0.000175	Acidic fraction
4713	14	18	1	0	0	6	202.144	0.000307	Acidic fraction
4714	14	18	2	0	0	6	218.144	0.000485	Acidic fraction
4715	15	20	1	0	0	6	216.16	0.00117	Acidic fraction
4716	15	20	2	0	0	6	232.16	0.001035	Acidic fraction
4717	16	22	1	0	0	6	230.176	0.002382	Acidic fraction
4718	16	22	2	0	0	6	246.176	0.001941	Acidic fraction
4719	17	24	1	0	0	6	244.192	0.003505	Acidic fraction
4720	17	24	2	0	0	6	260.192	0.003423	Acidic fraction
4721	18	26	1	0	0	6	258.208	0.005751	Acidic fraction
4722	18	26	2	0	0	6	274.208	0.002118	Acidic fraction
4723	19	28	1	0	0	6	272.224	0.006647	Acidic fraction
4724	19	28	2	0	0	6	288.224	0.004333	Acidic fraction
4725	20	30	1	0	0	6	286.24	0.007464	Acidic fraction
4726	20	30	2	0	0	6	302.24	0.00449	Acidic fraction
4727	21	32	1	0	0	6	300.256	0.006386	Acidic fraction
4728	21	32	2	0	0	6	316.256	0.003816	Acidic fraction
4729	22	34	1	0	0	6	314.272	0.006428	Acidic fraction
4730	22	34	2	0	0	6	330.272	0.003994	Acidic fraction
4731	23	36	1	0	0	6	328.288	0.006327	Acidic fraction
4732	23	36	2	0	0	6	344.288	0.003706	Acidic fraction
4733	24	38	1	0	0	6	342.304	0.006029	Acidic fraction
4734	24	38	2	0	0	6	358.304	0.003879	Acidic fraction
4735	25	40	1	0	0	6	356.32	0.005991	Acidic fraction
4736	25	40	2	0	0	6	372.32	0.003181	Acidic fraction
4737	26	42	1	0	0	6	370.336	0.005615	Acidic fraction
4738	26	42	2	0	0	6	386.336	0.003096	Acidic fraction
4739	27	44	1	0	0	6	384.352	0.004965	Acidic fraction
4740	27	44	2	0	0	6	400.352	0.002595	Acidic fraction
4741	28	46	1	0	0	6	398.368	0.004124	Acidic fraction
4742	28	46	2	0	0	6	414.368	0.001945	Acidic fraction
4743	29	48	1	0	0	6	412.384	0.003424	Acidic fraction
4744	29	48	2	0	0	6	428.384	0.002174	Acidic fraction
4745	30	50	1	0	0	6	426.4	0.002692	Acidic fraction
4746	30	50	2	0	0	6	442.4	0.002136	Acidic fraction
4747	31	52	1	0	0	6	440.416	0.002029	Acidic fraction
4748	31	52	2	0	0	6	456.416	0.000941	Acidic fraction
4749	32	54	1	0	0	6	454.432	0.001474	Acidic fraction
4750	32	54	2	0	0	6	470.432	0.000617	Acidic fraction
4751	33	56	1	0	0	6	468.448	0.000998	Acidic fraction
4752	33	56	2	0	0	6	484.448	0.000347	Acidic fraction
4753	34	58	1	0	0	6	482.464	0.00061	Acidic fraction
4754	34	58	2	0	0	6	498.464	0.000152	Acidic fraction
4755	35	60	1	0	0	6	496.48	0.000471	Acidic fraction
4756	35	60	2	0	0	6	512.48	9.8e-05	Acidic fraction
4757	36	62	1	0	0	6	510.496	0.000259	Acidic fraction
4758	37	64	1	0	0	6	524.512	0.00021	Acidic fraction
4759	38	66	1	0	0	6	538.528	0.000113	Acidic fraction
4760	39	68	1	0	0	6	552.544	0.000108	Acidic fraction
4761	10	12	2	0	0	5	164.096	2.4e-05	Acidic fraction
4762	11	14	1	0	0	5	162.112	2.1e-05	Acidic fraction
4763	11	14	2	0	0	5	178.112	7.5e-05	Acidic fraction
4764	12	16	1	0	0	5	176.128	0.00016	Acidic fraction
4765	12	16	2	0	0	5	192.128	8.3e-05	Acidic fraction
4766	13	18	1	0	0	5	190.144	0.000416	Acidic fraction
4767	13	18	2	0	0	5	206.144	0.000285	Acidic fraction
4768	14	20	1	0	0	5	204.16	0.001007	Acidic fraction
4769	14	20	2	0	0	5	220.16	0.000587	Acidic fraction
4770	15	22	1	0	0	5	218.176	0.002486	Acidic fraction
4771	15	22	2	0	0	5	234.176	0.001625	Acidic fraction
4772	16	24	1	0	0	5	232.192	0.003117	Acidic fraction
4773	16	24	2	0	0	5	248.192	0.003066	Acidic fraction
4774	17	26	1	0	0	5	246.208	0.004259	Acidic fraction
4775	17	26	2	0	0	5	262.208	0.003652	Acidic fraction
4776	18	28	1	0	0	5	260.224	0.006544	Acidic fraction
4777	18	28	2	0	0	5	276.224	0.003486	Acidic fraction
4778	19	30	1	0	0	5	274.24	0.004225	Acidic fraction
4779	19	30	2	0	0	5	290.24	0.005607	Acidic fraction
4780	20	32	1	0	0	5	288.256	0.008414	Acidic fraction
4781	20	32	2	0	0	5	304.256	0.005246	Acidic fraction
4782	21	34	1	0	0	5	302.272	0.007993	Acidic fraction
4783	21	34	2	0	0	5	318.272	0.004382	Acidic fraction
4784	22	36	1	0	0	5	316.288	0.008512	Acidic fraction
4785	22	36	2	0	0	5	332.288	0.00461	Acidic fraction
4786	23	38	1	0	0	5	330.304	0.008314	Acidic fraction
4787	23	38	2	0	0	5	346.304	0.00399	Acidic fraction
4788	24	40	1	0	0	5	344.32	0.007799	Acidic fraction
4789	24	40	2	0	0	5	360.32	0.004273	Acidic fraction
4790	25	42	1	0	0	5	358.336	0.007703	Acidic fraction
4791	25	42	2	0	0	5	374.336	0.003399	Acidic fraction
4792	26	44	1	0	0	5	372.352	0.006979	Acidic fraction
4793	26	44	2	0	0	5	388.352	0.002814	Acidic fraction
4794	27	46	1	0	0	5	386.368	0.01079	Acidic fraction
4795	27	46	2	0	0	5	402.368	0.002826	Acidic fraction
4796	28	48	1	0	0	5	400.384	0.007702	Acidic fraction
4797	28	48	2	0	0	5	416.384	0.002792	Acidic fraction
4798	29	50	1	0	0	5	414.4	0.004402	Acidic fraction
4799	29	50	2	0	0	5	430.4	0.001555	Acidic fraction
4800	30	52	1	0	0	5	428.416	0.003208	Acidic fraction
4801	30	52	2	0	0	5	444.416	0.001431	Acidic fraction
4802	31	54	1	0	0	5	442.432	0.002431	Acidic fraction
4803	31	54	2	0	0	5	458.432	0.000612	Acidic fraction
4804	32	56	1	0	0	5	456.448	0.001752	Acidic fraction
4805	32	56	2	0	0	5	472.448	0.000326	Acidic fraction
4806	33	58	1	0	0	5	470.464	0.00114	Acidic fraction
4807	33	58	2	0	0	5	486.464	0.000221	Acidic fraction
4808	34	60	1	0	0	5	484.48	0.000757	Acidic fraction
4809	34	60	2	0	0	5	500.48	0.000109	Acidic fraction
4810	35	62	1	0	0	5	498.496	0.000507	Acidic fraction
4811	35	62	2	0	0	5	514.496	7e-05	Acidic fraction
4812	36	64	1	0	0	5	512.512	0.000243	Acidic fraction
4813	37	66	1	0	0	5	526.528	0.000171	Acidic fraction
4814	38	68	1	0	0	5	540.544	8.4e-05	Acidic fraction
4815	39	70	1	0	0	5	554.56	8.3e-05	Acidic fraction
4816	9	12	1	0	0	4	136.096	1.2e-05	Acidic fraction
4817	10	14	2	0	0	4	166.112	1.8e-05	Acidic fraction
4818	11	16	1	0	0	4	164.128	4.3e-05	Acidic fraction
4819	11	16	2	0	0	4	180.128	2.5e-05	Acidic fraction
4820	12	18	1	0	0	4	178.144	0.000184	Acidic fraction
4821	12	18	2	0	0	4	194.144	7.1e-05	Acidic fraction
4822	13	20	1	0	0	4	192.16	0.000371	Acidic fraction
4823	13	20	2	0	0	4	208.16	0.000643	Acidic fraction
4824	14	22	1	0	0	4	206.176	0.001998	Acidic fraction
4825	14	22	2	0	0	4	222.176	0.004884	Acidic fraction
4826	15	24	1	0	0	4	220.192	0.001796	Acidic fraction
4827	15	24	2	0	0	4	236.192	0.005355	Acidic fraction
4828	16	26	1	0	0	4	234.208	0.002736	Acidic fraction
4829	16	26	2	0	0	4	250.208	0.007832	Acidic fraction
4830	17	28	1	0	0	4	248.224	0.00466	Acidic fraction
4831	17	28	2	0	0	4	264.224	0.008494	Acidic fraction
4832	18	30	1	0	0	4	262.24	0.007198	Acidic fraction
4833	18	30	2	0	0	4	278.24	0.008459	Acidic fraction
4834	19	32	1	0	0	4	276.256	0.008305	Acidic fraction
4835	19	32	2	0	0	4	292.256	0.011266	Acidic fraction
4836	20	34	1	0	0	4	290.272	0.009738	Acidic fraction
4837	20	34	2	0	0	4	306.272	0.008374	Acidic fraction
4838	21	36	1	0	0	4	304.288	0.010304	Acidic fraction
4839	21	36	2	0	0	4	320.288	0.00738	Acidic fraction
4840	22	38	1	0	0	4	318.304	0.011587	Acidic fraction
4841	22	38	2	0	0	4	334.304	0.006444	Acidic fraction
4842	23	40	1	0	0	4	332.32	0.010692	Acidic fraction
4843	23	40	2	0	0	4	348.32	0.005979	Acidic fraction
4844	24	42	1	0	0	4	346.336	0.009611	Acidic fraction
4845	24	42	2	0	0	4	362.336	0.005616	Acidic fraction
4846	25	44	1	0	0	4	360.352	0.009233	Acidic fraction
4847	25	44	2	0	0	4	376.352	0.004521	Acidic fraction
4848	26	46	1	0	0	4	374.368	0.008196	Acidic fraction
4849	26	46	2	0	0	4	390.368	0.003619	Acidic fraction
4850	27	48	1	0	0	4	388.384	0.012008	Acidic fraction
4851	27	48	2	0	0	4	404.384	0.002753	Acidic fraction
4852	28	50	1	0	0	4	402.4	0.008666	Acidic fraction
4853	28	50	2	0	0	4	418.4	0.002045	Acidic fraction
4854	29	52	1	0	0	4	416.416	0.004974	Acidic fraction
4855	29	52	2	0	0	4	432.416	0.001551	Acidic fraction
4856	30	54	1	0	0	4	430.432	0.003297	Acidic fraction
4857	30	54	2	0	0	4	446.432	0.001018	Acidic fraction
4858	31	56	1	0	0	4	444.448	0.002508	Acidic fraction
4859	31	56	2	0	0	4	460.448	0.000668	Acidic fraction
4860	32	58	1	0	0	4	458.464	0.001694	Acidic fraction
4861	32	58	2	0	0	4	474.464	0.000479	Acidic fraction
4862	33	60	1	0	0	4	472.48	0.001205	Acidic fraction
4863	33	60	2	0	0	4	488.48	0.000236	Acidic fraction
4864	34	62	1	0	0	4	486.496	0.000723	Acidic fraction
4865	34	62	2	0	0	4	502.496	0.000172	Acidic fraction
4866	35	64	1	0	0	4	500.512	0.000418	Acidic fraction
4867	35	64	2	0	0	4	516.512	9.7e-05	Acidic fraction
4868	36	66	1	0	0	4	514.528	0.000246	Acidic fraction
4869	37	68	1	0	0	4	528.544	0.000162	Acidic fraction
4870	38	70	1	0	0	4	542.56	0.000128	Acidic fraction
4871	10	16	2	0	0	3	168.128	4.8e-05	Acidic fraction
4872	11	18	2	0	0	3	182.144	0.00014	Acidic fraction
4873	12	20	2	0	0	3	196.16	0.000576	Acidic fraction
4874	13	22	2	0	0	3	210.176	0.002704	Acidic fraction
4875	14	24	2	0	0	3	224.192	0.006242	Acidic fraction
4876	15	26	2	0	0	3	238.208	0.010208	Acidic fraction
4877	16	28	2	0	0	3	252.224	0.013868	Acidic fraction
4878	17	30	2	0	0	3	266.24	0.015548	Acidic fraction
4879	18	32	2	0	0	3	280.256	0.018637	Acidic fraction
4880	19	34	2	0	0	3	294.272	0.017275	Acidic fraction
4881	20	36	2	0	0	3	308.288	0.019417	Acidic fraction
4882	21	38	2	0	0	3	322.304	0.016788	Acidic fraction
4883	22	40	2	0	0	3	336.32	0.015335	Acidic fraction
4884	23	42	2	0	0	3	350.336	0.013932	Acidic fraction
4885	24	44	2	0	0	3	364.352	0.011928	Acidic fraction
4886	25	46	2	0	0	3	378.368	0.009576	Acidic fraction
4887	26	48	2	0	0	3	392.384	0.007516	Acidic fraction
4888	27	50	2	0	0	3	406.4	0.005646	Acidic fraction
4889	28	52	2	0	0	3	420.416	0.004063	Acidic fraction
4890	29	54	2	0	0	3	434.432	0.002877	Acidic fraction
4891	30	56	2	0	0	3	448.448	0.001848	Acidic fraction
4892	31	58	2	0	0	3	462.464	0.001106	Acidic fraction
4893	32	60	2	0	0	3	476.48	0.000712	Acidic fraction
4894	33	62	2	0	0	3	490.496	0.000412	Acidic fraction
4895	34	64	2	0	0	3	504.512	0.00023	Acidic fraction
4896	35	66	2	0	0	3	518.528	0.00013	Acidic fraction
4897	36	68	2	0	0	3	532.544	7.4e-05	Acidic fraction
4898	37	70	2	0	0	3	546.56	6.2e-05	Acidic fraction
4899	7	12	2	0	0	2	128.096	1.1e-05	Acidic fraction
4900	9	16	2	0	0	2	156.128	1.8e-05	Acidic fraction
4901	10	18	2	0	0	2	170.144	8.4e-05	Acidic fraction
4902	11	20	2	0	0	2	184.16	0.000317	Acidic fraction
4903	12	22	2	0	0	2	198.176	0.000734	Acidic fraction
4904	13	24	2	0	0	2	212.192	0.001952	Acidic fraction
4905	14	26	2	0	0	2	226.208	0.004055	Acidic fraction
4906	15	28	1	0	0	2	224.224	2.6e-05	Acidic fraction
4907	15	28	2	0	0	2	240.224	0.006	Acidic fraction
4908	16	30	1	0	0	2	238.24	3.1e-05	Acidic fraction
4909	16	30	2	0	0	2	254.24	0.011492	Acidic fraction
4910	17	32	1	0	0	2	252.256	4.5e-05	Acidic fraction
4911	17	32	2	0	0	2	268.256	0.016499	Acidic fraction
4912	18	34	1	0	0	2	266.272	3.3e-05	Acidic fraction
4913	18	34	2	0	0	2	282.272	0.02284	Acidic fraction
4914	19	36	2	0	0	2	296.288	0.021007	Acidic fraction
4915	20	38	2	0	0	2	310.304	0.02569	Acidic fraction
4916	21	40	1	0	0	2	308.32	4.1e-05	Acidic fraction
4917	21	40	2	0	0	2	324.32	0.023542	Acidic fraction
4918	22	42	2	0	0	2	338.336	0.020619	Acidic fraction
4919	23	44	2	0	0	2	352.352	0.019163	Acidic fraction
4920	24	46	2	0	0	2	366.368	0.015783	Acidic fraction
4921	25	48	2	0	0	2	380.384	0.012221	Acidic fraction
4922	26	50	2	0	0	2	394.4	0.009611	Acidic fraction
4923	27	52	2	0	0	2	408.416	0.006931	Acidic fraction
4924	28	54	2	0	0	2	422.432	0.004764	Acidic fraction
4925	29	56	2	0	0	2	436.448	0.003306	Acidic fraction
4926	30	58	2	0	0	2	450.464	0.00214	Acidic fraction
4927	31	60	2	0	0	2	464.48	0.001233	Acidic fraction
4928	32	62	2	0	0	2	478.496	0.000663	Acidic fraction
4929	33	64	2	0	0	2	492.512	0.000416	Acidic fraction
4930	34	66	2	0	0	2	506.528	0.000251	Acidic fraction
4931	35	68	2	0	0	2	520.544	0.000116	Acidic fraction
4932	36	70	2	0	0	2	534.56	6.8e-05	Acidic fraction
4933	8	16	2	0	0	1	144.128	1.7e-05	Acidic fraction
4934	9	18	2	0	0	1	158.144	0.000197	Acidic fraction
4935	10	20	2	0	0	1	172.16	0.000136	Acidic fraction
4936	11	22	2	0	0	1	186.176	0.000165	Acidic fraction
4937	12	24	2	0	0	1	200.192	0.000621	Acidic fraction
4938	13	26	2	0	0	1	214.208	0.000615	Acidic fraction
4939	14	28	2	0	0	1	228.224	0.003776	Acidic fraction
4940	15	30	1	0	0	1	226.24	3.3e-05	Acidic fraction
4941	15	30	2	0	0	1	242.24	0.003724	Acidic fraction
4942	16	32	1	0	0	1	240.256	4.4e-05	Acidic fraction
4943	16	32	2	0	0	1	256.256	0.059424	Acidic fraction
4944	17	34	1	0	0	1	254.272	3.9e-05	Acidic fraction
4945	17	34	2	0	0	1	270.272	0.004809	Acidic fraction
4946	18	36	1	0	0	1	268.288	6e-05	Acidic fraction
4947	18	36	2	0	0	1	284.288	0.037716	Acidic fraction
4948	19	38	1	0	0	1	282.304	4e-05	Acidic fraction
4949	19	38	2	0	0	1	298.304	0.00437	Acidic fraction
4950	20	40	1	0	0	1	296.32	4.9e-05	Acidic fraction
4951	20	40	2	0	0	1	312.32	0.005951	Acidic fraction
4952	21	42	1	0	0	1	310.336	7e-05	Acidic fraction
4953	21	42	2	0	0	1	326.336	0.005189	Acidic fraction
4954	22	44	1	0	0	1	324.352	5.1e-05	Acidic fraction
4955	22	44	2	0	0	1	340.352	0.005076	Acidic fraction
4956	23	46	1	0	0	1	338.368	5.7e-05	Acidic fraction
4957	23	46	2	0	0	1	354.368	0.004634	Acidic fraction
4958	24	48	2	0	0	1	368.384	0.004899	Acidic fraction
4959	25	50	2	0	0	1	382.4	0.003798	Acidic fraction
4960	26	52	2	0	0	1	396.416	0.003429	Acidic fraction
4961	27	54	2	0	0	1	410.432	0.000883	Acidic fraction
4962	28	56	2	0	0	1	424.448	0.00213	Acidic fraction
4963	29	58	2	0	0	1	438.464	0.001174	Acidic fraction
4964	30	60	2	0	0	1	452.48	0.001189	Acidic fraction
4965	31	62	2	0	0	1	466.496	0.000468	Acidic fraction
4966	32	64	2	0	0	1	480.512	0.000372	Acidic fraction
4967	33	66	2	0	0	1	494.528	0.000181	Acidic fraction
4968	34	68	2	0	0	1	508.544	8.4e-05	Acidic fraction