hy_17_formula

id	C	H	O	N	S	DBE	molecular_weight	mass fraction_wtpct	compound type
1	15	10	0	0	0	11	190.08	7.8e-05	Saturates
2	16	10	0	0	0	12	202.08	3.1e-05	Saturates
3	18	10	0	0	0	14	226.08	3.4e-05	Saturates
4	21	10	0	0	0	17	262.08	3.4e-05	Saturates
5	27	10	0	0	0	23	334.08	5.7e-05	Saturates
6	29	10	0	0	0	25	358.08	0.000333	Saturates
7	40	10	0	0	0	36	490.08	0.000164	Saturates
8	14	12	0	0	0	9	180.096	0.001089	Saturates
9	15	12	0	0	0	10	192.096	0.000239	Saturates
10	16	12	0	0	0	11	204.096	0.000552	Saturates
11	17	12	0	0	0	12	216.096	3.7e-05	Saturates
12	24	12	0	0	0	19	300.096	0.000224	Saturates
13	32	12	0	0	0	27	396.096	8e-05	Saturates
14	35	12	0	0	0	30	432.096	0.01509	Saturates
15	44	12	0	0	0	39	540.096	0.000102	Saturates
16	50	12	0	0	0	45	612.096	0.000116	Saturates
17	13	14	0	0	0	7	170.112	0.000175	Saturates
18	14	14	0	0	0	8	182.112	0.001349	Saturates
19	15	14	0	0	0	9	194.112	0.009014	Saturates
20	17	14	0	0	0	11	218.112	0.000548	Saturates
21	18	14	0	0	0	12	230.112	0.000363	Saturates
22	19	14	0	0	0	13	242.112	0.001207	Saturates
23	25	14	0	0	0	19	314.112	6e-05	Saturates
24	30	14	0	0	0	24	374.112	6e-05	Saturates
25	45	14	0	0	0	39	554.112	9e-05	Saturates
26	12	16	0	0	0	5	160.128	2e-05	Saturates
27	13	16	0	0	0	6	172.128	0.000721	Saturates
28	14	16	0	0	0	7	184.128	0.003872	Saturates
29	15	16	0	0	0	8	196.128	0.011818	Saturates
30	16	16	0	0	0	9	208.128	0.016614	Saturates
31	17	16	0	0	0	10	220.128	0.001659	Saturates
32	18	16	0	0	0	11	232.128	0.003026	Saturates
33	19	16	0	0	0	12	244.128	0.000707	Saturates
34	20	16	0	0	0	13	256.128	0.000173	Saturates
35	22	16	0	0	0	15	280.128	5.2e-05	Saturates
36	36	16	0	0	0	29	448.128	0.100346	Saturates
37	12	18	0	0	0	4	162.144	0.001048	Saturates
38	13	18	0	0	0	5	174.144	0.00668	Saturates
39	14	18	0	0	0	6	186.144	0.007165	Saturates
40	15	18	0	0	0	7	198.144	0.007702	Saturates
41	16	18	0	0	0	8	210.144	0.040825	Saturates
42	17	18	0	0	0	9	222.144	0.015837	Saturates
43	18	18	0	0	0	10	234.144	0.002903	Saturates
44	19	18	0	0	0	11	246.144	0.003742	Saturates
45	20	18	0	0	0	12	258.144	7.4e-05	Saturates
46	21	18	0	0	0	13	270.144	6.5e-05	Saturates
47	26	18	0	0	0	18	330.144	5.4e-05	Saturates
48	38	18	0	0	0	30	474.144	0.0001	Saturates
49	43	18	0	0	0	35	534.144	8.3e-05	Saturates
50	51	18	0	0	0	43	630.144	0.000124	Saturates
51	11	20	0	0	0	2	152.16	0.035198	Saturates
52	12	20	0	0	0	3	164.16	0.065521	Saturates
53	13	20	0	0	0	4	176.16	0.132072	Saturates
54	14	20	0	0	0	5	188.16	0.056549	Saturates
55	15	20	0	0	0	6	200.16	0.014069	Saturates
56	16	20	0	0	0	7	212.16	0.015496	Saturates
57	17	20	0	0	0	8	224.16	0.016648	Saturates
58	18	20	0	0	0	9	236.16	0.012792	Saturates
59	19	20	0	0	0	10	248.16	0.005286	Saturates
60	20	20	0	0	0	11	260.16	0.002976	Saturates
61	21	20	0	0	0	12	272.16	0.000111	Saturates
62	22	20	0	0	0	13	284.16	5e-05	Saturates
63	24	20	0	0	0	15	308.16	6.6e-05	Saturates
64	37	20	0	0	0	28	464.16	0.00088	Saturates
65	38	20	0	0	0	29	476.16	9.2e-05	Saturates
66	46	20	0	0	0	37	572.16	0.001485	Saturates
67	11	22	0	0	0	1	154.176	0.029981	Saturates
68	12	22	0	0	0	2	166.176	0.109512	Saturates
69	13	22	0	0	0	3	178.176	0.849478	Saturates
70	14	22	0	0	0	4	190.176	0.611173	Saturates
71	15	22	0	0	0	5	202.176	0.167858	Saturates
72	16	22	0	0	0	6	214.176	0.030632	Saturates
73	17	22	0	0	0	7	226.176	0.022427	Saturates
74	18	22	0	0	0	8	238.176	0.018259	Saturates
75	19	22	0	0	0	9	250.176	0.010455	Saturates
76	20	22	0	0	0	10	262.176	0.003491	Saturates
77	21	22	0	0	0	11	274.176	0.001066	Saturates
78	22	22	0	0	0	12	286.176	5.9e-05	Saturates
79	23	22	0	0	0	13	298.176	4.6e-05	Saturates
80	39	22	0	0	0	29	490.176	0.001143	Saturates
81	43	22	0	0	0	33	538.176	0.002642	Saturates
82	44	22	0	0	0	34	550.176	0.004211	Saturates
83	52	22	0	0	0	42	646.176	0.000713	Saturates
84	11	24	0	0	0	0	156.192	0.009439	Saturates
85	12	24	0	0	0	1	168.192	0.045998	Saturates
86	13	24	0	0	0	2	180.192	0.6084	Saturates
87	14	24	0	0	0	3	192.192	1.85264	Saturates
88	15	24	0	0	0	4	204.192	1.11949	Saturates
89	16	24	0	0	0	5	216.192	0.356977	Saturates
90	17	24	0	0	0	6	228.192	0.091846	Saturates
91	18	24	0	0	0	7	240.192	0.040472	Saturates
92	19	24	0	0	0	8	252.192	0.020989	Saturates
93	20	24	0	0	0	9	264.192	0.008237	Saturates
94	21	24	0	0	0	10	276.192	0.001913	Saturates
95	22	24	0	0	0	11	288.192	0.000416	Saturates
96	23	24	0	0	0	12	300.192	5.2e-05	Saturates
97	40	24	0	0	0	29	504.192	0.000121	Saturates
98	45	24	0	0	0	34	564.192	0.009691	Saturates
99	50	24	0	0	0	39	624.192	0.000123	Saturates
100	54	24	0	0	0	43	672.192	0.005186	Saturates
101	58	24	0	0	0	47	720.192	0.00038	Saturates
102	12	26	0	0	0	0	170.208	0.022736	Saturates
103	13	26	0	0	0	1	182.208	0.095501	Saturates
104	14	26	0	0	0	2	194.208	0.85919	Saturates
105	15	26	0	0	0	3	206.208	1.70151	Saturates
106	16	26	0	0	0	4	218.208	1.51283	Saturates
107	17	26	0	0	0	5	230.208	0.596251	Saturates
108	18	26	0	0	0	6	242.208	0.187933	Saturates
109	19	26	0	0	0	7	254.208	0.059094	Saturates
110	20	26	0	0	0	8	266.208	0.022362	Saturates
111	21	26	0	0	0	9	278.208	0.006506	Saturates
112	22	26	0	0	0	10	290.208	0.001757	Saturates
113	23	26	0	0	0	11	302.208	0.000135	Saturates
114	24	26	0	0	0	12	314.208	6.3e-05	Saturates
115	26	26	0	0	0	14	338.208	8e-05	Saturates
116	41	26	0	0	0	29	518.208	0.000377	Saturates
117	46	26	0	0	0	34	578.208	0.008377	Saturates
118	57	26	0	0	0	45	710.208	0.000123	Saturates
119	60	26	0	0	0	48	746.208	0.007408	Saturates
120	13	28	0	0	0	0	184.224	0.0698	Saturates
121	14	28	0	0	0	1	196.224	0.114823	Saturates
122	15	28	0	0	0	2	208.224	0.786239	Saturates
123	16	28	0	0	0	3	220.224	1.71837	Saturates
124	17	28	0	0	0	4	232.224	1.59848	Saturates
125	18	28	0	0	0	5	244.224	0.84155	Saturates
126	19	28	0	0	0	6	256.224	0.295508	Saturates
127	20	28	0	0	0	7	268.224	0.092351	Saturates
128	21	28	0	0	0	8	280.224	0.022928	Saturates
129	22	28	0	0	0	9	292.224	0.007907	Saturates
130	23	28	0	0	0	10	304.224	0.000583	Saturates
131	24	28	0	0	0	11	316.224	0.000308	Saturates
132	25	28	0	0	0	12	328.224	6.4e-05	Saturates
133	42	28	0	0	0	29	532.224	0.000119	Saturates
134	43	28	0	0	0	30	544.224	0.000118	Saturates
135	47	28	0	0	0	34	592.224	0.010262	Saturates
136	61	28	0	0	0	48	760.224	0.000177	Saturates
137	14	30	0	0	0	0	198.24	0.094379	Saturates
138	15	30	0	0	0	1	210.24	0.119468	Saturates
139	16	30	0	0	0	2	222.24	0.624326	Saturates
140	17	30	0	0	0	3	234.24	1.56693	Saturates
141	18	30	0	0	0	4	246.24	1.6352	Saturates
142	19	30	0	0	0	5	258.24	0.990415	Saturates
143	20	30	0	0	0	6	270.24	0.381281	Saturates
144	21	30	0	0	0	7	282.24	0.113929	Saturates
145	22	30	0	0	0	8	294.24	0.027847	Saturates
146	23	30	0	0	0	9	306.24	0.008354	Saturates
147	24	30	0	0	0	10	318.24	0.001052	Saturates
148	25	30	0	0	0	11	330.24	0.000253	Saturates
149	48	30	0	0	0	34	606.24	0.006114	Saturates
150	59	30	0	0	0	45	738.24	0.00013	Saturates
151	60	30	0	0	0	46	750.24	0.000116	Saturates
152	15	32	0	0	0	0	212.256	0.105987	Saturates
153	16	32	0	0	0	1	224.256	0.114584	Saturates
154	17	32	0	0	0	2	236.256	0.490524	Saturates
155	18	32	0	0	0	3	248.256	1.50383	Saturates
156	19	32	0	0	0	4	260.256	1.80744	Saturates
157	20	32	0	0	0	5	272.256	0.952196	Saturates
158	21	32	0	0	0	6	284.256	0.408707	Saturates
159	22	32	0	0	0	7	296.256	0.133339	Saturates
160	23	32	0	0	0	8	308.256	0.033524	Saturates
161	24	32	0	0	0	9	320.256	0.00948	Saturates
162	25	32	0	0	0	10	332.256	0.001114	Saturates
163	26	32	0	0	0	11	344.256	0.00049	Saturates
164	27	32	0	0	0	12	356.256	9.4e-05	Saturates
165	39	32	0	0	0	24	500.256	7.5e-05	Saturates
166	48	32	0	0	0	33	608.256	9.8e-05	Saturates
167	49	32	0	0	0	34	620.256	0.002864	Saturates
168	52	32	0	0	0	37	656.256	0.000122	Saturates
169	54	32	0	0	0	39	680.256	0.000127	Saturates
170	58	32	0	0	0	43	728.256	0.000145	Saturates
171	62	32	0	0	0	47	776.256	0.000193	Saturates
172	16	34	0	0	0	0	226.272	0.110952	Saturates
173	17	34	0	0	0	1	238.272	0.111486	Saturates
174	18	34	0	0	0	2	250.272	0.469565	Saturates
175	19	34	0	0	0	3	262.272	1.38059	Saturates
176	20	34	0	0	0	4	274.272	1.60641	Saturates
177	21	34	0	0	0	5	286.272	0.870402	Saturates
178	22	34	0	0	0	6	298.272	0.397603	Saturates
179	23	34	0	0	0	7	310.272	0.14046	Saturates
180	24	34	0	0	0	8	322.272	0.043437	Saturates
181	25	34	0	0	0	9	334.272	0.011136	Saturates
182	26	34	0	0	0	10	346.272	0.001736	Saturates
183	27	34	0	0	0	11	358.272	0.00039	Saturates
184	29	34	0	0	0	13	382.272	7.4e-05	Saturates
185	30	34	0	0	0	14	394.272	7.3e-05	Saturates
186	34	34	0	0	0	18	442.272	0.000165	Saturates
187	48	34	0	0	0	32	610.272	0.000133	Saturates
188	62	34	0	0	0	46	778.272	0.000154	Saturates
189	17	36	0	0	0	0	240.288	0.110787	Saturates
190	18	36	0	0	0	1	252.288	0.103708	Saturates
191	19	36	0	0	0	2	264.288	0.463428	Saturates
192	20	36	0	0	0	3	276.288	1.07061	Saturates
193	21	36	0	0	0	4	288.288	1.66124	Saturates
194	22	36	0	0	0	5	300.288	0.791021	Saturates
195	23	36	0	0	0	6	312.288	0.345705	Saturates
196	24	36	0	0	0	7	324.288	0.148463	Saturates
197	25	36	0	0	0	8	336.288	0.048865	Saturates
198	26	36	0	0	0	9	348.288	0.013155	Saturates
199	27	36	0	0	0	10	360.288	0.002897	Saturates
200	38	36	0	0	0	21	492.288	8e-05	Saturates
201	56	36	0	0	0	39	708.288	0.000133	Saturates
202	60	36	0	0	0	43	756.288	0.000198	Saturates
203	18	38	0	0	0	0	254.304	0.108753	Saturates
204	19	38	0	0	0	1	266.304	0.094728	Saturates
205	20	38	0	0	0	2	278.304	0.414943	Saturates
206	21	38	0	0	0	3	290.304	0.85002	Saturates
207	22	38	0	0	0	4	302.304	1.7293	Saturates
208	23	38	0	0	0	5	314.304	0.690913	Saturates
209	24	38	0	0	0	6	326.304	0.348069	Saturates
210	25	38	0	0	0	7	338.304	0.148926	Saturates
211	26	38	0	0	0	8	350.304	0.054953	Saturates
212	27	38	0	0	0	9	362.304	0.013068	Saturates
213	28	38	0	0	0	10	374.304	0.003019	Saturates
214	29	38	0	0	0	11	386.304	0.000631	Saturates
215	32	38	0	0	0	14	422.304	6e-05	Saturates
216	19	40	0	0	0	0	268.32	0.098786	Saturates
217	20	40	0	0	0	1	280.32	0.081259	Saturates
218	21	40	0	0	0	2	292.32	0.34863	Saturates
219	22	40	0	0	0	3	304.32	0.644567	Saturates
220	23	40	0	0	0	4	316.32	1.25186	Saturates
221	24	40	0	0	0	5	328.32	0.688805	Saturates
222	25	40	0	0	0	6	340.32	0.346612	Saturates
223	26	40	0	0	0	7	352.32	0.152081	Saturates
224	27	40	0	0	0	8	364.32	0.053974	Saturates
225	28	40	0	0	0	9	376.32	0.017085	Saturates
226	29	40	0	0	0	10	388.32	0.002316	Saturates
227	30	40	0	0	0	11	400.32	0.000188	Saturates
228	34	40	0	0	0	15	448.32	9.8e-05	Saturates
229	41	40	0	0	0	22	532.32	0.000152	Saturates
230	45	40	0	0	0	26	580.32	0.000109	Saturates
231	20	42	0	0	0	0	282.336	0.089254	Saturates
232	21	42	0	0	0	1	294.336	0.072549	Saturates
233	22	42	0	0	0	2	306.336	0.272648	Saturates
234	23	42	0	0	0	3	318.336	0.536574	Saturates
235	24	42	0	0	0	4	330.336	0.976801	Saturates
236	25	42	0	0	0	5	342.336	0.665805	Saturates
237	26	42	0	0	0	6	354.336	0.374078	Saturates
238	27	42	0	0	0	7	366.336	0.173921	Saturates
239	28	42	0	0	0	8	378.336	0.050653	Saturates
240	29	42	0	0	0	9	390.336	0.016374	Saturates
241	30	42	0	0	0	10	402.336	0.002923	Saturates
242	31	42	0	0	0	11	414.336	9.5e-05	Saturates
243	36	42	0	0	0	16	474.336	9e-05	Saturates
244	21	44	0	0	0	0	296.352	0.08442	Saturates
245	22	44	0	0	0	1	308.352	0.064454	Saturates
246	23	44	0	0	0	2	320.352	0.231393	Saturates
247	24	44	0	0	0	3	332.352	0.485344	Saturates
248	25	44	0	0	0	4	344.352	0.762767	Saturates
249	26	44	0	0	0	5	356.352	0.870956	Saturates
250	27	44	0	0	0	6	368.352	0.483691	Saturates
251	28	44	0	0	0	7	380.352	0.155887	Saturates
252	29	44	0	0	0	8	392.352	0.05612	Saturates
253	30	44	0	0	0	9	404.352	0.018302	Saturates
254	31	44	0	0	0	10	416.352	0.003991	Saturates
255	32	44	0	0	0	11	428.352	0.000152	Saturates
256	33	44	0	0	0	12	440.352	6.9e-05	Saturates
257	35	44	0	0	0	14	464.352	6.4e-05	Saturates
258	41	44	0	0	0	20	536.352	0.000103	Saturates
259	55	44	0	0	0	34	704.352	0.000118	Saturates
260	22	46	0	0	0	0	310.368	0.082397	Saturates
261	23	46	0	0	0	1	322.368	0.061502	Saturates
262	24	46	0	0	0	2	334.368	0.211677	Saturates
263	25	46	0	0	0	3	346.368	0.421929	Saturates
264	26	46	0	0	0	4	358.368	0.760839	Saturates
265	27	46	0	0	0	5	370.368	1.49817	Saturates
266	28	46	0	0	0	6	382.368	0.39447	Saturates
267	29	46	0	0	0	7	394.368	0.170198	Saturates
268	30	46	0	0	0	8	406.368	0.05647	Saturates
269	31	46	0	0	0	9	418.368	0.018295	Saturates
270	32	46	0	0	0	10	430.368	0.004642	Saturates
271	36	46	0	0	0	14	478.368	0.004014	Saturates
272	47	46	0	0	0	25	610.368	0.000109	Saturates
273	57	46	0	0	0	35	730.368	0.000137	Saturates
274	23	48	0	0	0	0	324.384	0.083002	Saturates
275	24	48	0	0	0	1	336.384	0.054226	Saturates
276	25	48	0	0	0	2	348.384	0.184877	Saturates
277	26	48	0	0	0	3	360.384	0.379968	Saturates
278	27	48	0	0	0	4	372.384	1.31251	Saturates
279	28	48	0	0	0	5	384.384	1.07341	Saturates
280	29	48	0	0	0	6	396.384	0.548938	Saturates
281	30	48	0	0	0	7	408.384	0.18514	Saturates
282	31	48	0	0	0	8	420.384	0.054	Saturates
283	32	48	0	0	0	9	432.384	0.017127	Saturates
284	33	48	0	0	0	10	444.384	0.001144	Saturates
285	35	48	0	0	0	12	468.384	0.000196	Saturates
286	44	48	0	0	0	21	576.384	9.5e-05	Saturates
287	50	48	0	0	0	27	648.384	0.000217	Saturates
288	54	48	0	0	0	31	696.384	0.000144	Saturates
289	24	50	0	0	0	0	338.4	0.083427	Saturates
290	25	50	0	0	0	1	350.4	0.04383	Saturates
291	26	50	0	0	0	2	362.4	0.15466	Saturates
292	27	50	0	0	0	3	374.4	0.359472	Saturates
293	28	50	0	0	0	4	386.4	1.35038	Saturates
294	29	50	0	0	0	5	398.4	2.50116	Saturates
295	30	50	0	0	0	6	410.4	0.627898	Saturates
296	31	50	0	0	0	7	422.4	0.151427	Saturates
297	32	50	0	0	0	8	434.4	0.045074	Saturates
298	33	50	0	0	0	9	446.4	0.014609	Saturates
299	34	50	0	0	0	10	458.4	0.004317	Saturates
300	35	50	0	0	0	11	470.4	0.00022	Saturates
301	58	50	0	0	0	34	746.4	0.000166	Saturates
302	60	50	0	0	0	36	770.4	0.00029	Saturates
303	25	52	0	0	0	0	352.416	0.075557	Saturates
304	26	52	0	0	0	1	364.416	0.039587	Saturates
305	27	52	0	0	0	2	376.416	0.137741	Saturates
306	28	52	0	0	0	3	388.416	0.331483	Saturates
307	29	52	0	0	0	4	400.416	1.5814	Saturates
308	30	52	0	0	0	5	412.416	3.09227	Saturates
309	31	52	0	0	0	6	424.416	0.482908	Saturates
310	32	52	0	0	0	7	436.416	0.131166	Saturates
311	33	52	0	0	0	8	448.416	0.041219	Saturates
312	34	52	0	0	0	9	460.416	0.010768	Saturates
313	35	52	0	0	0	10	472.416	0.002787	Saturates
314	43	52	0	0	0	18	568.416	0.000101	Saturates
315	60	52	0	0	0	35	772.416	0.000149	Saturates
316	26	54	0	0	0	0	366.432	0.065033	Saturates
317	27	54	0	0	0	1	378.432	0.0334	Saturates
318	28	54	0	0	0	2	390.432	0.118549	Saturates
319	29	54	0	0	0	3	402.432	0.318446	Saturates
320	30	54	0	0	0	4	414.432	1.40312	Saturates
321	31	54	0	0	0	5	426.432	1.81265	Saturates
322	32	54	0	0	0	6	438.432	0.366034	Saturates
323	33	54	0	0	0	7	450.432	0.135912	Saturates
324	34	54	0	0	0	8	462.432	0.037274	Saturates
325	35	54	0	0	0	9	474.432	0.011797	Saturates
326	36	54	0	0	0	10	486.432	0.001564	Saturates
327	38	54	0	0	0	12	510.432	9.7e-05	Saturates
328	39	54	0	0	0	13	522.432	9.2e-05	Saturates
329	48	54	0	0	0	22	630.432	0.000106	Saturates
330	54	54	0	0	0	28	702.432	0.000128	Saturates
331	55	54	0	0	0	29	714.432	0.000131	Saturates
332	27	56	0	0	0	0	380.448	0.052299	Saturates
333	28	56	0	0	0	1	392.448	0.032494	Saturates
334	29	56	0	0	0	2	404.448	0.101027	Saturates
335	30	56	0	0	0	3	416.448	0.293339	Saturates
336	31	56	0	0	0	4	428.448	0.70559	Saturates
337	32	56	0	0	0	5	440.448	1.23223	Saturates
338	33	56	0	0	0	6	452.448	0.273889	Saturates
339	34	56	0	0	0	7	464.448	0.088532	Saturates
340	35	56	0	0	0	8	476.448	0.026926	Saturates
341	36	56	0	0	0	9	488.448	0.007644	Saturates
342	37	56	0	0	0	10	500.448	0.000572	Saturates
343	48	56	0	0	0	21	632.448	0.000122	Saturates
344	52	56	0	0	0	25	680.448	0.000123	Saturates
345	53	56	0	0	0	26	692.448	0.000115	Saturates
346	28	58	0	0	0	0	394.464	0.044926	Saturates
347	29	58	0	0	0	1	406.464	0.031055	Saturates
348	30	58	0	0	0	2	418.464	0.087965	Saturates
349	31	58	0	0	0	3	430.464	0.21739	Saturates
350	32	58	0	0	0	4	442.464	0.445527	Saturates
351	33	58	0	0	0	5	454.464	0.827621	Saturates
352	34	58	0	0	0	6	466.464	0.188416	Saturates
353	35	58	0	0	0	7	478.464	0.06528	Saturates
354	36	58	0	0	0	8	490.464	0.024398	Saturates
355	37	58	0	0	0	9	502.464	0.007357	Saturates
356	38	58	0	0	0	10	514.464	0.000755	Saturates
357	40	58	0	0	0	12	538.464	0.000112	Saturates
358	29	60	0	0	0	0	408.48	0.045176	Saturates
359	30	60	0	0	0	1	420.48	0.029133	Saturates
360	31	60	0	0	0	2	432.48	0.07459	Saturates
361	32	60	0	0	0	3	444.48	0.158272	Saturates
362	33	60	0	0	0	4	456.48	0.319873	Saturates
363	34	60	0	0	0	5	468.48	0.515999	Saturates
364	35	60	0	0	0	6	480.48	0.139451	Saturates
365	36	60	0	0	0	7	492.48	0.046384	Saturates
366	37	60	0	0	0	8	504.48	0.018841	Saturates
367	38	60	0	0	0	9	516.48	0.00644	Saturates
368	39	60	0	0	0	10	528.48	0.000274	Saturates
369	40	60	0	0	0	11	540.48	0.000106	Saturates
370	49	60	0	0	0	20	648.48	0.002855	Saturates
371	30	62	0	0	0	0	422.496	0.039863	Saturates
372	31	62	0	0	0	1	434.496	0.023708	Saturates
373	32	62	0	0	0	2	446.496	0.05564	Saturates
374	33	62	0	0	0	3	458.496	0.144163	Saturates
375	34	62	0	0	0	4	470.496	0.208495	Saturates
376	35	62	0	0	0	5	482.496	0.304043	Saturates
377	36	62	0	0	0	6	494.496	0.10234	Saturates
378	37	62	0	0	0	7	506.496	0.033776	Saturates
379	38	62	0	0	0	8	518.496	0.013181	Saturates
380	39	62	0	0	0	9	530.496	0.003235	Saturates
381	40	62	0	0	0	10	542.496	0.001353	Saturates
382	43	62	0	0	0	13	578.496	0.000218	Saturates
383	48	62	0	0	0	18	638.496	0.000114	Saturates
384	31	64	0	0	0	0	436.512	0.039321	Saturates
385	32	64	0	0	0	1	448.512	0.019618	Saturates
386	33	64	0	0	0	2	460.512	0.049604	Saturates
387	34	64	0	0	0	3	472.512	0.10792	Saturates
388	35	64	0	0	0	4	484.512	0.142916	Saturates
389	36	64	0	0	0	5	496.512	0.172879	Saturates
390	37	64	0	0	0	6	508.512	0.075245	Saturates
391	38	64	0	0	0	7	520.512	0.023144	Saturates
392	39	64	0	0	0	8	532.512	0.011266	Saturates
393	40	64	0	0	0	9	544.512	0.006652	Saturates
394	41	64	0	0	0	10	556.512	0.000302	Saturates
395	58	64	0	0	0	27	760.512	0.000289	Saturates
396	59	64	0	0	0	28	772.512	0.000119	Saturates
397	32	66	0	0	0	0	450.528	0.032363	Saturates
398	33	66	0	0	0	1	462.528	0.014522	Saturates
399	34	66	0	0	0	2	474.528	0.039771	Saturates
400	35	66	0	0	0	3	486.528	0.079904	Saturates
401	36	66	0	0	0	4	498.528	0.094333	Saturates
402	37	66	0	0	0	5	510.528	0.08464	Saturates
403	38	66	0	0	0	6	522.528	0.053791	Saturates
404	39	66	0	0	0	7	534.528	0.019849	Saturates
405	40	66	0	0	0	8	546.528	0.018187	Saturates
406	41	66	0	0	0	9	558.528	0.00047	Saturates
407	42	66	0	0	0	10	570.528	0.000112	Saturates
408	43	66	0	0	0	11	582.528	0.000214	Saturates
409	46	66	0	0	0	14	618.528	0.000117	Saturates
410	52	66	0	0	0	20	690.528	0.00013	Saturates
411	53	66	0	0	0	21	702.528	0.000116	Saturates
412	33	68	0	0	0	0	464.544	0.02492	Saturates
413	34	68	0	0	0	1	476.544	0.013619	Saturates
414	35	68	0	0	0	2	488.544	0.031287	Saturates
415	36	68	0	0	0	3	500.544	0.049942	Saturates
416	37	68	0	0	0	4	512.544	0.054535	Saturates
417	38	68	0	0	0	5	524.544	0.053541	Saturates
418	39	68	0	0	0	6	536.544	0.034363	Saturates
419	40	68	0	0	0	7	548.544	0.033538	Saturates
420	41	68	0	0	0	8	560.544	0.004749	Saturates
421	42	68	0	0	0	9	572.544	0.001156	Saturates
422	34	70	0	0	0	0	478.56	0.018002	Saturates
423	35	70	0	0	0	1	490.56	0.007387	Saturates
424	36	70	0	0	0	2	502.56	0.020706	Saturates
425	37	70	0	0	0	3	514.56	0.030205	Saturates
426	38	70	0	0	0	4	526.56	0.037576	Saturates
427	39	70	0	0	0	5	538.56	0.035265	Saturates
428	40	70	0	0	0	6	550.56	0.054069	Saturates
429	41	70	0	0	0	7	562.56	0.008878	Saturates
430	42	70	0	0	0	8	574.56	0.001455	Saturates
431	44	70	0	0	0	10	598.56	0.000125	Saturates
432	46	70	0	0	0	12	622.56	0.00012	Saturates
433	53	70	0	0	0	19	706.56	0.000183	Saturates
434	57	70	0	0	0	23	754.56	0.000131	Saturates
435	35	72	0	0	0	0	492.576	0.014487	Saturates
436	36	72	0	0	0	1	504.576	0.004427	Saturates
437	37	72	0	0	0	2	516.576	0.016347	Saturates
438	38	72	0	0	0	3	528.576	0.024918	Saturates
439	39	72	0	0	0	4	540.576	0.025504	Saturates
440	40	72	0	0	0	5	552.576	0.042557	Saturates
441	41	72	0	0	0	6	564.576	0.015321	Saturates
442	42	72	0	0	0	7	576.576	0.004657	Saturates
443	43	72	0	0	0	8	588.576	0.000548	Saturates
444	48	72	0	0	0	13	648.576	0.000123	Saturates
445	51	72	0	0	0	16	684.576	0.000133	Saturates
446	36	74	0	0	0	0	506.592	0.008294	Saturates
447	37	74	0	0	0	1	518.592	0.002055	Saturates
448	38	74	0	0	0	2	530.592	0.010987	Saturates
449	39	74	0	0	0	3	542.592	0.018599	Saturates
450	40	74	0	0	0	4	554.592	0.024353	Saturates
451	41	74	0	0	0	5	566.592	0.016327	Saturates
452	42	74	0	0	0	6	578.592	0.006365	Saturates
453	43	74	0	0	0	7	590.592	0.002225	Saturates
454	37	76	0	0	0	0	520.608	0.006916	Saturates
455	38	76	0	0	0	1	532.608	0.000848	Saturates
456	39	76	0	0	0	2	544.608	0.007951	Saturates
457	40	76	0	0	0	3	556.608	0.012971	Saturates
458	41	76	0	0	0	4	568.608	0.013976	Saturates
459	42	76	0	0	0	5	580.608	0.010601	Saturates
460	43	76	0	0	0	6	592.608	0.00512	Saturates
461	44	76	0	0	0	7	604.608	0.000782	Saturates
462	48	76	0	0	0	11	652.608	0.000124	Saturates
463	38	78	0	0	0	0	534.624	0.000877	Saturates
464	39	78	0	0	0	1	546.624	0.000225	Saturates
465	40	78	0	0	0	2	558.624	0.003192	Saturates
466	41	78	0	0	0	3	570.624	0.009034	Saturates
467	42	78	0	0	0	4	582.624	0.008505	Saturates
468	43	78	0	0	0	5	594.624	0.005761	Saturates
469	44	78	0	0	0	6	606.624	0.003094	Saturates
470	45	78	0	0	0	7	618.624	0.000755	Saturates
471	46	78	0	0	0	8	630.624	0.000142	Saturates
472	47	78	0	0	0	9	642.624	0.00035	Saturates
473	39	80	0	0	0	0	548.64	0.001005	Saturates
474	40	80	0	0	0	1	560.64	0.000331	Saturates
475	41	80	0	0	0	2	572.64	0.001285	Saturates
476	42	80	0	0	0	3	584.64	0.003584	Saturates
477	43	80	0	0	0	4	596.64	0.004411	Saturates
478	44	80	0	0	0	5	608.64	0.003049	Saturates
479	45	80	0	0	0	6	620.64	0.000516	Saturates
480	46	80	0	0	0	7	632.64	0.000288	Saturates
481	47	80	0	0	0	8	644.64	0.00026	Saturates
482	48	80	0	0	0	9	656.64	0.000152	Saturates
483	40	82	0	0	0	0	562.656	0.00086	Saturates
484	41	82	0	0	0	1	574.656	7.8e-05	Saturates
485	42	82	0	0	0	2	586.656	0.0001	Saturates
486	43	82	0	0	0	3	598.656	0.00255	Saturates
487	44	82	0	0	0	4	610.656	0.002606	Saturates
488	45	82	0	0	0	5	622.656	0.002744	Saturates
489	46	82	0	0	0	6	634.656	0.000431	Saturates
490	47	82	0	0	0	7	646.656	0.000379	Saturates
491	48	82	0	0	0	8	658.656	0.00013	Saturates
492	41	84	0	0	0	0	576.672	0.000109	Saturates
493	43	84	0	0	0	2	600.672	9.6e-05	Saturates
494	44	84	0	0	0	3	612.672	0.003493	Saturates
495	45	84	0	0	0	4	624.672	0.001596	Saturates
496	46	84	0	0	0	5	636.672	0.000892	Saturates
497	47	84	0	0	0	6	648.672	0.000257	Saturates
498	48	84	0	0	0	7	660.672	0.000124	Saturates
499	49	84	0	0	0	8	672.672	0.00011	Saturates
500	43	86	0	0	0	1	602.688	0.000131	Saturates
501	45	86	0	0	0	3	626.688	0.000574	Saturates
502	46	86	0	0	0	4	638.688	0.001488	Saturates
503	47	86	0	0	0	5	650.688	0.000821	Saturates
504	48	86	0	0	0	6	662.688	0.000127	Saturates
505	49	86	0	0	0	7	674.688	0.000406	Saturates
506	43	88	0	0	0	0	604.704	0.000117	Saturates
507	47	88	0	0	0	4	652.704	0.000296	Saturates
508	48	88	0	0	0	5	664.704	0.000302	Saturates
509	49	88	0	0	0	6	676.704	0.000122	Saturates
510	52	88	0	0	0	9	712.704	0.000128	Saturates
511	54	88	0	0	0	11	736.704	0.000186	Saturates
512	59	88	0	0	0	16	796.704	0.000162	Saturates
513	44	90	0	0	0	0	618.72	0.00012	Saturates
514	45	90	0	0	0	1	630.72	0.000115	Saturates
515	54	90	0	0	0	10	738.72	0.000142	Saturates
516	48	92	0	0	0	3	668.736	0.00012	Saturates
517	49	92	0	0	0	4	680.736	0.000128	Saturates
518	50	92	0	0	0	5	692.736	0.000123	Saturates
519	56	92	0	0	0	11	764.736	0.000151	Saturates
520	47	94	0	0	0	1	658.752	0.000145	Saturates
521	49	94	0	0	0	3	682.752	0.000142	Saturates
522	51	94	0	0	0	5	706.752	0.000171	Saturates
523	52	94	0	0	0	6	718.752	0.000126	Saturates
524	53	94	0	0	0	7	730.752	0.000391	Saturates
525	54	94	0	0	0	8	742.752	0.000129	Saturates
526	48	96	0	0	0	1	672.768	0.000118	Saturates
527	50	96	0	0	0	3	696.768	0.000111	Saturates
528	53	96	0	0	0	6	732.768	0.000136	Saturates
529	50	98	0	0	0	2	698.784	0.000118	Saturates
530	54	100	0	0	0	5	748.8	0.000147	Saturates
531	56	100	0	0	0	7	772.8	0.000315	Saturates
532	57	100	0	0	0	8	784.8	0.000173	Saturates
533	53	108	0	0	0	0	744.864	0.000167	Saturates
534	54	108	0	0	0	1	756.864	0.000131	Saturates
535	57	108	0	0	0	4	792.864	0.000194	Saturates
536	8	10	0	0	0	4	106.08	2.58993	Aromatics
537	9	10	0	0	0	5	118.08	0.010424	Aromatics
538	10	10	0	0	0	6	130.08	0.000644	Aromatics
539	11	10	0	0	0	7	142.08	0.567743	Aromatics
540	12	10	0	0	0	8	154.08	0.017485	Aromatics
541	13	10	0	0	0	9	166.08	0.008024	Aromatics
542	14	10	0	0	0	10	178.08	0.044642	Aromatics
543	16	10	0	0	0	12	202.08	0.00014	Aromatics
544	23	10	0	0	0	19	286.08	0.004253	Aromatics
545	26	10	0	0	0	22	322.08	0.001213	Aromatics
546	32	10	0	0	0	28	394.08	0.011616	Aromatics
547	35	10	0	0	0	31	430.08	0.001897	Aromatics
548	37	10	0	0	0	33	454.08	0.002217	Aromatics
549	38	10	0	0	0	34	466.08	0.000192	Aromatics
550	40	10	0	0	0	36	490.08	0.000376	Aromatics
551	41	10	0	0	0	37	502.08	0.009865	Aromatics
552	44	10	0	0	0	40	538.08	0.000185	Aromatics
553	50	10	0	0	0	46	610.08	0.000209	Aromatics
554	9	12	0	0	0	4	120.096	2.43049	Aromatics
555	10	12	0	0	0	5	132.096	0.081972	Aromatics
556	11	12	0	0	0	6	144.096	0.000611	Aromatics
557	12	12	0	0	0	7	156.096	0.662235	Aromatics
558	13	12	0	0	0	8	168.096	0.065587	Aromatics
559	14	12	0	0	0	9	180.096	0.031876	Aromatics
560	15	12	0	0	0	10	192.096	0.097408	Aromatics
561	16	12	0	0	0	11	204.096	0.003556	Aromatics
562	17	12	0	0	0	12	216.096	0.001322	Aromatics
563	18	12	0	0	0	13	228.096	0.003802	Aromatics
564	20	12	0	0	0	15	252.096	0.00011	Aromatics
565	24	12	0	0	0	19	300.096	0.003542	Aromatics
566	25	12	0	0	0	20	312.096	0.000121	Aromatics
567	26	12	0	0	0	21	324.096	9e-05	Aromatics
568	27	12	0	0	0	22	336.096	0.001038	Aromatics
569	28	12	0	0	0	23	348.096	0.00021	Aromatics
570	33	12	0	0	0	28	408.096	0.014086	Aromatics
571	34	12	0	0	0	29	420.096	0.000154	Aromatics
572	36	12	0	0	0	31	444.096	0.002697	Aromatics
573	37	12	0	0	0	32	456.096	0.000139	Aromatics
574	42	12	0	0	0	37	516.096	0.004714	Aromatics
575	43	12	0	0	0	38	528.096	0.000165	Aromatics
576	10	14	0	0	0	4	134.112	1.10726	Aromatics
577	11	14	0	0	0	5	146.112	0.21261	Aromatics
578	12	14	0	0	0	6	158.112	0.005726	Aromatics
579	13	14	0	0	0	7	170.112	0.378327	Aromatics
580	14	14	0	0	0	8	182.112	0.09918	Aromatics
581	15	14	0	0	0	9	194.112	0.035191	Aromatics
582	16	14	0	0	0	10	206.112	0.086196	Aromatics
583	17	14	0	0	0	11	218.112	0.00939	Aromatics
584	18	14	0	0	0	12	230.112	0.003936	Aromatics
585	19	14	0	0	0	13	242.112	0.008241	Aromatics
586	20	14	0	0	0	14	254.112	0.000844	Aromatics
587	21	14	0	0	0	15	266.112	0.001609	Aromatics
588	25	14	0	0	0	19	314.112	0.002195	Aromatics
589	26	14	0	0	0	20	326.112	0.000545	Aromatics
590	28	14	0	0	0	22	350.112	0.000436	Aromatics
591	29	14	0	0	0	23	362.112	0.000528	Aromatics
592	34	14	0	0	0	28	422.112	0.011324	Aromatics
593	35	14	0	0	0	29	434.112	0.000804	Aromatics
594	37	14	0	0	0	31	458.112	0.002294	Aromatics
595	39	14	0	0	0	33	482.112	0.003296	Aromatics
596	40	14	0	0	0	34	494.112	0.000344	Aromatics
597	42	14	0	0	0	36	518.112	0.000153	Aromatics
598	43	14	0	0	0	37	530.112	0.002277	Aromatics
599	11	16	0	0	0	4	148.128	0.688715	Aromatics
600	12	16	0	0	0	5	160.128	0.274677	Aromatics
601	13	16	0	0	0	6	172.128	0.038731	Aromatics
602	14	16	0	0	0	7	184.128	0.141665	Aromatics
603	15	16	0	0	0	8	196.128	0.096016	Aromatics
604	16	16	0	0	0	9	208.128	0.045461	Aromatics
605	17	16	0	0	0	10	220.128	0.041962	Aromatics
606	18	16	0	0	0	11	232.128	0.013073	Aromatics
607	19	16	0	0	0	12	244.128	0.005342	Aromatics
608	20	16	0	0	0	13	256.128	0.007188	Aromatics
609	21	16	0	0	0	14	268.128	0.001575	Aromatics
610	22	16	0	0	0	15	280.128	0.001609	Aromatics
611	23	16	0	0	0	16	292.128	0.000266	Aromatics
612	26	16	0	0	0	19	328.128	0.001434	Aromatics
613	27	16	0	0	0	20	340.128	0.00046	Aromatics
614	28	16	0	0	0	21	352.128	0.000105	Aromatics
615	29	16	0	0	0	22	364.128	0.000421	Aromatics
616	35	16	0	0	0	28	436.128	0.00586	Aromatics
617	36	16	0	0	0	29	448.128	0.000833	Aromatics
618	38	16	0	0	0	31	472.128	0.000311	Aromatics
619	40	16	0	0	0	33	496.128	0.00139	Aromatics
620	41	16	0	0	0	34	508.128	0.000283	Aromatics
621	44	16	0	0	0	37	544.128	0.000721	Aromatics
622	49	16	0	0	0	42	604.128	0.001097	Aromatics
623	51	16	0	0	0	44	628.128	0.001022	Aromatics
624	12	18	0	0	0	4	162.144	0.364209	Aromatics
625	13	18	0	0	0	5	174.144	0.26352	Aromatics
626	14	18	0	0	0	6	186.144	0.08534	Aromatics
627	15	18	0	0	0	7	198.144	0.081834	Aromatics
628	16	18	0	0	0	8	210.144	0.073313	Aromatics
629	17	18	0	0	0	9	222.144	0.041193	Aromatics
630	18	18	0	0	0	10	234.144	0.021336	Aromatics
631	19	18	0	0	0	11	246.144	0.012231	Aromatics
632	20	18	0	0	0	12	258.144	0.006979	Aromatics
633	21	18	0	0	0	13	270.144	0.004361	Aromatics
634	22	18	0	0	0	14	282.144	0.002224	Aromatics
635	23	18	0	0	0	15	294.144	0.001102	Aromatics
636	27	18	0	0	0	19	342.144	0.000518	Aromatics
637	28	18	0	0	0	20	354.144	0.000532	Aromatics
638	29	18	0	0	0	21	366.144	0.000211	Aromatics
639	36	18	0	0	0	28	450.144	0.002016	Aromatics
640	37	18	0	0	0	29	462.144	0.000995	Aromatics
641	41	18	0	0	0	33	510.144	0.000519	Aromatics
642	42	18	0	0	0	34	522.144	0.000288	Aromatics
643	50	18	0	0	0	42	618.144	0.000489	Aromatics
644	13	20	0	0	0	4	176.16	0.177956	Aromatics
645	14	20	0	0	0	5	188.16	0.218016	Aromatics
646	15	20	0	0	0	6	200.16	0.113191	Aromatics
647	16	20	0	0	0	7	212.16	0.06128	Aromatics
648	17	20	0	0	0	8	224.16	0.053183	Aromatics
649	18	20	0	0	0	9	236.16	0.038793	Aromatics
650	19	20	0	0	0	10	248.16	0.0158	Aromatics
651	20	20	0	0	0	11	260.16	0.010623	Aromatics
652	21	20	0	0	0	12	272.16	0.00651	Aromatics
653	22	20	0	0	0	13	284.16	0.002782	Aromatics
654	23	20	0	0	0	14	296.16	0.002989	Aromatics
655	25	20	0	0	0	16	320.16	0.000237	Aromatics
656	28	20	0	0	0	19	356.16	0.000442	Aromatics
657	29	20	0	0	0	20	368.16	0.000301	Aromatics
658	30	20	0	0	0	21	380.16	0.000208	Aromatics
659	38	20	0	0	0	29	476.16	0.000221	Aromatics
660	51	20	0	0	0	42	632.16	0.001043	Aromatics
661	53	20	0	0	0	44	656.16	0.00025	Aromatics
662	14	22	0	0	0	4	190.176	0.121954	Aromatics
663	15	22	0	0	0	5	202.176	0.155548	Aromatics
664	16	22	0	0	0	6	214.176	0.105005	Aromatics
665	17	22	0	0	0	7	226.176	0.055229	Aromatics
666	18	22	0	0	0	8	238.176	0.041539	Aromatics
667	19	22	0	0	0	9	250.176	0.035503	Aromatics
668	20	22	0	0	0	10	262.176	0.015347	Aromatics
669	21	22	0	0	0	11	274.176	0.008949	Aromatics
670	22	22	0	0	0	12	286.176	0.005622	Aromatics
671	23	22	0	0	0	13	298.176	0.002489	Aromatics
672	24	22	0	0	0	14	310.176	0.002874	Aromatics
673	31	22	0	0	0	21	394.176	0.000493	Aromatics
674	39	22	0	0	0	29	490.176	0.000137	Aromatics
675	52	22	0	0	0	42	646.176	0.000427	Aromatics
676	15	24	0	0	0	4	204.192	0.094103	Aromatics
677	16	24	0	0	0	5	216.192	0.101935	Aromatics
678	17	24	0	0	0	6	228.192	0.086079	Aromatics
679	18	24	0	0	0	7	240.192	0.057572	Aromatics
680	19	24	0	0	0	8	252.192	0.034029	Aromatics
681	20	24	0	0	0	9	264.192	0.02874	Aromatics
682	21	24	0	0	0	10	276.192	0.014866	Aromatics
683	22	24	0	0	0	11	288.192	0.007229	Aromatics
684	23	24	0	0	0	12	300.192	0.005203	Aromatics
685	24	24	0	0	0	13	312.192	0.002894	Aromatics
686	28	24	0	0	0	17	360.192	0.000176	Aromatics
687	30	24	0	0	0	19	384.192	0.000217	Aromatics
688	43	24	0	0	0	32	540.192	0.000304	Aromatics
689	44	24	0	0	0	33	552.192	0.000299	Aromatics
690	16	26	0	0	0	4	218.208	0.076221	Aromatics
691	17	26	0	0	0	5	230.208	0.074765	Aromatics
692	18	26	0	0	0	6	242.208	0.067376	Aromatics
693	19	26	0	0	0	7	254.208	0.059253	Aromatics
694	20	26	0	0	0	8	266.208	0.032307	Aromatics
695	21	26	0	0	0	9	278.208	0.02299	Aromatics
696	22	26	0	0	0	10	290.208	0.013646	Aromatics
697	23	26	0	0	0	11	302.208	0.006784	Aromatics
698	24	26	0	0	0	12	314.208	0.004423	Aromatics
699	31	26	0	0	0	19	398.208	0.000632	Aromatics
700	33	26	0	0	0	21	422.208	0.000121	Aromatics
701	42	26	0	0	0	30	530.208	0.000432	Aromatics
702	43	26	0	0	0	31	542.208	0.000308	Aromatics
703	17	28	0	0	0	4	232.224	0.06885	Aromatics
704	18	28	0	0	0	5	244.224	0.062166	Aromatics
705	19	28	0	0	0	6	256.224	0.055279	Aromatics
706	20	28	0	0	0	7	268.224	0.049326	Aromatics
707	21	28	0	0	0	8	280.224	0.030629	Aromatics
708	22	28	0	0	0	9	292.224	0.019698	Aromatics
709	23	28	0	0	0	10	304.224	0.012418	Aromatics
710	41	28	0	0	0	28	520.224	0.000317	Aromatics
711	42	28	0	0	0	29	532.224	0.000359	Aromatics
712	43	28	0	0	0	30	544.224	0.000482	Aromatics
713	18	30	0	0	0	4	246.24	0.063347	Aromatics
714	19	30	0	0	0	5	258.24	0.050255	Aromatics
715	20	30	0	0	0	6	270.24	0.042642	Aromatics
716	21	30	0	0	0	7	282.24	0.039001	Aromatics
717	22	30	0	0	0	8	294.24	0.024811	Aromatics
718	23	30	0	0	0	9	306.24	0.015047	Aromatics
719	42	30	0	0	0	28	534.24	0.000256	Aromatics
720	44	30	0	0	0	30	558.24	0.000345	Aromatics
721	45	30	0	0	0	31	570.24	0.000182	Aromatics
722	19	32	0	0	0	4	260.256	0.052879	Aromatics
723	20	32	0	0	0	5	272.256	0.039279	Aromatics
724	21	32	0	0	0	6	284.256	0.035082	Aromatics
725	22	32	0	0	0	7	296.256	0.033928	Aromatics
726	23	32	0	0	0	8	308.256	0.020513	Aromatics
727	42	32	0	0	0	27	536.256	0.001284	Aromatics
728	20	34	0	0	0	4	274.272	0.037152	Aromatics
729	21	34	0	0	0	5	286.272	0.033796	Aromatics
730	22	34	0	0	0	6	298.272	0.027951	Aromatics
731	23	34	0	0	0	7	310.272	0.024882	Aromatics
732	43	34	0	0	0	27	550.272	0.001395	Aromatics
733	21	36	0	0	0	4	288.288	0.032154	Aromatics
734	22	36	0	0	0	5	300.288	0.028408	Aromatics
735	23	36	0	0	0	6	312.288	0.021325	Aromatics
736	44	36	0	0	0	27	564.288	0.002278	Aromatics
737	47	36	0	0	0	30	600.288	0.000381	Aromatics
738	48	36	0	0	0	31	612.288	0.000241	Aromatics
739	22	38	0	0	0	4	302.304	0.027707	Aromatics
740	23	38	0	0	0	5	314.304	0.023944	Aromatics
741	45	38	0	0	0	27	578.304	0.006043	Aromatics
742	46	38	0	0	0	28	590.304	0.000551	Aromatics
743	47	38	0	0	0	29	602.304	0.000729	Aromatics
744	48	38	0	0	0	30	614.304	0.001287	Aromatics
745	46	40	0	0	0	27	592.32	0.009909	Aromatics
746	47	40	0	0	0	28	604.32	0.001609	Aromatics
747	48	40	0	0	0	29	616.32	0.001402	Aromatics
748	49	40	0	0	0	30	628.32	0.003125	Aromatics
749	47	42	0	0	0	27	606.336	0.01121	Aromatics
750	48	42	0	0	0	28	618.336	0.003288	Aromatics
751	49	42	0	0	0	29	630.336	0.001206	Aromatics
752	50	42	0	0	0	30	642.336	0.003428	Aromatics
753	51	42	0	0	0	31	654.336	0.000897	Aromatics
754	53	42	0	0	0	33	678.336	0.000221	Aromatics
755	48	44	0	0	0	27	620.352	0.009795	Aromatics
756	49	44	0	0	0	28	632.352	0.003759	Aromatics
757	50	44	0	0	0	29	644.352	0.000884	Aromatics
758	51	44	0	0	0	30	656.352	0.003097	Aromatics
759	52	44	0	0	0	31	668.352	0.000504	Aromatics
760	49	46	0	0	0	27	634.368	0.006724	Aromatics
761	50	46	0	0	0	28	646.368	0.002995	Aromatics
762	52	46	0	0	0	30	670.368	0.002718	Aromatics
763	50	48	0	0	0	27	648.384	0.004309	Aromatics
764	51	48	0	0	0	28	660.384	0.00268	Aromatics
765	52	48	0	0	0	29	672.384	0.000655	Aromatics
766	51	50	0	0	0	27	662.4	0.00217	Aromatics
767	52	50	0	0	0	28	674.4	0.001726	Aromatics
768	52	52	0	0	0	27	676.416	0.001141	Aromatics
769	54	52	0	0	0	29	700.416	0.000347	Aromatics
770	47	54	0	0	0	21	618.432	0.000269	Aromatics
771	51	74	0	0	0	15	686.592	0.000247	Aromatics
772	52	76	0	0	0	15	700.608	0.000552	Aromatics
773	53	76	0	0	0	16	712.608	0.000285	Aromatics
774	52	78	0	0	0	14	702.624	0.000256	Aromatics
775	55	80	0	0	0	16	740.64	0.000376	Aromatics
776	54	82	0	0	0	14	730.656	0.00036	Aromatics
777	55	84	0	0	0	14	744.672	0.000228	Aromatics
778	16	11	0	1	0	12	217.098	2e-05	Neutral nitrogen compounds
779	16	11	1	1	0	12	233.098	0.0	Neutral nitrogen compounds
780	18	11	0	1	0	14	241.098	0.0	Neutral nitrogen compounds
781	17	11	1	1	0	13	245.098	0.0	Neutral nitrogen compounds
782	14	13	0	1	0	9	195.114	5.6e-05	Neutral nitrogen compounds
783	15	13	0	1	0	10	207.114	1e-06	Neutral nitrogen compounds
784	15	13	1	1	0	10	223.114	1e-06	Neutral nitrogen compounds
785	17	13	0	1	0	12	231.114	6.4e-05	Neutral nitrogen compounds
786	18	13	0	1	0	13	243.114	2e-06	Neutral nitrogen compounds
787	17	13	1	1	0	12	247.114	0.0	Neutral nitrogen compounds
788	19	13	0	1	0	14	255.114	1e-06	Neutral nitrogen compounds
789	18	13	1	1	0	13	259.114	0.0	Neutral nitrogen compounds
790	20	13	0	1	0	15	267.114	1.1e-05	Neutral nitrogen compounds
791	19	13	1	1	0	14	271.114	0.0	Neutral nitrogen compounds
792	21	13	0	1	0	16	279.114	0.0	Neutral nitrogen compounds
793	20	13	1	1	0	15	283.114	0.0	Neutral nitrogen compounds
794	22	13	0	1	0	17	291.114	0.0	Neutral nitrogen compounds
795	15	15	0	1	0	9	209.13	5.4e-05	Neutral nitrogen compounds
796	16	15	0	1	0	10	221.13	6e-06	Neutral nitrogen compounds
797	17	15	0	1	0	11	233.13	0.0	Neutral nitrogen compounds
798	16	15	1	1	0	10	237.13	0.0	Neutral nitrogen compounds
799	18	15	0	1	0	12	245.13	8.5e-05	Neutral nitrogen compounds
800	19	15	0	1	0	13	257.13	1.2e-05	Neutral nitrogen compounds
801	18	15	1	1	0	12	261.13	0.0	Neutral nitrogen compounds
802	20	15	0	1	0	14	269.13	4e-06	Neutral nitrogen compounds
803	19	15	1	1	0	13	273.13	0.0	Neutral nitrogen compounds
804	18	15	2	1	0	12	277.13	0.0	Neutral nitrogen compounds
805	21	15	0	1	0	15	281.13	3.1e-05	Neutral nitrogen compounds
806	20	15	1	1	0	14	285.13	0.0	Neutral nitrogen compounds
807	22	15	0	1	0	16	293.13	1e-06	Neutral nitrogen compounds
808	21	15	1	1	0	15	297.13	0.0	Neutral nitrogen compounds
809	23	15	0	1	0	17	305.13	1e-06	Neutral nitrogen compounds
810	22	15	1	1	0	16	309.13	0.0	Neutral nitrogen compounds
811	24	15	0	1	0	18	317.13	1e-06	Neutral nitrogen compounds
812	24	15	1	1	0	18	333.13	0.0	Neutral nitrogen compounds
813	26	15	0	1	0	20	341.13	0.0	Neutral nitrogen compounds
814	13	17	0	1	0	6	187.146	0.0	Neutral nitrogen compounds
815	16	17	0	1	0	9	223.146	3.7e-05	Neutral nitrogen compounds
816	17	17	0	1	0	10	235.146	1.3e-05	Neutral nitrogen compounds
817	18	17	0	1	0	11	247.146	1e-06	Neutral nitrogen compounds
818	17	17	1	1	0	10	251.146	0.0	Neutral nitrogen compounds
819	19	17	0	1	0	12	259.146	7.1e-05	Neutral nitrogen compounds
820	18	17	1	1	0	11	263.146	0.0	Neutral nitrogen compounds
821	20	17	0	1	0	13	271.146	2.4e-05	Neutral nitrogen compounds
822	21	17	0	1	0	14	283.146	9e-06	Neutral nitrogen compounds
823	20	17	1	1	0	13	287.146	0.0	Neutral nitrogen compounds
824	19	17	2	1	0	12	291.146	0.0	Neutral nitrogen compounds
825	22	17	0	1	0	15	295.146	3.8e-05	Neutral nitrogen compounds
826	21	17	1	1	0	14	299.146	0.0	Neutral nitrogen compounds
827	23	17	0	1	0	16	307.146	7e-06	Neutral nitrogen compounds
828	22	17	1	1	0	15	311.146	0.0	Neutral nitrogen compounds
829	24	17	0	1	0	17	319.146	4e-06	Neutral nitrogen compounds
830	23	17	1	1	0	16	323.146	0.0	Neutral nitrogen compounds
831	25	17	0	1	0	18	331.146	5e-06	Neutral nitrogen compounds
832	24	17	1	1	0	17	335.146	0.0	Neutral nitrogen compounds
833	26	17	0	1	0	19	343.146	0.0	Neutral nitrogen compounds
834	25	17	1	1	0	18	347.146	0.0	Neutral nitrogen compounds
835	27	17	0	1	0	20	355.146	0.0	Neutral nitrogen compounds
836	28	17	0	1	0	21	367.146	0.0	Neutral nitrogen compounds
837	14	19	0	1	0	6	201.162	0.0	Neutral nitrogen compounds
838	16	19	0	1	0	8	225.162	0.0	Neutral nitrogen compounds
839	17	19	0	1	0	9	237.162	2.9e-05	Neutral nitrogen compounds
840	18	19	0	1	0	10	249.162	1.8e-05	Neutral nitrogen compounds
841	19	19	0	1	0	11	261.162	7e-06	Neutral nitrogen compounds
842	18	19	1	1	0	10	265.162	0.0	Neutral nitrogen compounds
843	20	19	0	1	0	12	273.162	4e-05	Neutral nitrogen compounds
844	19	19	1	1	0	11	277.162	0.0	Neutral nitrogen compounds
845	21	19	0	1	0	13	285.162	2.8e-05	Neutral nitrogen compounds
846	20	19	1	1	0	12	289.162	0.0	Neutral nitrogen compounds
847	22	19	0	1	0	14	297.162	1.2e-05	Neutral nitrogen compounds
848	21	19	1	1	0	13	301.162	0.0	Neutral nitrogen compounds
849	20	19	2	1	0	12	305.162	0.0	Neutral nitrogen compounds
850	23	19	0	1	0	15	309.162	2.7e-05	Neutral nitrogen compounds
851	22	19	1	1	0	14	313.162	0.0	Neutral nitrogen compounds
852	21	19	2	1	0	13	317.162	0.0	Neutral nitrogen compounds
853	24	19	0	1	0	16	321.162	1.1e-05	Neutral nitrogen compounds
854	23	19	1	1	0	15	325.162	0.0	Neutral nitrogen compounds
855	25	19	0	1	0	17	333.162	6e-06	Neutral nitrogen compounds
856	24	19	1	1	0	16	337.162	0.0	Neutral nitrogen compounds
857	26	19	0	1	0	18	345.162	6e-06	Neutral nitrogen compounds
858	25	19	1	1	0	17	349.162	0.0	Neutral nitrogen compounds
859	27	19	0	1	0	19	357.162	2e-06	Neutral nitrogen compounds
860	26	19	1	1	0	18	361.162	0.0	Neutral nitrogen compounds
861	28	19	0	1	0	20	369.162	1e-06	Neutral nitrogen compounds
862	27	19	1	1	0	19	373.162	0.0	Neutral nitrogen compounds
863	29	19	0	1	0	21	381.162	0.0	Neutral nitrogen compounds
864	30	19	0	1	0	22	393.162	0.0	Neutral nitrogen compounds
865	31	19	0	1	0	23	405.162	0.0	Neutral nitrogen compounds
866	15	21	0	1	0	6	215.178	0.0	Neutral nitrogen compounds
867	16	21	0	1	0	7	227.178	0.0	Neutral nitrogen compounds
868	17	21	0	1	0	8	239.178	0.0	Neutral nitrogen compounds
869	18	21	0	1	0	9	251.178	2.2e-05	Neutral nitrogen compounds
870	19	21	0	1	0	10	263.178	1.8e-05	Neutral nitrogen compounds
871	18	21	1	1	0	9	267.178	0.0	Neutral nitrogen compounds
872	20	21	0	1	0	11	275.178	1.7e-05	Neutral nitrogen compounds
873	19	21	1	1	0	10	279.178	0.0	Neutral nitrogen compounds
874	21	21	0	1	0	12	287.178	2.4e-05	Neutral nitrogen compounds
875	20	21	1	1	0	11	291.178	0.0	Neutral nitrogen compounds
876	22	21	0	1	0	13	299.178	2.4e-05	Neutral nitrogen compounds
877	21	21	1	1	0	12	303.178	0.0	Neutral nitrogen compounds
878	20	21	2	1	0	11	307.178	0.0	Neutral nitrogen compounds
879	23	21	0	1	0	14	311.178	1.4e-05	Neutral nitrogen compounds
880	22	21	1	1	0	13	315.178	0.0	Neutral nitrogen compounds
881	21	21	2	1	0	12	319.178	0.0	Neutral nitrogen compounds
882	24	21	0	1	0	15	323.178	1.5e-05	Neutral nitrogen compounds
883	23	21	1	1	0	14	327.178	0.0	Neutral nitrogen compounds
884	22	21	2	1	0	13	331.178	0.0	Neutral nitrogen compounds
885	25	21	0	1	0	16	335.178	1.3e-05	Neutral nitrogen compounds
886	24	21	1	1	0	15	339.178	0.0	Neutral nitrogen compounds
887	26	21	0	1	0	17	347.178	6e-06	Neutral nitrogen compounds
888	25	21	1	1	0	16	351.178	0.0	Neutral nitrogen compounds
889	27	21	0	1	0	18	359.178	5e-06	Neutral nitrogen compounds
890	26	21	1	1	0	17	363.178	0.0	Neutral nitrogen compounds
891	28	21	0	1	0	19	371.178	3e-06	Neutral nitrogen compounds
892	27	21	1	1	0	18	375.178	0.0	Neutral nitrogen compounds
893	29	21	0	1	0	20	383.178	1e-06	Neutral nitrogen compounds
894	28	21	1	1	0	19	387.178	0.0	Neutral nitrogen compounds
895	30	21	0	1	0	21	395.178	1e-06	Neutral nitrogen compounds
896	31	21	0	1	0	22	407.178	0.0	Neutral nitrogen compounds
897	32	21	0	1	0	23	419.178	0.0	Neutral nitrogen compounds
898	16	23	0	1	0	6	229.194	0.0	Neutral nitrogen compounds
899	17	23	0	1	0	7	241.194	0.0	Neutral nitrogen compounds
900	18	23	0	1	0	8	253.194	1e-06	Neutral nitrogen compounds
901	19	23	0	1	0	9	265.194	1.3e-05	Neutral nitrogen compounds
902	20	23	0	1	0	10	277.194	1.6e-05	Neutral nitrogen compounds
903	19	23	1	1	0	9	281.194	0.0	Neutral nitrogen compounds
904	21	23	0	1	0	11	289.194	2.3e-05	Neutral nitrogen compounds
905	20	23	1	1	0	10	293.194	0.0	Neutral nitrogen compounds
906	22	23	0	1	0	12	301.194	1.7e-05	Neutral nitrogen compounds
907	21	23	1	1	0	11	305.194	0.0	Neutral nitrogen compounds
908	23	23	0	1	0	13	313.194	1.9e-05	Neutral nitrogen compounds
909	22	23	1	1	0	12	317.194	0.0	Neutral nitrogen compounds
910	21	23	2	1	0	11	321.194	0.0	Neutral nitrogen compounds
911	24	23	0	1	0	14	325.194	1.7e-05	Neutral nitrogen compounds
912	23	23	1	1	0	13	329.194	0.0	Neutral nitrogen compounds
913	22	23	2	1	0	12	333.194	0.0	Neutral nitrogen compounds
914	25	23	0	1	0	15	337.194	1e-05	Neutral nitrogen compounds
915	24	23	1	1	0	14	341.194	0.0	Neutral nitrogen compounds
916	23	23	2	1	0	13	345.194	0.0	Neutral nitrogen compounds
917	26	23	0	1	0	16	349.194	1e-05	Neutral nitrogen compounds
918	25	23	1	1	0	15	353.194	0.0	Neutral nitrogen compounds
919	27	23	0	1	0	17	361.194	5e-06	Neutral nitrogen compounds
920	26	23	1	1	0	16	365.194	0.0	Neutral nitrogen compounds
921	28	23	0	1	0	18	373.194	3e-06	Neutral nitrogen compounds
922	27	23	1	1	0	17	377.194	0.0	Neutral nitrogen compounds
923	29	23	0	1	0	19	385.194	2e-06	Neutral nitrogen compounds
924	28	23	1	1	0	18	389.194	0.0	Neutral nitrogen compounds
925	30	23	0	1	0	20	397.194	1e-06	Neutral nitrogen compounds
926	31	23	0	1	0	21	409.194	1e-06	Neutral nitrogen compounds
927	32	23	0	1	0	22	421.194	0.0	Neutral nitrogen compounds
928	33	23	0	1	0	23	433.194	0.0	Neutral nitrogen compounds
929	34	23	0	1	0	24	445.194	0.0	Neutral nitrogen compounds
930	17	25	0	1	0	6	243.21	0.0	Neutral nitrogen compounds
931	18	25	0	1	0	7	255.21	1e-06	Neutral nitrogen compounds
932	19	25	0	1	0	8	267.21	1e-06	Neutral nitrogen compounds
933	20	25	0	1	0	9	279.21	9e-06	Neutral nitrogen compounds
934	21	25	0	1	0	10	291.21	1.4e-05	Neutral nitrogen compounds
935	20	25	1	1	0	9	295.21	0.0	Neutral nitrogen compounds
936	22	25	0	1	0	11	303.21	2.3e-05	Neutral nitrogen compounds
937	21	25	1	1	0	10	307.21	0.0	Neutral nitrogen compounds
938	23	25	0	1	0	12	315.21	1.7e-05	Neutral nitrogen compounds
939	22	25	1	1	0	11	319.21	0.0	Neutral nitrogen compounds
940	24	25	0	1	0	13	327.21	1.5e-05	Neutral nitrogen compounds
941	23	25	1	1	0	12	331.21	0.0	Neutral nitrogen compounds
942	22	25	2	1	0	11	335.21	0.0	Neutral nitrogen compounds
943	25	25	0	1	0	14	339.21	1.8e-05	Neutral nitrogen compounds
944	24	25	1	1	0	13	343.21	0.0	Neutral nitrogen compounds
945	23	25	2	1	0	12	347.21	0.0	Neutral nitrogen compounds
946	26	25	0	1	0	15	351.21	9e-06	Neutral nitrogen compounds
947	25	25	1	1	0	14	355.21	0.0	Neutral nitrogen compounds
948	24	25	2	1	0	13	359.21	0.0	Neutral nitrogen compounds
949	27	25	0	1	0	16	363.21	7e-06	Neutral nitrogen compounds
950	26	25	1	1	0	15	367.21	0.0	Neutral nitrogen compounds
951	25	25	2	1	0	14	371.21	0.0	Neutral nitrogen compounds
952	28	25	0	1	0	17	375.21	5e-06	Neutral nitrogen compounds
953	27	25	1	1	0	16	379.21	0.0	Neutral nitrogen compounds
954	29	25	0	1	0	18	387.21	3e-06	Neutral nitrogen compounds
955	28	25	1	1	0	17	391.21	0.0	Neutral nitrogen compounds
956	30	25	0	1	0	19	399.21	2e-06	Neutral nitrogen compounds
957	29	25	1	1	0	18	403.21	0.0	Neutral nitrogen compounds
958	31	25	0	1	0	20	411.21	1e-06	Neutral nitrogen compounds
959	30	25	1	1	0	19	415.21	0.0	Neutral nitrogen compounds
960	32	25	0	1	0	21	423.21	1e-06	Neutral nitrogen compounds
961	33	25	0	1	0	22	435.21	0.0	Neutral nitrogen compounds
962	34	25	0	1	0	23	447.21	0.0	Neutral nitrogen compounds
963	35	25	0	1	0	24	459.21	0.0	Neutral nitrogen compounds
964	36	25	0	1	0	25	471.21	0.0	Neutral nitrogen compounds
965	18	27	0	1	0	6	257.226	0.0	Neutral nitrogen compounds
966	19	27	0	1	0	7	269.226	1e-06	Neutral nitrogen compounds
967	20	27	0	1	0	8	281.226	1e-06	Neutral nitrogen compounds
968	21	27	0	1	0	9	293.226	9e-06	Neutral nitrogen compounds
969	20	27	1	1	0	8	297.226	0.0	Neutral nitrogen compounds
970	22	27	0	1	0	10	305.226	1.2e-05	Neutral nitrogen compounds
971	21	27	1	1	0	9	309.226	0.0	Neutral nitrogen compounds
972	23	27	0	1	0	11	317.226	2e-05	Neutral nitrogen compounds
973	22	27	1	1	0	10	321.226	0.0	Neutral nitrogen compounds
974	21	27	2	1	0	9	325.226	0.0	Neutral nitrogen compounds
975	24	27	0	1	0	12	329.226	1.7e-05	Neutral nitrogen compounds
976	23	27	1	1	0	11	333.226	0.0	Neutral nitrogen compounds
977	22	27	2	1	0	10	337.226	0.0	Neutral nitrogen compounds
978	25	27	0	1	0	13	341.226	1.2e-05	Neutral nitrogen compounds
979	24	27	1	1	0	12	345.226	0.0	Neutral nitrogen compounds
980	23	27	2	1	0	11	349.226	0.0	Neutral nitrogen compounds
981	26	27	0	1	0	14	353.226	1.6e-05	Neutral nitrogen compounds
982	25	27	1	1	0	13	357.226	0.0	Neutral nitrogen compounds
983	24	27	2	1	0	12	361.226	0.0	Neutral nitrogen compounds
984	27	27	0	1	0	15	365.226	9e-06	Neutral nitrogen compounds
985	26	27	1	1	0	14	369.226	0.0	Neutral nitrogen compounds
986	25	27	2	1	0	13	373.226	0.0	Neutral nitrogen compounds
987	28	27	0	1	0	16	377.226	6e-06	Neutral nitrogen compounds
988	27	27	1	1	0	15	381.226	0.0	Neutral nitrogen compounds
989	26	27	2	1	0	14	385.226	0.0	Neutral nitrogen compounds
990	29	27	0	1	0	17	389.226	5e-06	Neutral nitrogen compounds
991	28	27	1	1	0	16	393.226	0.0	Neutral nitrogen compounds
992	30	27	0	1	0	18	401.226	2e-06	Neutral nitrogen compounds
993	29	27	1	1	0	17	405.226	0.0	Neutral nitrogen compounds
994	31	27	0	1	0	19	413.226	2e-06	Neutral nitrogen compounds
995	30	27	1	1	0	18	417.226	0.0	Neutral nitrogen compounds
996	32	27	0	1	0	20	425.226	1e-06	Neutral nitrogen compounds
997	33	27	0	1	0	21	437.226	1e-06	Neutral nitrogen compounds
998	34	27	0	1	0	22	449.226	0.0	Neutral nitrogen compounds
999	35	27	0	1	0	23	461.226	0.0	Neutral nitrogen compounds
1000	36	27	0	1	0	24	473.226	0.0	Neutral nitrogen compounds
1001	37	27	0	1	0	25	485.226	0.0	Neutral nitrogen compounds
1002	19	29	0	1	0	6	271.242	0.0	Neutral nitrogen compounds
1003	20	29	0	1	0	7	283.242	0.0	Neutral nitrogen compounds
1004	21	29	0	1	0	8	295.242	1e-06	Neutral nitrogen compounds
1005	22	29	0	1	0	9	307.242	8e-06	Neutral nitrogen compounds
1006	21	29	1	1	0	8	311.242	0.0	Neutral nitrogen compounds
1007	23	29	0	1	0	10	319.242	1e-05	Neutral nitrogen compounds
1008	22	29	1	1	0	9	323.242	0.0	Neutral nitrogen compounds
1009	24	29	0	1	0	11	331.242	1.6e-05	Neutral nitrogen compounds
1010	23	29	1	1	0	10	335.242	0.0	Neutral nitrogen compounds
1011	22	29	2	1	0	9	339.242	0.0	Neutral nitrogen compounds
1012	25	29	0	1	0	12	343.242	1.6e-05	Neutral nitrogen compounds
1013	24	29	1	1	0	11	347.242	0.0	Neutral nitrogen compounds
1014	23	29	2	1	0	10	351.242	0.0	Neutral nitrogen compounds
1015	26	29	0	1	0	13	355.242	1.1e-05	Neutral nitrogen compounds
1016	25	29	1	1	0	12	359.242	0.0	Neutral nitrogen compounds
1017	24	29	2	1	0	11	363.242	0.0	Neutral nitrogen compounds
1018	27	29	0	1	0	14	367.242	1.3e-05	Neutral nitrogen compounds
1019	26	29	1	1	0	13	371.242	0.0	Neutral nitrogen compounds
1020	25	29	2	1	0	12	375.242	0.0	Neutral nitrogen compounds
1021	28	29	0	1	0	15	379.242	9e-06	Neutral nitrogen compounds
1022	27	29	1	1	0	14	383.242	0.0	Neutral nitrogen compounds
1023	26	29	2	1	0	13	387.242	0.0	Neutral nitrogen compounds
1024	29	29	0	1	0	16	391.242	5e-06	Neutral nitrogen compounds
1025	28	29	1	1	0	15	395.242	0.0	Neutral nitrogen compounds
1026	27	29	2	1	0	14	399.242	0.0	Neutral nitrogen compounds
1027	30	29	0	1	0	17	403.242	4e-06	Neutral nitrogen compounds
1028	29	29	1	1	0	16	407.242	0.0	Neutral nitrogen compounds
1029	28	29	2	1	0	15	411.242	0.0	Neutral nitrogen compounds
1030	31	29	0	1	0	18	415.242	2e-06	Neutral nitrogen compounds
1031	30	29	1	1	0	17	419.242	0.0	Neutral nitrogen compounds
1032	32	29	0	1	0	19	427.242	1e-06	Neutral nitrogen compounds
1033	31	29	1	1	0	18	431.242	0.0	Neutral nitrogen compounds
1034	33	29	0	1	0	20	439.242	1e-06	Neutral nitrogen compounds
1035	34	29	0	1	0	21	451.242	1e-06	Neutral nitrogen compounds
1036	35	29	0	1	0	22	463.242	0.0	Neutral nitrogen compounds
1037	36	29	0	1	0	23	475.242	0.0	Neutral nitrogen compounds
1038	37	29	0	1	0	24	487.242	0.0	Neutral nitrogen compounds
1039	38	29	0	1	0	25	499.242	0.0	Neutral nitrogen compounds
1040	20	31	0	1	0	6	285.258	0.0	Neutral nitrogen compounds
1041	21	31	0	1	0	7	297.258	0.0	Neutral nitrogen compounds
1042	22	31	0	1	0	8	309.258	1e-06	Neutral nitrogen compounds
1043	23	31	0	1	0	9	321.258	8e-06	Neutral nitrogen compounds
1044	22	31	1	1	0	8	325.258	0.0	Neutral nitrogen compounds
1045	24	31	0	1	0	10	333.258	9e-06	Neutral nitrogen compounds
1046	23	31	1	1	0	9	337.258	0.0	Neutral nitrogen compounds
1047	25	31	0	1	0	11	345.258	1.2e-05	Neutral nitrogen compounds
1048	24	31	1	1	0	10	349.258	0.0	Neutral nitrogen compounds
1049	23	31	2	1	0	9	353.258	0.0	Neutral nitrogen compounds
1050	26	31	0	1	0	12	357.258	1.4e-05	Neutral nitrogen compounds
1051	25	31	1	1	0	11	361.258	0.0	Neutral nitrogen compounds
1052	24	31	2	1	0	10	365.258	0.0	Neutral nitrogen compounds
1053	27	31	0	1	0	13	369.258	1.1e-05	Neutral nitrogen compounds
1054	26	31	1	1	0	12	373.258	0.0	Neutral nitrogen compounds
1055	25	31	2	1	0	11	377.258	0.0	Neutral nitrogen compounds
1056	28	31	0	1	0	14	381.258	1.1e-05	Neutral nitrogen compounds
1057	27	31	1	1	0	13	385.258	0.0	Neutral nitrogen compounds
1058	26	31	2	1	0	12	389.258	0.0	Neutral nitrogen compounds
1059	29	31	0	1	0	15	393.258	7e-06	Neutral nitrogen compounds
1060	28	31	1	1	0	14	397.258	0.0	Neutral nitrogen compounds
1061	27	31	2	1	0	13	401.258	0.0	Neutral nitrogen compounds
1062	30	31	0	1	0	16	405.258	4e-06	Neutral nitrogen compounds
1063	29	31	1	1	0	15	409.258	0.0	Neutral nitrogen compounds
1064	28	31	2	1	0	14	413.258	0.0	Neutral nitrogen compounds
1065	31	31	0	1	0	17	417.258	3e-06	Neutral nitrogen compounds
1066	30	31	1	1	0	16	421.258	0.0	Neutral nitrogen compounds
1067	32	31	0	1	0	18	429.258	2e-06	Neutral nitrogen compounds
1068	31	31	1	1	0	17	433.258	0.0	Neutral nitrogen compounds
1069	33	31	0	1	0	19	441.258	1e-06	Neutral nitrogen compounds
1070	32	31	1	1	0	18	445.258	0.0	Neutral nitrogen compounds
1071	34	31	0	1	0	20	453.258	1e-06	Neutral nitrogen compounds
1072	35	31	0	1	0	21	465.258	0.0	Neutral nitrogen compounds
1073	36	31	0	1	0	22	477.258	0.0	Neutral nitrogen compounds
1074	37	31	0	1	0	23	489.258	0.0	Neutral nitrogen compounds
1075	38	31	0	1	0	24	501.258	0.0	Neutral nitrogen compounds
1076	21	33	0	1	0	6	299.274	0.0	Neutral nitrogen compounds
1077	22	33	0	1	0	7	311.274	0.0	Neutral nitrogen compounds
1078	23	33	0	1	0	8	323.274	1e-06	Neutral nitrogen compounds
1079	24	33	0	1	0	9	335.274	7e-06	Neutral nitrogen compounds
1080	23	33	1	1	0	8	339.274	0.0	Neutral nitrogen compounds
1081	25	33	0	1	0	10	347.274	7e-06	Neutral nitrogen compounds
1082	24	33	1	1	0	9	351.274	0.0	Neutral nitrogen compounds
1083	26	33	0	1	0	11	359.274	1e-05	Neutral nitrogen compounds
1084	25	33	1	1	0	10	363.274	0.0	Neutral nitrogen compounds
1085	24	33	2	1	0	9	367.274	0.0	Neutral nitrogen compounds
1086	27	33	0	1	0	12	371.274	1.2e-05	Neutral nitrogen compounds
1087	26	33	1	1	0	11	375.274	0.0	Neutral nitrogen compounds
1088	25	33	2	1	0	10	379.274	0.0	Neutral nitrogen compounds
1089	28	33	0	1	0	13	383.274	9e-06	Neutral nitrogen compounds
1090	27	33	1	1	0	12	387.274	0.0	Neutral nitrogen compounds
1091	26	33	2	1	0	11	391.274	0.0	Neutral nitrogen compounds
1092	29	33	0	1	0	14	395.274	8e-06	Neutral nitrogen compounds
1093	28	33	1	1	0	13	399.274	0.0	Neutral nitrogen compounds
1094	27	33	2	1	0	12	403.274	0.0	Neutral nitrogen compounds
1095	30	33	0	1	0	15	407.274	6e-06	Neutral nitrogen compounds
1096	29	33	1	1	0	14	411.274	0.0	Neutral nitrogen compounds
1097	28	33	2	1	0	13	415.274	0.0	Neutral nitrogen compounds
1098	31	33	0	1	0	16	419.274	4e-06	Neutral nitrogen compounds
1099	30	33	1	1	0	15	423.274	0.0	Neutral nitrogen compounds
1100	29	33	2	1	0	14	427.274	0.0	Neutral nitrogen compounds
1101	32	33	0	1	0	17	431.274	3e-06	Neutral nitrogen compounds
1102	31	33	1	1	0	16	435.274	0.0	Neutral nitrogen compounds
1103	30	33	2	1	0	15	439.274	0.0	Neutral nitrogen compounds
1104	33	33	0	1	0	18	443.274	2e-06	Neutral nitrogen compounds
1105	32	33	1	1	0	17	447.274	0.0	Neutral nitrogen compounds
1106	34	33	0	1	0	19	455.274	1e-06	Neutral nitrogen compounds
1107	33	33	1	1	0	18	459.274	0.0	Neutral nitrogen compounds
1108	35	33	0	1	0	20	467.274	1e-06	Neutral nitrogen compounds
1109	36	33	0	1	0	21	479.274	0.0	Neutral nitrogen compounds
1110	37	33	0	1	0	22	491.274	0.0	Neutral nitrogen compounds
1111	38	33	0	1	0	23	503.274	0.0	Neutral nitrogen compounds
1112	39	33	0	1	0	24	515.274	0.0	Neutral nitrogen compounds
1113	40	33	0	1	0	25	527.274	0.0	Neutral nitrogen compounds
1114	22	35	0	1	0	6	313.29	0.0	Neutral nitrogen compounds
1115	23	35	0	1	0	7	325.29	0.0	Neutral nitrogen compounds
1116	24	35	0	1	0	8	337.29	1e-06	Neutral nitrogen compounds
1117	25	35	0	1	0	9	349.29	6e-06	Neutral nitrogen compounds
1118	24	35	1	1	0	8	353.29	0.0	Neutral nitrogen compounds
1119	26	35	0	1	0	10	361.29	6e-06	Neutral nitrogen compounds
1120	25	35	1	1	0	9	365.29	0.0	Neutral nitrogen compounds
1121	27	35	0	1	0	11	373.29	9e-06	Neutral nitrogen compounds
1122	26	35	1	1	0	10	377.29	0.0	Neutral nitrogen compounds
1123	25	35	2	1	0	9	381.29	0.0	Neutral nitrogen compounds
1124	28	35	0	1	0	12	385.29	1e-05	Neutral nitrogen compounds
1125	27	35	1	1	0	11	389.29	0.0	Neutral nitrogen compounds
1126	26	35	2	1	0	10	393.29	0.0	Neutral nitrogen compounds
1127	29	35	0	1	0	13	397.29	8e-06	Neutral nitrogen compounds
1128	28	35	1	1	0	12	401.29	0.0	Neutral nitrogen compounds
1129	27	35	2	1	0	11	405.29	0.0	Neutral nitrogen compounds
1130	30	35	0	1	0	14	409.29	6e-06	Neutral nitrogen compounds
1131	29	35	1	1	0	13	413.29	0.0	Neutral nitrogen compounds
1132	28	35	2	1	0	12	417.29	0.0	Neutral nitrogen compounds
1133	31	35	0	1	0	15	421.29	5e-06	Neutral nitrogen compounds
1134	30	35	1	1	0	14	425.29	0.0	Neutral nitrogen compounds
1135	29	35	2	1	0	13	429.29	0.0	Neutral nitrogen compounds
1136	32	35	0	1	0	16	433.29	3e-06	Neutral nitrogen compounds
1137	31	35	1	1	0	15	437.29	0.0	Neutral nitrogen compounds
1138	30	35	2	1	0	14	441.29	0.0	Neutral nitrogen compounds
1139	33	35	0	1	0	17	445.29	2e-06	Neutral nitrogen compounds
1140	32	35	1	1	0	16	449.29	0.0	Neutral nitrogen compounds
1141	31	35	2	1	0	15	453.29	0.0	Neutral nitrogen compounds
1142	34	35	0	1	0	18	457.29	1e-06	Neutral nitrogen compounds
1143	33	35	1	1	0	17	461.29	0.0	Neutral nitrogen compounds
1144	35	35	0	1	0	19	469.29	1e-06	Neutral nitrogen compounds
1145	34	35	1	1	0	18	473.29	0.0	Neutral nitrogen compounds
1146	36	35	0	1	0	20	481.29	1e-06	Neutral nitrogen compounds
1147	37	35	0	1	0	21	493.29	0.0	Neutral nitrogen compounds
1148	38	35	0	1	0	22	505.29	0.0	Neutral nitrogen compounds
1149	39	35	0	1	0	23	517.29	0.0	Neutral nitrogen compounds
1150	40	35	0	1	0	24	529.29	0.0	Neutral nitrogen compounds
1151	23	37	0	1	0	6	327.306	0.0	Neutral nitrogen compounds
1152	24	37	0	1	0	7	339.306	0.0	Neutral nitrogen compounds
1153	25	37	0	1	0	8	351.306	1e-06	Neutral nitrogen compounds
1154	26	37	0	1	0	9	363.306	5e-06	Neutral nitrogen compounds
1155	25	37	1	1	0	8	367.306	0.0	Neutral nitrogen compounds
1156	27	37	0	1	0	10	375.306	5e-06	Neutral nitrogen compounds
1157	26	37	1	1	0	9	379.306	0.0	Neutral nitrogen compounds
1158	28	37	0	1	0	11	387.306	7e-06	Neutral nitrogen compounds
1159	27	37	1	1	0	10	391.306	0.0	Neutral nitrogen compounds
1160	26	37	2	1	0	9	395.306	0.0	Neutral nitrogen compounds
1161	29	37	0	1	0	12	399.306	8e-06	Neutral nitrogen compounds
1162	28	37	1	1	0	11	403.306	0.0	Neutral nitrogen compounds
1163	27	37	2	1	0	10	407.306	0.0	Neutral nitrogen compounds
1164	30	37	0	1	0	13	411.306	6e-06	Neutral nitrogen compounds
1165	29	37	1	1	0	12	415.306	0.0	Neutral nitrogen compounds
1166	28	37	2	1	0	11	419.306	0.0	Neutral nitrogen compounds
1167	31	37	0	1	0	14	423.306	5e-06	Neutral nitrogen compounds
1168	30	37	1	1	0	13	427.306	0.0	Neutral nitrogen compounds
1169	29	37	2	1	0	12	431.306	0.0	Neutral nitrogen compounds
1170	32	37	0	1	0	15	435.306	4e-06	Neutral nitrogen compounds
1171	31	37	1	1	0	14	439.306	0.0	Neutral nitrogen compounds
1172	30	37	2	1	0	13	443.306	0.0	Neutral nitrogen compounds
1173	33	37	0	1	0	16	447.306	3e-06	Neutral nitrogen compounds
1174	32	37	1	1	0	15	451.306	0.0	Neutral nitrogen compounds
1175	31	37	2	1	0	14	455.306	0.0	Neutral nitrogen compounds
1176	34	37	0	1	0	17	459.306	2e-06	Neutral nitrogen compounds
1177	33	37	1	1	0	16	463.306	0.0	Neutral nitrogen compounds
1178	32	37	2	1	0	15	467.306	0.0	Neutral nitrogen compounds
1179	35	37	0	1	0	18	471.306	1e-06	Neutral nitrogen compounds
1180	36	37	0	1	0	19	483.306	1e-06	Neutral nitrogen compounds
1181	37	37	0	1	0	20	495.306	0.0	Neutral nitrogen compounds
1182	38	37	0	1	0	21	507.306	0.0	Neutral nitrogen compounds
1183	39	37	0	1	0	22	519.306	0.0	Neutral nitrogen compounds
1184	40	37	0	1	0	23	531.306	0.0	Neutral nitrogen compounds
1185	41	37	0	1	0	24	543.306	0.0	Neutral nitrogen compounds
1186	24	39	0	1	0	6	341.322	0.0	Neutral nitrogen compounds
1187	25	39	0	1	0	7	353.322	0.0	Neutral nitrogen compounds
1188	26	39	0	1	0	8	365.322	0.0	Neutral nitrogen compounds
1189	27	39	0	1	0	9	377.322	5e-06	Neutral nitrogen compounds
1190	26	39	1	1	0	8	381.322	0.0	Neutral nitrogen compounds
1191	28	39	0	1	0	10	389.322	5e-06	Neutral nitrogen compounds
1192	27	39	1	1	0	9	393.322	0.0	Neutral nitrogen compounds
1193	29	39	0	1	0	11	401.322	5e-06	Neutral nitrogen compounds
1194	28	39	1	1	0	10	405.322	0.0	Neutral nitrogen compounds
1195	27	39	2	1	0	9	409.322	0.0	Neutral nitrogen compounds
1196	30	39	0	1	0	12	413.322	6e-06	Neutral nitrogen compounds
1197	29	39	1	1	0	11	417.322	0.0	Neutral nitrogen compounds
1198	28	39	2	1	0	10	421.322	0.0	Neutral nitrogen compounds
1199	31	39	0	1	0	13	425.322	5e-06	Neutral nitrogen compounds
1200	30	39	1	1	0	12	429.322	0.0	Neutral nitrogen compounds
1201	29	39	2	1	0	11	433.322	0.0	Neutral nitrogen compounds
1202	32	39	0	1	0	14	437.322	4e-06	Neutral nitrogen compounds
1203	31	39	1	1	0	13	441.322	0.0	Neutral nitrogen compounds
1204	30	39	2	1	0	12	445.322	0.0	Neutral nitrogen compounds
1205	33	39	0	1	0	15	449.322	3e-06	Neutral nitrogen compounds
1206	32	39	1	1	0	14	453.322	0.0	Neutral nitrogen compounds
1207	31	39	2	1	0	13	457.322	0.0	Neutral nitrogen compounds
1208	34	39	0	1	0	16	461.322	2e-06	Neutral nitrogen compounds
1209	33	39	1	1	0	15	465.322	0.0	Neutral nitrogen compounds
1210	32	39	2	1	0	14	469.322	0.0	Neutral nitrogen compounds
1211	35	39	0	1	0	17	473.322	1e-06	Neutral nitrogen compounds
1212	34	39	1	1	0	16	477.322	0.0	Neutral nitrogen compounds
1213	36	39	0	1	0	18	485.322	1e-06	Neutral nitrogen compounds
1214	37	39	0	1	0	19	497.322	1e-06	Neutral nitrogen compounds
1215	38	39	0	1	0	20	509.322	0.0	Neutral nitrogen compounds
1216	39	39	0	1	0	21	521.322	0.0	Neutral nitrogen compounds
1217	40	39	0	1	0	22	533.322	0.0	Neutral nitrogen compounds
1218	41	39	0	1	0	23	545.322	0.0	Neutral nitrogen compounds
1219	43	39	0	1	0	25	569.322	0.0	Neutral nitrogen compounds
1220	25	41	0	1	0	6	355.338	0.0	Neutral nitrogen compounds
1221	26	41	0	1	0	7	367.338	0.0	Neutral nitrogen compounds
1222	27	41	0	1	0	8	379.338	0.0	Neutral nitrogen compounds
1223	28	41	0	1	0	9	391.338	4e-06	Neutral nitrogen compounds
1224	29	41	0	1	0	10	403.338	3e-06	Neutral nitrogen compounds
1225	28	41	1	1	0	9	407.338	0.0	Neutral nitrogen compounds
1226	30	41	0	1	0	11	415.338	5e-06	Neutral nitrogen compounds
1227	29	41	1	1	0	10	419.338	0.0	Neutral nitrogen compounds
1228	28	41	2	1	0	9	423.338	0.0	Neutral nitrogen compounds
1229	31	41	0	1	0	12	427.338	6e-06	Neutral nitrogen compounds
1230	30	41	1	1	0	11	431.338	0.0	Neutral nitrogen compounds
1231	29	41	2	1	0	10	435.338	0.0	Neutral nitrogen compounds
1232	32	41	0	1	0	13	439.338	5e-06	Neutral nitrogen compounds
1233	31	41	1	1	0	12	443.338	0.0	Neutral nitrogen compounds
1234	30	41	2	1	0	11	447.338	0.0	Neutral nitrogen compounds
1235	33	41	0	1	0	14	451.338	3e-06	Neutral nitrogen compounds
1236	32	41	1	1	0	13	455.338	0.0	Neutral nitrogen compounds
1237	31	41	2	1	0	12	459.338	0.0	Neutral nitrogen compounds
1238	34	41	0	1	0	15	463.338	3e-06	Neutral nitrogen compounds
1239	33	41	1	1	0	14	467.338	0.0	Neutral nitrogen compounds
1240	32	41	2	1	0	13	471.338	0.0	Neutral nitrogen compounds
1241	35	41	0	1	0	16	475.338	2e-06	Neutral nitrogen compounds
1242	34	41	1	1	0	15	479.338	0.0	Neutral nitrogen compounds
1243	33	41	2	1	0	14	483.338	0.0	Neutral nitrogen compounds
1244	36	41	0	1	0	17	487.338	1e-06	Neutral nitrogen compounds
1245	35	41	1	1	0	16	491.338	0.0	Neutral nitrogen compounds
1246	34	41	2	1	0	15	495.338	0.0	Neutral nitrogen compounds
1247	37	41	0	1	0	18	499.338	1e-06	Neutral nitrogen compounds
1248	38	41	0	1	0	19	511.338	1e-06	Neutral nitrogen compounds
1249	39	41	0	1	0	20	523.338	0.0	Neutral nitrogen compounds
1250	40	41	0	1	0	21	535.338	0.0	Neutral nitrogen compounds
1251	41	41	0	1	0	22	547.338	0.0	Neutral nitrogen compounds
1252	42	41	0	1	0	23	559.338	0.0	Neutral nitrogen compounds
1253	26	43	0	1	0	6	369.354	0.0	Neutral nitrogen compounds
1254	27	43	0	1	0	7	381.354	0.0	Neutral nitrogen compounds
1255	28	43	0	1	0	8	393.354	0.0	Neutral nitrogen compounds
1256	29	43	0	1	0	9	405.354	3e-06	Neutral nitrogen compounds
1257	28	43	1	1	0	8	409.354	0.0	Neutral nitrogen compounds
1258	30	43	0	1	0	10	417.354	3e-06	Neutral nitrogen compounds
1259	29	43	1	1	0	9	421.354	0.0	Neutral nitrogen compounds
1260	31	43	0	1	0	11	429.354	4e-06	Neutral nitrogen compounds
1261	30	43	1	1	0	10	433.354	0.0	Neutral nitrogen compounds
1262	29	43	2	1	0	9	437.354	0.0	Neutral nitrogen compounds
1263	32	43	0	1	0	12	441.354	5e-06	Neutral nitrogen compounds
1264	31	43	1	1	0	11	445.354	0.0	Neutral nitrogen compounds
1265	30	43	2	1	0	10	449.354	0.0	Neutral nitrogen compounds
1266	33	43	0	1	0	13	453.354	4e-06	Neutral nitrogen compounds
1267	32	43	1	1	0	12	457.354	0.0	Neutral nitrogen compounds
1268	31	43	2	1	0	11	461.354	0.0	Neutral nitrogen compounds
1269	34	43	0	1	0	14	465.354	3e-06	Neutral nitrogen compounds
1270	33	43	1	1	0	13	469.354	0.0	Neutral nitrogen compounds
1271	32	43	2	1	0	12	473.354	0.0	Neutral nitrogen compounds
1272	35	43	0	1	0	15	477.354	2e-06	Neutral nitrogen compounds
1273	34	43	1	1	0	14	481.354	0.0	Neutral nitrogen compounds
1274	33	43	2	1	0	13	485.354	0.0	Neutral nitrogen compounds
1275	36	43	0	1	0	16	489.354	2e-06	Neutral nitrogen compounds
1276	35	43	1	1	0	15	493.354	0.0	Neutral nitrogen compounds
1277	34	43	2	1	0	14	497.354	0.0	Neutral nitrogen compounds
1278	37	43	0	1	0	17	501.354	1e-06	Neutral nitrogen compounds
1279	38	43	0	1	0	18	513.354	1e-06	Neutral nitrogen compounds
1280	39	43	0	1	0	19	525.354	1e-06	Neutral nitrogen compounds
1281	40	43	0	1	0	20	537.354	0.0	Neutral nitrogen compounds
1282	41	43	0	1	0	21	549.354	0.0	Neutral nitrogen compounds
1283	42	43	0	1	0	22	561.354	0.0	Neutral nitrogen compounds
1284	27	45	0	1	0	6	383.37	0.0	Neutral nitrogen compounds
1285	28	45	0	1	0	7	395.37	0.0	Neutral nitrogen compounds
1286	29	45	0	1	0	8	407.37	0.0	Neutral nitrogen compounds
1287	30	45	0	1	0	9	419.37	3e-06	Neutral nitrogen compounds
1288	29	45	1	1	0	8	423.37	0.0	Neutral nitrogen compounds
1289	31	45	0	1	0	10	431.37	3e-06	Neutral nitrogen compounds
1290	30	45	1	1	0	9	435.37	0.0	Neutral nitrogen compounds
1291	32	45	0	1	0	11	443.37	4e-06	Neutral nitrogen compounds
1292	31	45	1	1	0	10	447.37	0.0	Neutral nitrogen compounds
1293	30	45	2	1	0	9	451.37	0.0	Neutral nitrogen compounds
1294	33	45	0	1	0	12	455.37	4e-06	Neutral nitrogen compounds
1295	32	45	1	1	0	11	459.37	0.0	Neutral nitrogen compounds
1296	31	45	2	1	0	10	463.37	0.0	Neutral nitrogen compounds
1297	34	45	0	1	0	13	467.37	3e-06	Neutral nitrogen compounds
1298	33	45	1	1	0	12	471.37	0.0	Neutral nitrogen compounds
1299	32	45	2	1	0	11	475.37	0.0	Neutral nitrogen compounds
1300	35	45	0	1	0	14	479.37	3e-06	Neutral nitrogen compounds
1301	33	45	2	1	0	12	487.37	0.0	Neutral nitrogen compounds
1302	36	45	0	1	0	15	491.37	2e-06	Neutral nitrogen compounds
1303	35	45	1	1	0	14	495.37	0.0	Neutral nitrogen compounds
1304	34	45	2	1	0	13	499.37	0.0	Neutral nitrogen compounds
1305	37	45	0	1	0	16	503.37	1e-06	Neutral nitrogen compounds
1306	35	45	2	1	0	14	511.37	0.0	Neutral nitrogen compounds
1307	38	45	0	1	0	17	515.37	1e-06	Neutral nitrogen compounds
1308	37	45	1	1	0	16	519.37	0.0	Neutral nitrogen compounds
1309	39	45	0	1	0	18	527.37	1e-06	Neutral nitrogen compounds
1310	40	45	0	1	0	19	539.37	0.0	Neutral nitrogen compounds
1311	41	45	0	1	0	20	551.37	0.0	Neutral nitrogen compounds
1312	42	45	0	1	0	21	563.37	0.0	Neutral nitrogen compounds
1313	43	45	0	1	0	22	575.37	0.0	Neutral nitrogen compounds
1314	45	45	0	1	0	24	599.37	0.0	Neutral nitrogen compounds
1315	62	45	2	1	0	41	835.37	0.0	Neutral nitrogen compounds
1316	28	47	0	1	0	6	397.386	0.0	Neutral nitrogen compounds
1317	29	47	0	1	0	7	409.386	0.0	Neutral nitrogen compounds
1318	30	47	0	1	0	8	421.386	0.0	Neutral nitrogen compounds
1319	31	47	0	1	0	9	433.386	3e-06	Neutral nitrogen compounds
1320	30	47	1	1	0	8	437.386	0.0	Neutral nitrogen compounds
1321	32	47	0	1	0	10	445.386	2e-06	Neutral nitrogen compounds
1322	31	47	1	1	0	9	449.386	0.0	Neutral nitrogen compounds
1323	33	47	0	1	0	11	457.386	3e-06	Neutral nitrogen compounds
1324	32	47	1	1	0	10	461.386	0.0	Neutral nitrogen compounds
1325	31	47	2	1	0	9	465.386	0.0	Neutral nitrogen compounds
1326	34	47	0	1	0	12	469.386	3e-06	Neutral nitrogen compounds
1327	33	47	1	1	0	11	473.386	0.0	Neutral nitrogen compounds
1328	32	47	2	1	0	10	477.386	0.0	Neutral nitrogen compounds
1329	35	47	0	1	0	13	481.386	2e-06	Neutral nitrogen compounds
1330	34	47	1	1	0	12	485.386	0.0	Neutral nitrogen compounds
1331	33	47	2	1	0	11	489.386	0.0	Neutral nitrogen compounds
1332	36	47	0	1	0	14	493.386	2e-06	Neutral nitrogen compounds
1333	35	47	1	1	0	13	497.386	0.0	Neutral nitrogen compounds
1334	34	47	2	1	0	12	501.386	0.0	Neutral nitrogen compounds
1335	37	47	0	1	0	15	505.386	2e-06	Neutral nitrogen compounds
1336	36	47	1	1	0	14	509.386	0.0	Neutral nitrogen compounds
1337	35	47	2	1	0	13	513.386	0.0	Neutral nitrogen compounds
1338	38	47	0	1	0	16	517.386	1e-06	Neutral nitrogen compounds
1339	36	47	2	1	0	14	525.386	0.0	Neutral nitrogen compounds
1340	39	47	0	1	0	17	529.386	1e-06	Neutral nitrogen compounds
1341	37	47	2	1	0	15	537.386	0.0	Neutral nitrogen compounds
1342	40	47	0	1	0	18	541.386	0.0	Neutral nitrogen compounds
1343	41	47	0	1	0	19	553.386	0.0	Neutral nitrogen compounds
1344	42	47	0	1	0	20	565.386	0.0	Neutral nitrogen compounds
1345	43	47	0	1	0	21	577.386	0.0	Neutral nitrogen compounds
1346	44	47	0	1	0	22	589.386	0.0	Neutral nitrogen compounds
1347	29	49	0	1	0	6	411.402	0.0	Neutral nitrogen compounds
1348	30	49	0	1	0	7	423.402	0.0	Neutral nitrogen compounds
1349	31	49	0	1	0	8	435.402	0.0	Neutral nitrogen compounds
1350	32	49	0	1	0	9	447.402	2e-06	Neutral nitrogen compounds
1351	33	49	0	1	0	10	459.402	2e-06	Neutral nitrogen compounds
1352	34	49	0	1	0	11	471.402	3e-06	Neutral nitrogen compounds
1353	32	49	2	1	0	9	479.402	0.0	Neutral nitrogen compounds
1354	35	49	0	1	0	12	483.402	3e-06	Neutral nitrogen compounds
1355	33	49	2	1	0	10	491.402	0.0	Neutral nitrogen compounds
1356	36	49	0	1	0	13	495.402	2e-06	Neutral nitrogen compounds
1357	34	49	2	1	0	11	503.402	0.0	Neutral nitrogen compounds
1358	37	49	0	1	0	14	507.402	2e-06	Neutral nitrogen compounds
1359	36	49	1	1	0	13	511.402	0.0	Neutral nitrogen compounds
1360	35	49	2	1	0	12	515.402	0.0	Neutral nitrogen compounds
1361	38	49	0	1	0	15	519.402	1e-06	Neutral nitrogen compounds
1362	37	49	1	1	0	14	523.402	0.0	Neutral nitrogen compounds
1363	36	49	2	1	0	13	527.402	0.0	Neutral nitrogen compounds
1364	39	49	0	1	0	16	531.402	1e-06	Neutral nitrogen compounds
1365	37	49	2	1	0	14	539.402	0.0	Neutral nitrogen compounds
1366	40	49	0	1	0	17	543.402	1e-06	Neutral nitrogen compounds
1367	38	49	2	1	0	15	551.402	0.0	Neutral nitrogen compounds
1368	41	49	0	1	0	18	555.402	0.0	Neutral nitrogen compounds
1369	42	49	0	1	0	19	567.402	0.0	Neutral nitrogen compounds
1370	43	49	0	1	0	20	579.402	0.0	Neutral nitrogen compounds
1371	44	49	0	1	0	21	591.402	0.0	Neutral nitrogen compounds
1372	30	51	0	1	0	6	425.418	0.0	Neutral nitrogen compounds
1373	31	51	0	1	0	7	437.418	0.0	Neutral nitrogen compounds
1374	32	51	0	1	0	8	449.418	0.0	Neutral nitrogen compounds
1375	33	51	0	1	0	9	461.418	2e-06	Neutral nitrogen compounds
1376	34	51	0	1	0	10	473.418	2e-06	Neutral nitrogen compounds
1377	35	51	0	1	0	11	485.418	2e-06	Neutral nitrogen compounds
1378	33	51	2	1	0	9	493.418	0.0	Neutral nitrogen compounds
1379	36	51	0	1	0	12	497.418	2e-06	Neutral nitrogen compounds
1380	34	51	2	1	0	10	505.418	0.0	Neutral nitrogen compounds
1381	37	51	0	1	0	13	509.418	2e-06	Neutral nitrogen compounds
1382	35	51	2	1	0	11	517.418	0.0	Neutral nitrogen compounds
1383	38	51	0	1	0	14	521.418	2e-06	Neutral nitrogen compounds
1384	37	51	1	1	0	13	525.418	0.0	Neutral nitrogen compounds
1385	36	51	2	1	0	12	529.418	0.0	Neutral nitrogen compounds
1386	39	51	0	1	0	15	533.418	1e-06	Neutral nitrogen compounds
1387	38	51	1	1	0	14	537.418	0.0	Neutral nitrogen compounds
1388	37	51	2	1	0	13	541.418	0.0	Neutral nitrogen compounds
1389	40	51	0	1	0	16	545.418	1e-06	Neutral nitrogen compounds
1390	38	51	2	1	0	14	553.418	0.0	Neutral nitrogen compounds
1391	41	51	0	1	0	17	557.418	1e-06	Neutral nitrogen compounds
1392	39	51	2	1	0	15	565.418	0.0	Neutral nitrogen compounds
1393	42	51	0	1	0	18	569.418	0.0	Neutral nitrogen compounds
1394	43	51	0	1	0	19	581.418	0.0	Neutral nitrogen compounds
1395	44	51	0	1	0	20	593.418	0.0	Neutral nitrogen compounds
1396	45	51	0	1	0	21	605.418	0.0	Neutral nitrogen compounds
1397	31	53	0	1	0	6	439.434	0.0	Neutral nitrogen compounds
1398	33	53	0	1	0	8	463.434	0.0	Neutral nitrogen compounds
1399	34	53	0	1	0	9	475.434	2e-06	Neutral nitrogen compounds
1400	35	53	0	1	0	10	487.434	2e-06	Neutral nitrogen compounds
1401	36	53	0	1	0	11	499.434	2e-06	Neutral nitrogen compounds
1402	34	53	2	1	0	9	507.434	0.0	Neutral nitrogen compounds
1403	37	53	0	1	0	12	511.434	2e-06	Neutral nitrogen compounds
1404	35	53	2	1	0	10	519.434	0.0	Neutral nitrogen compounds
1405	38	53	0	1	0	13	523.434	2e-06	Neutral nitrogen compounds
1406	36	53	2	1	0	11	531.434	0.0	Neutral nitrogen compounds
1407	39	53	0	1	0	14	535.434	1e-06	Neutral nitrogen compounds
1408	37	53	2	1	0	12	543.434	0.0	Neutral nitrogen compounds
1409	40	53	0	1	0	15	547.434	1e-06	Neutral nitrogen compounds
1410	38	53	2	1	0	13	555.434	0.0	Neutral nitrogen compounds
1411	41	53	0	1	0	16	559.434	1e-06	Neutral nitrogen compounds
1412	39	53	2	1	0	14	567.434	0.0	Neutral nitrogen compounds
1413	42	53	0	1	0	17	571.434	1e-06	Neutral nitrogen compounds
1414	40	53	2	1	0	15	579.434	0.0	Neutral nitrogen compounds
1415	43	53	0	1	0	18	583.434	0.0	Neutral nitrogen compounds
1416	44	53	0	1	0	19	595.434	0.0	Neutral nitrogen compounds
1417	45	53	0	1	0	20	607.434	0.0	Neutral nitrogen compounds
1418	46	53	0	1	0	21	619.434	0.0	Neutral nitrogen compounds
1419	49	53	0	1	0	24	655.434	0.0	Neutral nitrogen compounds
1420	32	55	0	1	0	6	453.45	0.0	Neutral nitrogen compounds
1421	33	55	0	1	0	7	465.45	0.0	Neutral nitrogen compounds
1422	34	55	0	1	0	8	477.45	0.0	Neutral nitrogen compounds
1423	35	55	0	1	0	9	489.45	1e-06	Neutral nitrogen compounds
1424	36	55	0	1	0	10	501.45	2e-06	Neutral nitrogen compounds
1425	37	55	0	1	0	11	513.45	2e-06	Neutral nitrogen compounds
1426	35	55	2	1	0	9	521.45	0.0	Neutral nitrogen compounds
1427	38	55	0	1	0	12	525.45	2e-06	Neutral nitrogen compounds
1428	36	55	2	1	0	10	533.45	0.0	Neutral nitrogen compounds
1429	39	55	0	1	0	13	537.45	2e-06	Neutral nitrogen compounds
1430	37	55	2	1	0	11	545.45	0.0	Neutral nitrogen compounds
1431	40	55	0	1	0	14	549.45	1e-06	Neutral nitrogen compounds
1432	38	55	2	1	0	12	557.45	0.0	Neutral nitrogen compounds
1433	41	55	0	1	0	15	561.45	1e-06	Neutral nitrogen compounds
1434	39	55	2	1	0	13	569.45	0.0	Neutral nitrogen compounds
1435	42	55	0	1	0	16	573.45	1e-06	Neutral nitrogen compounds
1436	40	55	2	1	0	14	581.45	0.0	Neutral nitrogen compounds
1437	43	55	0	1	0	17	585.45	0.0	Neutral nitrogen compounds
1438	44	55	0	1	0	18	597.45	0.0	Neutral nitrogen compounds
1439	45	55	0	1	0	19	609.45	0.0	Neutral nitrogen compounds
1440	46	55	0	1	0	20	621.45	0.0	Neutral nitrogen compounds
1441	49	55	0	1	0	23	657.45	0.0	Neutral nitrogen compounds
1442	35	57	0	1	0	8	491.466	0.0	Neutral nitrogen compounds
1443	36	57	0	1	0	9	503.466	2e-06	Neutral nitrogen compounds
1444	37	57	0	1	0	10	515.466	1e-06	Neutral nitrogen compounds
1445	38	57	0	1	0	11	527.466	2e-06	Neutral nitrogen compounds
1446	39	57	0	1	0	12	539.466	2e-06	Neutral nitrogen compounds
1447	37	57	2	1	0	10	547.466	0.0	Neutral nitrogen compounds
1448	40	57	0	1	0	13	551.466	1e-06	Neutral nitrogen compounds
1449	38	57	2	1	0	11	559.466	0.0	Neutral nitrogen compounds
1450	41	57	0	1	0	14	563.466	1e-06	Neutral nitrogen compounds
1451	39	57	2	1	0	12	571.466	0.0	Neutral nitrogen compounds
1452	42	57	0	1	0	15	575.466	1e-06	Neutral nitrogen compounds
1453	40	57	2	1	0	13	583.466	0.0	Neutral nitrogen compounds
1454	43	57	0	1	0	16	587.466	1e-06	Neutral nitrogen compounds
1455	41	57	2	1	0	14	595.466	0.0	Neutral nitrogen compounds
1456	44	57	0	1	0	17	599.466	0.0	Neutral nitrogen compounds
1457	45	57	0	1	0	18	611.466	0.0	Neutral nitrogen compounds
1458	46	57	0	1	0	19	623.466	0.0	Neutral nitrogen compounds
1459	47	57	0	1	0	20	635.466	0.0	Neutral nitrogen compounds
1460	48	57	0	1	0	21	647.466	0.0	Neutral nitrogen compounds
1461	35	59	0	1	0	7	493.482	0.0	Neutral nitrogen compounds
1462	36	59	0	1	0	8	505.482	0.0	Neutral nitrogen compounds
1463	37	59	0	1	0	9	517.482	1e-06	Neutral nitrogen compounds
1464	38	59	0	1	0	10	529.482	1e-06	Neutral nitrogen compounds
1465	39	59	0	1	0	11	541.482	1e-06	Neutral nitrogen compounds
1466	40	59	0	1	0	12	553.482	1e-06	Neutral nitrogen compounds
1467	38	59	2	1	0	10	561.482	0.0	Neutral nitrogen compounds
1468	41	59	0	1	0	13	565.482	1e-06	Neutral nitrogen compounds
1469	39	59	2	1	0	11	573.482	0.0	Neutral nitrogen compounds
1470	42	59	0	1	0	14	577.482	1e-06	Neutral nitrogen compounds
1471	40	59	2	1	0	12	585.482	0.0	Neutral nitrogen compounds
1472	43	59	0	1	0	15	589.482	1e-06	Neutral nitrogen compounds
1473	41	59	2	1	0	13	597.482	0.0	Neutral nitrogen compounds
1474	44	59	0	1	0	16	601.482	0.0	Neutral nitrogen compounds
1475	42	59	2	1	0	14	609.482	0.0	Neutral nitrogen compounds
1476	45	59	0	1	0	17	613.482	0.0	Neutral nitrogen compounds
1477	46	59	0	1	0	18	625.482	0.0	Neutral nitrogen compounds
1478	47	59	0	1	0	19	637.482	0.0	Neutral nitrogen compounds
1479	48	59	0	1	0	20	649.482	0.0	Neutral nitrogen compounds
1480	37	61	0	1	0	8	519.498	0.0	Neutral nitrogen compounds
1481	38	61	0	1	0	9	531.498	1e-06	Neutral nitrogen compounds
1482	39	61	0	1	0	10	543.498	1e-06	Neutral nitrogen compounds
1483	40	61	0	1	0	11	555.498	1e-06	Neutral nitrogen compounds
1484	41	61	0	1	0	12	567.498	1e-06	Neutral nitrogen compounds
1485	39	61	2	1	0	10	575.498	0.0	Neutral nitrogen compounds
1486	42	61	0	1	0	13	579.498	1e-06	Neutral nitrogen compounds
1487	40	61	2	1	0	11	587.498	0.0	Neutral nitrogen compounds
1488	43	61	0	1	0	14	591.498	1e-06	Neutral nitrogen compounds
1489	41	61	2	1	0	12	599.498	0.0	Neutral nitrogen compounds
1490	44	61	0	1	0	15	603.498	1e-06	Neutral nitrogen compounds
1491	42	61	2	1	0	13	611.498	0.0	Neutral nitrogen compounds
1492	45	61	0	1	0	16	615.498	0.0	Neutral nitrogen compounds
1493	43	61	2	1	0	14	623.498	0.0	Neutral nitrogen compounds
1494	46	61	0	1	0	17	627.498	0.0	Neutral nitrogen compounds
1495	47	61	0	1	0	18	639.498	0.0	Neutral nitrogen compounds
1496	48	61	0	1	0	19	651.498	0.0	Neutral nitrogen compounds
1497	49	61	0	1	0	20	663.498	0.0	Neutral nitrogen compounds
1498	38	63	0	1	0	8	533.514	0.0	Neutral nitrogen compounds
1499	39	63	0	1	0	9	545.514	1e-06	Neutral nitrogen compounds
1500	40	63	0	1	0	10	557.514	1e-06	Neutral nitrogen compounds
1501	41	63	0	1	0	11	569.514	1e-06	Neutral nitrogen compounds
1502	39	63	2	1	0	9	577.514	0.0	Neutral nitrogen compounds
1503	42	63	0	1	0	12	581.514	1e-06	Neutral nitrogen compounds
1504	40	63	2	1	0	10	589.514	0.0	Neutral nitrogen compounds
1505	43	63	0	1	0	13	593.514	1e-06	Neutral nitrogen compounds
1506	41	63	2	1	0	11	601.514	0.0	Neutral nitrogen compounds
1507	44	63	0	1	0	14	605.514	1e-06	Neutral nitrogen compounds
1508	42	63	2	1	0	12	613.514	0.0	Neutral nitrogen compounds
1509	45	63	0	1	0	15	617.514	1e-06	Neutral nitrogen compounds
1510	43	63	2	1	0	13	625.514	0.0	Neutral nitrogen compounds
1511	46	63	0	1	0	16	629.514	0.0	Neutral nitrogen compounds
1512	47	63	0	1	0	17	641.514	0.0	Neutral nitrogen compounds
1513	48	63	0	1	0	18	653.514	0.0	Neutral nitrogen compounds
1514	49	63	0	1	0	19	665.514	0.0	Neutral nitrogen compounds
1515	50	63	0	1	0	20	677.514	0.0	Neutral nitrogen compounds
1516	39	65	0	1	0	8	547.53	0.0	Neutral nitrogen compounds
1517	40	65	0	1	0	9	559.53	1e-06	Neutral nitrogen compounds
1518	41	65	0	1	0	10	571.53	1e-06	Neutral nitrogen compounds
1519	42	65	0	1	0	11	583.53	1e-06	Neutral nitrogen compounds
1520	40	65	2	1	0	9	591.53	0.0	Neutral nitrogen compounds
1521	43	65	0	1	0	12	595.53	1e-06	Neutral nitrogen compounds
1522	44	65	0	1	0	13	607.53	1e-06	Neutral nitrogen compounds
1523	42	65	2	1	0	11	615.53	0.0	Neutral nitrogen compounds
1524	45	65	0	1	0	14	619.53	1e-06	Neutral nitrogen compounds
1525	43	65	2	1	0	12	627.53	0.0	Neutral nitrogen compounds
1526	46	65	0	1	0	15	631.53	1e-06	Neutral nitrogen compounds
1527	44	65	2	1	0	13	639.53	0.0	Neutral nitrogen compounds
1528	47	65	0	1	0	16	643.53	0.0	Neutral nitrogen compounds
1529	45	65	2	1	0	14	651.53	0.0	Neutral nitrogen compounds
1530	48	65	0	1	0	17	655.53	0.0	Neutral nitrogen compounds
1531	46	65	2	1	0	15	663.53	0.0	Neutral nitrogen compounds
1532	49	65	0	1	0	18	667.53	0.0	Neutral nitrogen compounds
1533	50	65	0	1	0	19	679.53	0.0	Neutral nitrogen compounds
1534	40	67	0	1	0	8	561.546	0.0	Neutral nitrogen compounds
1535	41	67	0	1	0	9	573.546	1e-06	Neutral nitrogen compounds
1536	42	67	0	1	0	10	585.546	1e-06	Neutral nitrogen compounds
1537	43	67	0	1	0	11	597.546	0.0	Neutral nitrogen compounds
1538	44	67	0	1	0	12	609.546	1e-06	Neutral nitrogen compounds
1539	45	67	0	1	0	13	621.546	0.0	Neutral nitrogen compounds
1540	43	67	2	1	0	11	629.546	0.0	Neutral nitrogen compounds
1541	46	67	0	1	0	14	633.546	1e-06	Neutral nitrogen compounds
1542	44	67	2	1	0	12	641.546	0.0	Neutral nitrogen compounds
1543	47	67	0	1	0	15	645.546	0.0	Neutral nitrogen compounds
1544	45	67	2	1	0	13	653.546	0.0	Neutral nitrogen compounds
1545	48	67	0	1	0	16	657.546	0.0	Neutral nitrogen compounds
1546	49	67	0	1	0	17	669.546	0.0	Neutral nitrogen compounds
1547	50	67	0	1	0	18	681.546	0.0	Neutral nitrogen compounds
1548	42	69	0	1	0	9	587.562	1e-06	Neutral nitrogen compounds
1549	43	69	0	1	0	10	599.562	0.0	Neutral nitrogen compounds
1550	44	69	0	1	0	11	611.562	1e-06	Neutral nitrogen compounds
1551	45	69	0	1	0	12	623.562	1e-06	Neutral nitrogen compounds
1552	46	69	0	1	0	13	635.562	1e-06	Neutral nitrogen compounds
1553	44	69	2	1	0	11	643.562	0.0	Neutral nitrogen compounds
1554	47	69	0	1	0	14	647.562	0.0	Neutral nitrogen compounds
1555	45	69	2	1	0	12	655.562	0.0	Neutral nitrogen compounds
1556	48	69	0	1	0	15	659.562	0.0	Neutral nitrogen compounds
1557	49	69	0	1	0	16	671.562	0.0	Neutral nitrogen compounds
1558	50	69	0	1	0	17	683.562	0.0	Neutral nitrogen compounds
1559	51	69	0	1	0	18	695.562	0.0	Neutral nitrogen compounds
1560	42	71	0	1	0	8	589.578	0.0	Neutral nitrogen compounds
1561	43	71	0	1	0	9	601.578	0.0	Neutral nitrogen compounds
1562	44	71	0	1	0	10	613.578	0.0	Neutral nitrogen compounds
1563	45	71	0	1	0	11	625.578	0.0	Neutral nitrogen compounds
1564	46	71	0	1	0	12	637.578	0.0	Neutral nitrogen compounds
1565	47	71	0	1	0	13	649.578	0.0	Neutral nitrogen compounds
1566	48	71	0	1	0	14	661.578	0.0	Neutral nitrogen compounds
1567	46	71	2	1	0	12	669.578	0.0	Neutral nitrogen compounds
1568	49	71	0	1	0	15	673.578	0.0	Neutral nitrogen compounds
1569	50	71	0	1	0	16	685.578	0.0	Neutral nitrogen compounds
1570	51	71	0	1	0	17	697.578	0.0	Neutral nitrogen compounds
1571	52	71	0	1	0	18	709.578	0.0	Neutral nitrogen compounds
1572	44	73	0	1	0	9	615.594	0.0	Neutral nitrogen compounds
1573	45	73	0	1	0	10	627.594	0.0	Neutral nitrogen compounds
1574	46	73	0	1	0	11	639.594	0.0	Neutral nitrogen compounds
1575	47	73	0	1	0	12	651.594	0.0	Neutral nitrogen compounds
1576	48	73	0	1	0	13	663.594	0.0	Neutral nitrogen compounds
1577	49	73	0	1	0	14	675.594	0.0	Neutral nitrogen compounds
1578	50	73	0	1	0	15	687.594	0.0	Neutral nitrogen compounds
1579	51	73	0	1	0	16	699.594	0.0	Neutral nitrogen compounds
1580	52	73	0	1	0	17	711.594	0.0	Neutral nitrogen compounds
1581	53	73	0	1	0	18	723.594	0.0	Neutral nitrogen compounds
1582	45	75	0	1	0	9	629.61	0.0	Neutral nitrogen compounds
1583	46	75	0	1	0	10	641.61	0.0	Neutral nitrogen compounds
1584	47	75	0	1	0	11	653.61	0.0	Neutral nitrogen compounds
1585	48	75	0	1	0	12	665.61	0.0	Neutral nitrogen compounds
1586	49	75	0	1	0	13	677.61	0.0	Neutral nitrogen compounds
1587	50	75	0	1	0	14	689.61	0.0	Neutral nitrogen compounds
1588	51	75	0	1	0	15	701.61	0.0	Neutral nitrogen compounds
1589	52	75	0	1	0	16	713.61	0.0	Neutral nitrogen compounds
1590	53	75	0	1	0	17	725.61	0.0	Neutral nitrogen compounds
1591	46	77	0	1	0	9	643.626	0.0	Neutral nitrogen compounds
1592	47	77	0	1	0	10	655.626	0.0	Neutral nitrogen compounds
1593	48	77	0	1	0	11	667.626	0.0	Neutral nitrogen compounds
1594	49	77	0	1	0	12	679.626	0.0	Neutral nitrogen compounds
1595	50	77	0	1	0	13	691.626	0.0	Neutral nitrogen compounds
1596	51	77	0	1	0	14	703.626	0.0	Neutral nitrogen compounds
1597	52	77	0	1	0	15	715.626	0.0	Neutral nitrogen compounds
1598	54	77	0	1	0	17	739.626	0.0	Neutral nitrogen compounds
1599	47	79	0	1	0	9	657.642	0.0	Neutral nitrogen compounds
1600	48	79	0	1	0	10	669.642	0.0	Neutral nitrogen compounds
1601	49	79	0	1	0	11	681.642	0.0	Neutral nitrogen compounds
1602	50	79	0	1	0	12	693.642	0.0	Neutral nitrogen compounds
1603	51	79	0	1	0	13	705.642	0.0	Neutral nitrogen compounds
1604	52	79	0	1	0	14	717.642	0.0	Neutral nitrogen compounds
1605	53	79	0	1	0	15	729.642	0.0	Neutral nitrogen compounds
1606	48	81	0	1	0	9	671.658	0.0	Neutral nitrogen compounds
1607	49	81	0	1	0	10	683.658	0.0	Neutral nitrogen compounds
1608	50	81	0	1	0	11	695.658	0.0	Neutral nitrogen compounds
1609	51	81	0	1	0	12	707.658	0.0	Neutral nitrogen compounds
1610	52	81	0	1	0	13	719.658	0.0	Neutral nitrogen compounds
1611	53	81	0	1	0	14	731.658	0.0	Neutral nitrogen compounds
1612	54	81	0	1	0	15	743.658	0.0	Neutral nitrogen compounds
1613	49	83	0	1	0	9	685.674	0.0	Neutral nitrogen compounds
1614	50	83	0	1	0	10	697.674	0.0	Neutral nitrogen compounds
1615	51	83	0	1	0	11	709.674	0.0	Neutral nitrogen compounds
1616	52	83	0	1	0	12	721.674	0.0	Neutral nitrogen compounds
1617	53	83	0	1	0	13	733.674	0.0	Neutral nitrogen compounds
1618	54	83	0	1	0	14	745.674	0.0	Neutral nitrogen compounds
1619	55	83	0	1	0	15	757.674	0.0	Neutral nitrogen compounds
1620	51	85	0	1	0	10	711.69	0.0	Neutral nitrogen compounds
1621	52	85	0	1	0	11	723.69	0.0	Neutral nitrogen compounds
1622	53	85	0	1	0	12	735.69	0.0	Neutral nitrogen compounds
1623	54	85	0	1	0	13	747.69	0.0	Neutral nitrogen compounds
1624	51	87	0	1	0	9	713.706	0.0	Neutral nitrogen compounds
1625	52	87	0	1	0	10	725.706	0.0	Neutral nitrogen compounds
1626	53	87	0	1	0	11	737.706	0.0	Neutral nitrogen compounds
1627	54	87	0	1	0	12	749.706	0.0	Neutral nitrogen compounds
1628	57	91	0	1	0	13	789.738	0.0	Neutral nitrogen compounds
1629	69	123	0	1	0	9	965.994	0.0	Neutral nitrogen compounds
1630	68	127	0	1	0	6	958.026	1e-06	Neutral nitrogen compounds
1631	12	13	0	1	0	7	171.114	0.0	Basic nitrogen compounds
1632	13	13	0	1	0	8	183.114	0.0	Basic nitrogen compounds
1633	14	13	0	1	0	9	195.114	0.0	Basic nitrogen compounds
1634	15	13	0	1	0	10	207.114	2e-06	Basic nitrogen compounds
1635	16	13	0	1	0	11	219.114	0.0	Basic nitrogen compounds
1636	17	13	0	1	0	12	231.114	0.0	Basic nitrogen compounds
1637	18	13	0	1	0	13	243.114	0.0	Basic nitrogen compounds
1638	19	13	0	1	0	14	255.114	0.0	Basic nitrogen compounds
1639	20	13	0	1	0	15	267.114	0.0	Basic nitrogen compounds
1640	50	13	0	1	0	45	627.114	0.0	Basic nitrogen compounds
1641	13	15	0	1	0	7	185.13	1e-06	Basic nitrogen compounds
1642	14	15	0	1	0	8	197.13	0.0	Basic nitrogen compounds
1643	15	15	0	1	0	9	209.13	0.0	Basic nitrogen compounds
1644	16	15	0	1	0	10	221.13	3e-06	Basic nitrogen compounds
1645	17	15	0	1	0	11	233.13	0.0	Basic nitrogen compounds
1646	18	15	0	1	0	12	245.13	1e-06	Basic nitrogen compounds
1647	19	15	0	1	0	13	257.13	1e-06	Basic nitrogen compounds
1648	20	15	0	1	0	14	269.13	0.0	Basic nitrogen compounds
1649	21	15	0	1	0	15	281.13	0.0	Basic nitrogen compounds
1650	22	15	0	1	0	16	293.13	0.0	Basic nitrogen compounds
1651	23	15	0	1	0	17	305.13	0.0	Basic nitrogen compounds
1652	24	15	0	1	0	18	317.13	0.0	Basic nitrogen compounds
1653	52	15	0	1	0	46	653.13	0.0	Basic nitrogen compounds
1654	12	17	0	1	0	5	175.146	0.0	Basic nitrogen compounds
1655	13	17	0	1	0	6	187.146	0.0	Basic nitrogen compounds
1656	14	17	0	1	0	7	199.146	0.0	Basic nitrogen compounds
1657	15	17	0	1	0	8	211.146	0.0	Basic nitrogen compounds
1658	16	17	0	1	0	9	223.146	0.0	Basic nitrogen compounds
1659	17	17	0	1	0	10	235.146	2e-06	Basic nitrogen compounds
1660	18	17	0	1	0	11	247.146	2e-06	Basic nitrogen compounds
1661	19	17	0	1	0	12	259.146	2e-06	Basic nitrogen compounds
1662	20	17	0	1	0	13	271.146	1e-06	Basic nitrogen compounds
1663	21	17	0	1	0	14	283.146	1e-06	Basic nitrogen compounds
1664	22	17	0	1	0	15	295.146	1e-06	Basic nitrogen compounds
1665	23	17	0	1	0	16	307.146	0.0	Basic nitrogen compounds
1666	24	17	0	1	0	17	319.146	0.0	Basic nitrogen compounds
1667	25	17	0	1	0	18	331.146	0.0	Basic nitrogen compounds
1668	26	17	0	1	0	19	343.146	0.0	Basic nitrogen compounds
1669	27	17	0	1	0	20	355.146	0.0	Basic nitrogen compounds
1670	52	17	0	1	0	45	655.146	0.0	Basic nitrogen compounds
1671	12	19	0	1	0	4	177.162	0.0	Basic nitrogen compounds
1672	13	19	0	1	0	5	189.162	0.0	Basic nitrogen compounds
1673	14	19	0	1	0	6	201.162	0.0	Basic nitrogen compounds
1674	15	19	0	1	0	7	213.162	0.0	Basic nitrogen compounds
1675	16	19	0	1	0	8	225.162	1e-06	Basic nitrogen compounds
1676	17	19	0	1	0	9	237.162	1e-06	Basic nitrogen compounds
1677	18	19	0	1	0	10	249.162	1e-06	Basic nitrogen compounds
1678	19	19	0	1	0	11	261.162	2e-06	Basic nitrogen compounds
1679	20	19	0	1	0	12	273.162	3e-06	Basic nitrogen compounds
1680	21	19	0	1	0	13	285.162	1e-06	Basic nitrogen compounds
1681	22	19	0	1	0	14	297.162	1e-06	Basic nitrogen compounds
1682	23	19	0	1	0	15	309.162	1e-06	Basic nitrogen compounds
1683	24	19	0	1	0	16	321.162	1e-06	Basic nitrogen compounds
1684	25	19	0	1	0	17	333.162	0.0	Basic nitrogen compounds
1685	26	19	0	1	0	18	345.162	0.0	Basic nitrogen compounds
1686	27	19	0	1	0	19	357.162	0.0	Basic nitrogen compounds
1687	28	19	0	1	0	20	369.162	0.0	Basic nitrogen compounds
1688	29	19	0	1	0	21	381.162	0.0	Basic nitrogen compounds
1689	31	19	0	1	0	23	405.162	0.0	Basic nitrogen compounds
1690	13	21	0	1	0	4	191.178	0.0	Basic nitrogen compounds
1691	14	21	0	1	0	5	203.178	0.0	Basic nitrogen compounds
1692	15	21	0	1	0	6	215.178	0.0	Basic nitrogen compounds
1693	16	21	0	1	0	7	227.178	0.0	Basic nitrogen compounds
1694	17	21	0	1	0	8	239.178	1e-06	Basic nitrogen compounds
1695	18	21	0	1	0	9	251.178	4e-06	Basic nitrogen compounds
1696	19	21	0	1	0	10	263.178	2e-06	Basic nitrogen compounds
1697	20	21	0	1	0	11	275.178	2e-06	Basic nitrogen compounds
1698	21	21	0	1	0	12	287.178	4e-06	Basic nitrogen compounds
1699	22	21	0	1	0	13	299.178	1e-06	Basic nitrogen compounds
1700	23	21	0	1	0	14	311.178	1e-06	Basic nitrogen compounds
1701	24	21	0	1	0	15	323.178	1e-06	Basic nitrogen compounds
1702	25	21	0	1	0	16	335.178	1e-06	Basic nitrogen compounds
1703	26	21	0	1	0	17	347.178	0.0	Basic nitrogen compounds
1704	27	21	0	1	0	18	359.178	0.0	Basic nitrogen compounds
1705	28	21	0	1	0	19	371.178	0.0	Basic nitrogen compounds
1706	29	21	0	1	0	20	383.178	0.0	Basic nitrogen compounds
1707	30	21	0	1	0	21	395.178	0.0	Basic nitrogen compounds
1708	31	21	0	1	0	22	407.178	0.0	Basic nitrogen compounds
1709	32	21	0	1	0	23	419.178	0.0	Basic nitrogen compounds
1710	14	23	0	1	0	4	205.194	0.0	Basic nitrogen compounds
1711	15	23	0	1	0	5	217.194	0.0	Basic nitrogen compounds
1712	16	23	0	1	0	6	229.194	1e-06	Basic nitrogen compounds
1713	17	23	0	1	0	7	241.194	1e-06	Basic nitrogen compounds
1714	18	23	0	1	0	8	253.194	1e-06	Basic nitrogen compounds
1715	19	23	0	1	0	9	265.194	5e-06	Basic nitrogen compounds
1716	20	23	0	1	0	10	277.194	4e-06	Basic nitrogen compounds
1717	21	23	0	1	0	11	289.194	3e-06	Basic nitrogen compounds
1718	22	23	0	1	0	12	301.194	5e-06	Basic nitrogen compounds
1719	23	23	0	1	0	13	313.194	2e-06	Basic nitrogen compounds
1720	24	23	0	1	0	14	325.194	1e-06	Basic nitrogen compounds
1721	25	23	0	1	0	15	337.194	1e-06	Basic nitrogen compounds
1722	26	23	0	1	0	16	349.194	1e-06	Basic nitrogen compounds
1723	27	23	0	1	0	17	361.194	0.0	Basic nitrogen compounds
1724	28	23	0	1	0	18	373.194	0.0	Basic nitrogen compounds
1725	29	23	0	1	0	19	385.194	0.0	Basic nitrogen compounds
1726	30	23	0	1	0	20	397.194	0.0	Basic nitrogen compounds
1727	31	23	0	1	0	21	409.194	0.0	Basic nitrogen compounds
1728	32	23	0	1	0	22	421.194	0.0	Basic nitrogen compounds
1729	33	23	0	1	0	23	433.194	0.0	Basic nitrogen compounds
1730	15	25	0	1	0	4	219.21	0.0	Basic nitrogen compounds
1731	16	25	0	1	0	5	231.21	3e-06	Basic nitrogen compounds
1732	17	25	0	1	0	6	243.21	1e-06	Basic nitrogen compounds
1733	18	25	0	1	0	7	255.21	2e-06	Basic nitrogen compounds
1734	19	25	0	1	0	8	267.21	1e-06	Basic nitrogen compounds
1735	20	25	0	1	0	9	279.21	6e-06	Basic nitrogen compounds
1736	21	25	0	1	0	10	291.21	6e-06	Basic nitrogen compounds
1737	22	25	0	1	0	11	303.21	3e-06	Basic nitrogen compounds
1738	23	25	0	1	0	12	315.21	5e-06	Basic nitrogen compounds
1739	24	25	0	1	0	13	327.21	3e-06	Basic nitrogen compounds
1740	25	25	0	1	0	14	339.21	2e-06	Basic nitrogen compounds
1741	26	25	0	1	0	15	351.21	1e-06	Basic nitrogen compounds
1742	27	25	0	1	0	16	363.21	1e-06	Basic nitrogen compounds
1743	28	25	0	1	0	17	375.21	1e-06	Basic nitrogen compounds
1744	29	25	0	1	0	18	387.21	0.0	Basic nitrogen compounds
1745	30	25	0	1	0	19	399.21	0.0	Basic nitrogen compounds
1746	31	25	0	1	0	20	411.21	0.0	Basic nitrogen compounds
1747	32	25	0	1	0	21	423.21	0.0	Basic nitrogen compounds
1748	33	25	0	1	0	22	435.21	0.0	Basic nitrogen compounds
1749	16	27	0	1	0	4	233.226	0.0	Basic nitrogen compounds
1750	17	27	0	1	0	5	245.226	2e-06	Basic nitrogen compounds
1751	18	27	0	1	0	6	257.226	2e-06	Basic nitrogen compounds
1752	19	27	0	1	0	7	269.226	3e-06	Basic nitrogen compounds
1753	20	27	0	1	0	8	281.226	2e-06	Basic nitrogen compounds
1754	21	27	0	1	0	9	293.226	5e-06	Basic nitrogen compounds
1755	22	27	0	1	0	10	305.226	7e-06	Basic nitrogen compounds
1756	23	27	0	1	0	11	317.226	5e-06	Basic nitrogen compounds
1757	24	27	0	1	0	12	329.226	5e-06	Basic nitrogen compounds
1758	25	27	0	1	0	13	341.226	4e-06	Basic nitrogen compounds
1759	26	27	0	1	0	14	353.226	2e-06	Basic nitrogen compounds
1760	27	27	0	1	0	15	365.226	1e-06	Basic nitrogen compounds
1761	28	27	0	1	0	16	377.226	1e-06	Basic nitrogen compounds
1762	29	27	0	1	0	17	389.226	1e-06	Basic nitrogen compounds
1763	30	27	0	1	0	18	401.226	0.0	Basic nitrogen compounds
1764	31	27	0	1	0	19	413.226	0.0	Basic nitrogen compounds
1765	32	27	0	1	0	20	425.226	0.0	Basic nitrogen compounds
1766	33	27	0	1	0	21	437.226	0.0	Basic nitrogen compounds
1767	34	27	0	1	0	22	449.226	0.0	Basic nitrogen compounds
1768	35	27	0	1	0	23	461.226	0.0	Basic nitrogen compounds
1769	17	29	0	1	0	4	247.242	0.0	Basic nitrogen compounds
1770	18	29	0	1	0	5	259.242	1e-06	Basic nitrogen compounds
1771	19	29	0	1	0	6	271.242	2e-06	Basic nitrogen compounds
1772	20	29	0	1	0	7	283.242	4e-06	Basic nitrogen compounds
1773	21	29	0	1	0	8	295.242	4e-06	Basic nitrogen compounds
1774	22	29	0	1	0	9	307.242	4e-06	Basic nitrogen compounds
1775	23	29	0	1	0	10	319.242	7e-06	Basic nitrogen compounds
1776	24	29	0	1	0	11	331.242	6e-06	Basic nitrogen compounds
1777	25	29	0	1	0	12	343.242	6e-06	Basic nitrogen compounds
1778	26	29	0	1	0	13	355.242	4e-06	Basic nitrogen compounds
1779	27	29	0	1	0	14	367.242	2e-06	Basic nitrogen compounds
1780	28	29	0	1	0	15	379.242	2e-06	Basic nitrogen compounds
1781	29	29	0	1	0	16	391.242	1e-06	Basic nitrogen compounds
1782	30	29	0	1	0	17	403.242	1e-06	Basic nitrogen compounds
1783	31	29	0	1	0	18	415.242	1e-06	Basic nitrogen compounds
1784	32	29	0	1	0	19	427.242	0.0	Basic nitrogen compounds
1785	33	29	0	1	0	20	439.242	0.0	Basic nitrogen compounds
1786	34	29	0	1	0	21	451.242	0.0	Basic nitrogen compounds
1787	35	29	0	1	0	22	463.242	0.0	Basic nitrogen compounds
1788	18	31	0	1	0	4	261.258	0.0	Basic nitrogen compounds
1789	19	31	0	1	0	5	273.258	1e-06	Basic nitrogen compounds
1790	20	31	0	1	0	6	285.258	3e-06	Basic nitrogen compounds
1791	21	31	0	1	0	7	297.258	4e-06	Basic nitrogen compounds
1792	22	31	0	1	0	8	309.258	4e-06	Basic nitrogen compounds
1793	23	31	0	1	0	9	321.258	5e-06	Basic nitrogen compounds
1794	24	31	0	1	0	10	333.258	7e-06	Basic nitrogen compounds
1795	25	31	0	1	0	11	345.258	7e-06	Basic nitrogen compounds
1796	26	31	0	1	0	12	357.258	6e-06	Basic nitrogen compounds
1797	27	31	0	1	0	13	369.258	4e-06	Basic nitrogen compounds
1798	28	31	0	1	0	14	381.258	2e-06	Basic nitrogen compounds
1799	29	31	0	1	0	15	393.258	2e-06	Basic nitrogen compounds
1800	30	31	0	1	0	16	405.258	1e-06	Basic nitrogen compounds
1801	31	31	0	1	0	17	417.258	1e-06	Basic nitrogen compounds
1802	32	31	0	1	0	18	429.258	1e-06	Basic nitrogen compounds
1803	33	31	0	1	0	19	441.258	0.0	Basic nitrogen compounds
1804	34	31	0	1	0	20	453.258	0.0	Basic nitrogen compounds
1805	35	31	0	1	0	21	465.258	0.0	Basic nitrogen compounds
1806	36	31	0	1	0	22	477.258	0.0	Basic nitrogen compounds
1807	37	31	0	1	0	23	489.258	0.0	Basic nitrogen compounds
1808	19	33	0	1	0	4	275.274	0.0	Basic nitrogen compounds
1809	20	33	0	1	0	5	287.274	1e-06	Basic nitrogen compounds
1810	21	33	0	1	0	6	299.274	3e-06	Basic nitrogen compounds
1811	22	33	0	1	0	7	311.274	4e-06	Basic nitrogen compounds
1812	23	33	0	1	0	8	323.274	5e-06	Basic nitrogen compounds
1813	24	33	0	1	0	9	335.274	6e-06	Basic nitrogen compounds
1814	25	33	0	1	0	10	347.274	7e-06	Basic nitrogen compounds
1815	26	33	0	1	0	11	359.274	6e-06	Basic nitrogen compounds
1816	27	33	0	1	0	12	371.274	5e-06	Basic nitrogen compounds
1817	28	33	0	1	0	13	383.274	3e-06	Basic nitrogen compounds
1818	29	33	0	1	0	14	395.274	3e-06	Basic nitrogen compounds
1819	30	33	0	1	0	15	407.274	2e-06	Basic nitrogen compounds
1820	31	33	0	1	0	16	419.274	1e-06	Basic nitrogen compounds
1821	32	33	0	1	0	17	431.274	1e-06	Basic nitrogen compounds
1822	33	33	0	1	0	18	443.274	1e-06	Basic nitrogen compounds
1823	34	33	0	1	0	19	455.274	0.0	Basic nitrogen compounds
1824	35	33	0	1	0	20	467.274	0.0	Basic nitrogen compounds
1825	36	33	0	1	0	21	479.274	0.0	Basic nitrogen compounds
1826	37	33	0	1	0	22	491.274	0.0	Basic nitrogen compounds
1827	38	33	0	1	0	23	503.274	0.0	Basic nitrogen compounds
1828	20	35	0	1	0	4	289.29	0.0	Basic nitrogen compounds
1829	21	35	0	1	0	5	301.29	1e-06	Basic nitrogen compounds
1830	22	35	0	1	0	6	313.29	3e-06	Basic nitrogen compounds
1831	23	35	0	1	0	7	325.29	4e-06	Basic nitrogen compounds
1832	24	35	0	1	0	8	337.29	5e-06	Basic nitrogen compounds
1833	25	35	0	1	0	9	349.29	6e-06	Basic nitrogen compounds
1834	26	35	0	1	0	10	361.29	5e-06	Basic nitrogen compounds
1835	27	35	0	1	0	11	373.29	5e-06	Basic nitrogen compounds
1836	28	35	0	1	0	12	385.29	5e-06	Basic nitrogen compounds
1837	29	35	0	1	0	13	397.29	4e-06	Basic nitrogen compounds
1838	30	35	0	1	0	14	409.29	3e-06	Basic nitrogen compounds
1839	31	35	0	1	0	15	421.29	2e-06	Basic nitrogen compounds
1840	32	35	0	1	0	16	433.29	1e-06	Basic nitrogen compounds
1841	33	35	0	1	0	17	445.29	1e-06	Basic nitrogen compounds
1842	34	35	0	1	0	18	457.29	1e-06	Basic nitrogen compounds
1843	35	35	0	1	0	19	469.29	0.0	Basic nitrogen compounds
1844	36	35	0	1	0	20	481.29	0.0	Basic nitrogen compounds
1845	37	35	0	1	0	21	493.29	0.0	Basic nitrogen compounds
1846	38	35	0	1	0	22	505.29	0.0	Basic nitrogen compounds
1847	39	35	0	1	0	23	517.29	0.0	Basic nitrogen compounds
1848	21	37	0	1	0	4	303.306	0.0	Basic nitrogen compounds
1849	22	37	0	1	0	5	315.306	1e-06	Basic nitrogen compounds
1850	23	37	0	1	0	6	327.306	3e-06	Basic nitrogen compounds
1851	24	37	0	1	0	7	339.306	5e-06	Basic nitrogen compounds
1852	25	37	0	1	0	8	351.306	5e-06	Basic nitrogen compounds
1853	26	37	0	1	0	9	363.306	5e-06	Basic nitrogen compounds
1854	27	37	0	1	0	10	375.306	5e-06	Basic nitrogen compounds
1855	28	37	0	1	0	11	387.306	5e-06	Basic nitrogen compounds
1856	29	37	0	1	0	12	399.306	5e-06	Basic nitrogen compounds
1857	30	37	0	1	0	13	411.306	4e-06	Basic nitrogen compounds
1858	31	37	0	1	0	14	423.306	3e-06	Basic nitrogen compounds
1859	32	37	0	1	0	15	435.306	2e-06	Basic nitrogen compounds
1860	33	37	0	1	0	16	447.306	1e-06	Basic nitrogen compounds
1861	34	37	0	1	0	17	459.306	1e-06	Basic nitrogen compounds
1862	35	37	0	1	0	18	471.306	1e-06	Basic nitrogen compounds
1863	36	37	0	1	0	19	483.306	0.0	Basic nitrogen compounds
1864	37	37	0	1	0	20	495.306	0.0	Basic nitrogen compounds
1865	38	37	0	1	0	21	507.306	0.0	Basic nitrogen compounds
1866	39	37	0	1	0	22	519.306	0.0	Basic nitrogen compounds
1867	40	37	0	1	0	23	531.306	0.0	Basic nitrogen compounds
1868	64	37	0	1	0	47	819.306	0.0	Basic nitrogen compounds
1869	66	37	0	1	0	49	843.306	0.0	Basic nitrogen compounds
1870	22	39	0	1	0	4	317.322	0.0	Basic nitrogen compounds
1871	23	39	0	1	0	5	329.322	1e-06	Basic nitrogen compounds
1872	24	39	0	1	0	6	341.322	3e-06	Basic nitrogen compounds
1873	25	39	0	1	0	7	353.322	4e-06	Basic nitrogen compounds
1874	26	39	0	1	0	8	365.322	4e-06	Basic nitrogen compounds
1875	27	39	0	1	0	9	377.322	5e-06	Basic nitrogen compounds
1876	28	39	0	1	0	10	389.322	5e-06	Basic nitrogen compounds
1877	29	39	0	1	0	11	401.322	4e-06	Basic nitrogen compounds
1878	30	39	0	1	0	12	413.322	5e-06	Basic nitrogen compounds
1879	31	39	0	1	0	13	425.322	3e-06	Basic nitrogen compounds
1880	32	39	0	1	0	14	437.322	2e-06	Basic nitrogen compounds
1881	33	39	0	1	0	15	449.322	2e-06	Basic nitrogen compounds
1882	34	39	0	1	0	16	461.322	1e-06	Basic nitrogen compounds
1883	35	39	0	1	0	17	473.322	1e-06	Basic nitrogen compounds
1884	36	39	0	1	0	18	485.322	0.0	Basic nitrogen compounds
1885	37	39	0	1	0	19	497.322	0.0	Basic nitrogen compounds
1886	38	39	0	1	0	20	509.322	0.0	Basic nitrogen compounds
1887	39	39	0	1	0	21	521.322	0.0	Basic nitrogen compounds
1888	40	39	0	1	0	22	533.322	0.0	Basic nitrogen compounds
1889	63	39	0	1	0	45	809.322	0.0	Basic nitrogen compounds
1890	23	41	0	1	0	4	331.338	0.0	Basic nitrogen compounds
1891	24	41	0	1	0	5	343.338	1e-06	Basic nitrogen compounds
1892	25	41	0	1	0	6	355.338	2e-06	Basic nitrogen compounds
1893	26	41	0	1	0	7	367.338	4e-06	Basic nitrogen compounds
1894	27	41	0	1	0	8	379.338	4e-06	Basic nitrogen compounds
1895	28	41	0	1	0	9	391.338	5e-06	Basic nitrogen compounds
1896	29	41	0	1	0	10	403.338	5e-06	Basic nitrogen compounds
1897	30	41	0	1	0	11	415.338	5e-06	Basic nitrogen compounds
1898	31	41	0	1	0	12	427.338	4e-06	Basic nitrogen compounds
1899	32	41	0	1	0	13	439.338	3e-06	Basic nitrogen compounds
1900	33	41	0	1	0	14	451.338	2e-06	Basic nitrogen compounds
1901	34	41	0	1	0	15	463.338	1e-06	Basic nitrogen compounds
1902	35	41	0	1	0	16	475.338	1e-06	Basic nitrogen compounds
1903	36	41	0	1	0	17	487.338	1e-06	Basic nitrogen compounds
1904	37	41	0	1	0	18	499.338	1e-06	Basic nitrogen compounds
1905	38	41	0	1	0	19	511.338	0.0	Basic nitrogen compounds
1906	39	41	0	1	0	20	523.338	0.0	Basic nitrogen compounds
1907	40	41	0	1	0	21	535.338	0.0	Basic nitrogen compounds
1908	41	41	0	1	0	22	547.338	0.0	Basic nitrogen compounds
1909	42	41	0	1	0	23	559.338	0.0	Basic nitrogen compounds
1910	24	43	0	1	0	4	345.354	0.0	Basic nitrogen compounds
1911	25	43	0	1	0	5	357.354	1e-06	Basic nitrogen compounds
1912	26	43	0	1	0	6	369.354	2e-06	Basic nitrogen compounds
1913	27	43	0	1	0	7	381.354	3e-06	Basic nitrogen compounds
1914	28	43	0	1	0	8	393.354	4e-06	Basic nitrogen compounds
1915	29	43	0	1	0	9	405.354	5e-06	Basic nitrogen compounds
1916	30	43	0	1	0	10	417.354	4e-06	Basic nitrogen compounds
1917	31	43	0	1	0	11	429.354	4e-06	Basic nitrogen compounds
1918	32	43	0	1	0	12	441.354	3e-06	Basic nitrogen compounds
1919	33	43	0	1	0	13	453.354	2e-06	Basic nitrogen compounds
1920	34	43	0	1	0	14	465.354	2e-06	Basic nitrogen compounds
1921	35	43	0	1	0	15	477.354	1e-06	Basic nitrogen compounds
1922	36	43	0	1	0	16	489.354	1e-06	Basic nitrogen compounds
1923	37	43	0	1	0	17	501.354	1e-06	Basic nitrogen compounds
1924	38	43	0	1	0	18	513.354	1e-06	Basic nitrogen compounds
1925	39	43	0	1	0	19	525.354	0.0	Basic nitrogen compounds
1926	40	43	0	1	0	20	537.354	0.0	Basic nitrogen compounds
1927	41	43	0	1	0	21	549.354	0.0	Basic nitrogen compounds
1928	42	43	0	1	0	22	561.354	0.0	Basic nitrogen compounds
1929	43	43	0	1	0	23	573.354	0.0	Basic nitrogen compounds
1930	66	43	0	1	0	46	849.354	0.0	Basic nitrogen compounds
1931	25	45	0	1	0	4	359.37	0.0	Basic nitrogen compounds
1932	26	45	0	1	0	5	371.37	1e-06	Basic nitrogen compounds
1933	27	45	0	1	0	6	383.37	2e-06	Basic nitrogen compounds
1934	28	45	0	1	0	7	395.37	3e-06	Basic nitrogen compounds
1935	29	45	0	1	0	8	407.37	4e-06	Basic nitrogen compounds
1936	30	45	0	1	0	9	419.37	4e-06	Basic nitrogen compounds
1937	31	45	0	1	0	10	431.37	4e-06	Basic nitrogen compounds
1938	32	45	0	1	0	11	443.37	4e-06	Basic nitrogen compounds
1939	33	45	0	1	0	12	455.37	3e-06	Basic nitrogen compounds
1940	34	45	0	1	0	13	467.37	2e-06	Basic nitrogen compounds
1941	35	45	0	1	0	14	479.37	2e-06	Basic nitrogen compounds
1942	36	45	0	1	0	15	491.37	1e-06	Basic nitrogen compounds
1943	37	45	0	1	0	16	503.37	1e-06	Basic nitrogen compounds
1944	38	45	0	1	0	17	515.37	1e-06	Basic nitrogen compounds
1945	39	45	0	1	0	18	527.37	1e-06	Basic nitrogen compounds
1946	40	45	0	1	0	19	539.37	0.0	Basic nitrogen compounds
1947	41	45	0	1	0	20	551.37	0.0	Basic nitrogen compounds
1948	42	45	0	1	0	21	563.37	0.0	Basic nitrogen compounds
1949	43	45	0	1	0	22	575.37	0.0	Basic nitrogen compounds
1950	26	47	0	1	0	4	373.386	0.0	Basic nitrogen compounds
1951	27	47	0	1	0	5	385.386	1e-06	Basic nitrogen compounds
1952	28	47	0	1	0	6	397.386	2e-06	Basic nitrogen compounds
1953	29	47	0	1	0	7	409.386	3e-06	Basic nitrogen compounds
1954	30	47	0	1	0	8	421.386	4e-06	Basic nitrogen compounds
1955	31	47	0	1	0	9	433.386	4e-06	Basic nitrogen compounds
1956	32	47	0	1	0	10	445.386	3e-06	Basic nitrogen compounds
1957	33	47	0	1	0	11	457.386	3e-06	Basic nitrogen compounds
1958	34	47	0	1	0	12	469.386	3e-06	Basic nitrogen compounds
1959	35	47	0	1	0	13	481.386	2e-06	Basic nitrogen compounds
1960	36	47	0	1	0	14	493.386	1e-06	Basic nitrogen compounds
1961	37	47	0	1	0	15	505.386	1e-06	Basic nitrogen compounds
1962	38	47	0	1	0	16	517.386	1e-06	Basic nitrogen compounds
1963	39	47	0	1	0	17	529.386	1e-06	Basic nitrogen compounds
1964	40	47	0	1	0	18	541.386	0.0	Basic nitrogen compounds
1965	41	47	0	1	0	19	553.386	0.0	Basic nitrogen compounds
1966	42	47	0	1	0	20	565.386	0.0	Basic nitrogen compounds
1967	43	47	0	1	0	21	577.386	0.0	Basic nitrogen compounds
1968	27	49	0	1	0	4	387.402	0.0	Basic nitrogen compounds
1969	28	49	0	1	0	5	399.402	1e-06	Basic nitrogen compounds
1970	29	49	0	1	0	6	411.402	2e-06	Basic nitrogen compounds
1971	30	49	0	1	0	7	423.402	3e-06	Basic nitrogen compounds
1972	31	49	0	1	0	8	435.402	4e-06	Basic nitrogen compounds
1973	32	49	0	1	0	9	447.402	4e-06	Basic nitrogen compounds
1974	33	49	0	1	0	10	459.402	3e-06	Basic nitrogen compounds
1975	34	49	0	1	0	11	471.402	2e-06	Basic nitrogen compounds
1976	35	49	0	1	0	12	483.402	2e-06	Basic nitrogen compounds
1977	36	49	0	1	0	13	495.402	2e-06	Basic nitrogen compounds
1978	37	49	0	1	0	14	507.402	1e-06	Basic nitrogen compounds
1979	38	49	0	1	0	15	519.402	1e-06	Basic nitrogen compounds
1980	39	49	0	1	0	16	531.402	1e-06	Basic nitrogen compounds
1981	40	49	0	1	0	17	543.402	1e-06	Basic nitrogen compounds
1982	41	49	0	1	0	18	555.402	0.0	Basic nitrogen compounds
1983	42	49	0	1	0	19	567.402	0.0	Basic nitrogen compounds
1984	43	49	0	1	0	20	579.402	0.0	Basic nitrogen compounds
1985	44	49	0	1	0	21	591.402	0.0	Basic nitrogen compounds
1986	45	49	0	1	0	22	603.402	0.0	Basic nitrogen compounds
1987	28	51	0	1	0	4	401.418	0.0	Basic nitrogen compounds
1988	29	51	0	1	0	5	413.418	1e-06	Basic nitrogen compounds
1989	30	51	0	1	0	6	425.418	2e-06	Basic nitrogen compounds
1990	31	51	0	1	0	7	437.418	3e-06	Basic nitrogen compounds
1991	32	51	0	1	0	8	449.418	3e-06	Basic nitrogen compounds
1992	33	51	0	1	0	9	461.418	3e-06	Basic nitrogen compounds
1993	34	51	0	1	0	10	473.418	3e-06	Basic nitrogen compounds
1994	35	51	0	1	0	11	485.418	2e-06	Basic nitrogen compounds
1995	36	51	0	1	0	12	497.418	2e-06	Basic nitrogen compounds
1996	37	51	0	1	0	13	509.418	2e-06	Basic nitrogen compounds
1997	38	51	0	1	0	14	521.418	1e-06	Basic nitrogen compounds
1998	39	51	0	1	0	15	533.418	1e-06	Basic nitrogen compounds
1999	40	51	0	1	0	16	545.418	1e-06	Basic nitrogen compounds
2000	41	51	0	1	0	17	557.418	0.0	Basic nitrogen compounds
2001	42	51	0	1	0	18	569.418	0.0	Basic nitrogen compounds
2002	43	51	0	1	0	19	581.418	0.0	Basic nitrogen compounds
2003	44	51	0	1	0	20	593.418	0.0	Basic nitrogen compounds
2004	45	51	0	1	0	21	605.418	0.0	Basic nitrogen compounds
2005	47	51	0	1	0	23	629.418	0.0	Basic nitrogen compounds
2006	29	53	0	1	0	4	415.434	0.0	Basic nitrogen compounds
2007	30	53	0	1	0	5	427.434	1e-06	Basic nitrogen compounds
2008	31	53	0	1	0	6	439.434	2e-06	Basic nitrogen compounds
2009	32	53	0	1	0	7	451.434	2e-06	Basic nitrogen compounds
2010	33	53	0	1	0	8	463.434	3e-06	Basic nitrogen compounds
2011	34	53	0	1	0	9	475.434	3e-06	Basic nitrogen compounds
2012	35	53	0	1	0	10	487.434	3e-06	Basic nitrogen compounds
2013	36	53	0	1	0	11	499.434	2e-06	Basic nitrogen compounds
2014	37	53	0	1	0	12	511.434	2e-06	Basic nitrogen compounds
2015	38	53	0	1	0	13	523.434	2e-06	Basic nitrogen compounds
2016	39	53	0	1	0	14	535.434	1e-06	Basic nitrogen compounds
2017	40	53	0	1	0	15	547.434	1e-06	Basic nitrogen compounds
2018	41	53	0	1	0	16	559.434	1e-06	Basic nitrogen compounds
2019	42	53	0	1	0	17	571.434	0.0	Basic nitrogen compounds
2020	43	53	0	1	0	18	583.434	0.0	Basic nitrogen compounds
2021	44	53	0	1	0	19	595.434	0.0	Basic nitrogen compounds
2022	45	53	0	1	0	20	607.434	0.0	Basic nitrogen compounds
2023	46	53	0	1	0	21	619.434	0.0	Basic nitrogen compounds
2024	30	55	0	1	0	4	429.45	0.0	Basic nitrogen compounds
2025	31	55	0	1	0	5	441.45	1e-06	Basic nitrogen compounds
2026	32	55	0	1	0	6	453.45	2e-06	Basic nitrogen compounds
2027	33	55	0	1	0	7	465.45	2e-06	Basic nitrogen compounds
2028	34	55	0	1	0	8	477.45	3e-06	Basic nitrogen compounds
2029	35	55	0	1	0	9	489.45	3e-06	Basic nitrogen compounds
2030	36	55	0	1	0	10	501.45	2e-06	Basic nitrogen compounds
2031	37	55	0	1	0	11	513.45	2e-06	Basic nitrogen compounds
2032	38	55	0	1	0	12	525.45	2e-06	Basic nitrogen compounds
2033	39	55	0	1	0	13	537.45	1e-06	Basic nitrogen compounds
2034	40	55	0	1	0	14	549.45	1e-06	Basic nitrogen compounds
2035	41	55	0	1	0	15	561.45	1e-06	Basic nitrogen compounds
2036	42	55	0	1	0	16	573.45	1e-06	Basic nitrogen compounds
2037	43	55	0	1	0	17	585.45	0.0	Basic nitrogen compounds
2038	44	55	0	1	0	18	597.45	0.0	Basic nitrogen compounds
2039	45	55	0	1	0	19	609.45	0.0	Basic nitrogen compounds
2040	46	55	0	1	0	20	621.45	0.0	Basic nitrogen compounds
2041	47	55	0	1	0	21	633.45	0.0	Basic nitrogen compounds
2042	31	57	0	1	0	4	443.466	0.0	Basic nitrogen compounds
2043	32	57	0	1	0	5	455.466	1e-06	Basic nitrogen compounds
2044	33	57	0	1	0	6	467.466	1e-06	Basic nitrogen compounds
2045	34	57	0	1	0	7	479.466	2e-06	Basic nitrogen compounds
2046	35	57	0	1	0	8	491.466	3e-06	Basic nitrogen compounds
2047	36	57	0	1	0	9	503.466	3e-06	Basic nitrogen compounds
2048	37	57	0	1	0	10	515.466	2e-06	Basic nitrogen compounds
2049	38	57	0	1	0	11	527.466	2e-06	Basic nitrogen compounds
2050	39	57	0	1	0	12	539.466	2e-06	Basic nitrogen compounds
2051	40	57	0	1	0	13	551.466	1e-06	Basic nitrogen compounds
2052	41	57	0	1	0	14	563.466	1e-06	Basic nitrogen compounds
2053	42	57	0	1	0	15	575.466	1e-06	Basic nitrogen compounds
2054	43	57	0	1	0	16	587.466	0.0	Basic nitrogen compounds
2055	44	57	0	1	0	17	599.466	0.0	Basic nitrogen compounds
2056	45	57	0	1	0	18	611.466	0.0	Basic nitrogen compounds
2057	46	57	0	1	0	19	623.466	0.0	Basic nitrogen compounds
2058	48	57	0	1	0	21	647.466	0.0	Basic nitrogen compounds
2059	32	59	0	1	0	4	457.482	0.0	Basic nitrogen compounds
2060	33	59	0	1	0	5	469.482	1e-06	Basic nitrogen compounds
2061	34	59	0	1	0	6	481.482	1e-06	Basic nitrogen compounds
2062	35	59	0	1	0	7	493.482	2e-06	Basic nitrogen compounds
2063	36	59	0	1	0	8	505.482	2e-06	Basic nitrogen compounds
2064	37	59	0	1	0	9	517.482	2e-06	Basic nitrogen compounds
2065	38	59	0	1	0	10	529.482	2e-06	Basic nitrogen compounds
2066	39	59	0	1	0	11	541.482	2e-06	Basic nitrogen compounds
2067	40	59	0	1	0	12	553.482	1e-06	Basic nitrogen compounds
2068	41	59	0	1	0	13	565.482	1e-06	Basic nitrogen compounds
2069	42	59	0	1	0	14	577.482	1e-06	Basic nitrogen compounds
2070	43	59	0	1	0	15	589.482	1e-06	Basic nitrogen compounds
2071	44	59	0	1	0	16	601.482	0.0	Basic nitrogen compounds
2072	45	59	0	1	0	17	613.482	0.0	Basic nitrogen compounds
2073	46	59	0	1	0	18	625.482	0.0	Basic nitrogen compounds
2074	47	59	0	1	0	19	637.482	0.0	Basic nitrogen compounds
2075	48	59	0	1	0	20	649.482	0.0	Basic nitrogen compounds
2076	49	59	0	1	0	21	661.482	0.0	Basic nitrogen compounds
2077	33	61	0	1	0	4	471.498	0.0	Basic nitrogen compounds
2078	34	61	0	1	0	5	483.498	1e-06	Basic nitrogen compounds
2079	35	61	0	1	0	6	495.498	1e-06	Basic nitrogen compounds
2080	36	61	0	1	0	7	507.498	2e-06	Basic nitrogen compounds
2081	37	61	0	1	0	8	519.498	2e-06	Basic nitrogen compounds
2082	38	61	0	1	0	9	531.498	2e-06	Basic nitrogen compounds
2083	39	61	0	1	0	10	543.498	2e-06	Basic nitrogen compounds
2084	40	61	0	1	0	11	555.498	2e-06	Basic nitrogen compounds
2085	41	61	0	1	0	12	567.498	1e-06	Basic nitrogen compounds
2086	42	61	0	1	0	13	579.498	1e-06	Basic nitrogen compounds
2087	43	61	0	1	0	14	591.498	1e-06	Basic nitrogen compounds
2088	44	61	0	1	0	15	603.498	1e-06	Basic nitrogen compounds
2089	45	61	0	1	0	16	615.498	0.0	Basic nitrogen compounds
2090	46	61	0	1	0	17	627.498	0.0	Basic nitrogen compounds
2091	47	61	0	1	0	18	639.498	0.0	Basic nitrogen compounds
2092	48	61	0	1	0	19	651.498	0.0	Basic nitrogen compounds
2093	49	61	0	1	0	20	663.498	0.0	Basic nitrogen compounds
2094	34	63	0	1	0	4	485.514	0.0	Basic nitrogen compounds
2095	35	63	0	1	0	5	497.514	1e-06	Basic nitrogen compounds
2096	36	63	0	1	0	6	509.514	1e-06	Basic nitrogen compounds
2097	37	63	0	1	0	7	521.514	2e-06	Basic nitrogen compounds
2098	38	63	0	1	0	8	533.514	2e-06	Basic nitrogen compounds
2099	39	63	0	1	0	9	545.514	2e-06	Basic nitrogen compounds
2100	40	63	0	1	0	10	557.514	2e-06	Basic nitrogen compounds
2101	41	63	0	1	0	11	569.514	1e-06	Basic nitrogen compounds
2102	42	63	0	1	0	12	581.514	1e-06	Basic nitrogen compounds
2103	43	63	0	1	0	13	593.514	1e-06	Basic nitrogen compounds
2104	44	63	0	1	0	14	605.514	1e-06	Basic nitrogen compounds
2105	45	63	0	1	0	15	617.514	1e-06	Basic nitrogen compounds
2106	46	63	0	1	0	16	629.514	0.0	Basic nitrogen compounds
2107	47	63	0	1	0	17	641.514	0.0	Basic nitrogen compounds
2108	48	63	0	1	0	18	653.514	0.0	Basic nitrogen compounds
2109	49	63	0	1	0	19	665.514	0.0	Basic nitrogen compounds
2110	50	63	0	1	0	20	677.514	0.0	Basic nitrogen compounds
2111	35	65	0	1	0	4	499.53	0.0	Basic nitrogen compounds
2112	36	65	0	1	0	5	511.53	1e-06	Basic nitrogen compounds
2113	37	65	0	1	0	6	523.53	1e-06	Basic nitrogen compounds
2114	38	65	0	1	0	7	535.53	1e-06	Basic nitrogen compounds
2115	39	65	0	1	0	8	547.53	2e-06	Basic nitrogen compounds
2116	40	65	0	1	0	9	559.53	2e-06	Basic nitrogen compounds
2117	41	65	0	1	0	10	571.53	1e-06	Basic nitrogen compounds
2118	42	65	0	1	0	11	583.53	1e-06	Basic nitrogen compounds
2119	43	65	0	1	0	12	595.53	1e-06	Basic nitrogen compounds
2120	44	65	0	1	0	13	607.53	1e-06	Basic nitrogen compounds
2121	45	65	0	1	0	14	619.53	1e-06	Basic nitrogen compounds
2122	46	65	0	1	0	15	631.53	0.0	Basic nitrogen compounds
2123	47	65	0	1	0	16	643.53	0.0	Basic nitrogen compounds
2124	48	65	0	1	0	17	655.53	0.0	Basic nitrogen compounds
2125	49	65	0	1	0	18	667.53	0.0	Basic nitrogen compounds
2126	50	65	0	1	0	19	679.53	0.0	Basic nitrogen compounds
2127	51	65	0	1	0	20	691.53	0.0	Basic nitrogen compounds
2128	36	67	0	1	0	4	513.546	0.0	Basic nitrogen compounds
2129	37	67	0	1	0	5	525.546	1e-06	Basic nitrogen compounds
2130	38	67	0	1	0	6	537.546	1e-06	Basic nitrogen compounds
2131	39	67	0	1	0	7	549.546	1e-06	Basic nitrogen compounds
2132	40	67	0	1	0	8	561.546	1e-06	Basic nitrogen compounds
2133	41	67	0	1	0	9	573.546	2e-06	Basic nitrogen compounds
2134	42	67	0	1	0	10	585.546	1e-06	Basic nitrogen compounds
2135	43	67	0	1	0	11	597.546	1e-06	Basic nitrogen compounds
2136	44	67	0	1	0	12	609.546	1e-06	Basic nitrogen compounds
2137	45	67	0	1	0	13	621.546	1e-06	Basic nitrogen compounds
2138	46	67	0	1	0	14	633.546	1e-06	Basic nitrogen compounds
2139	47	67	0	1	0	15	645.546	0.0	Basic nitrogen compounds
2140	48	67	0	1	0	16	657.546	0.0	Basic nitrogen compounds
2141	49	67	0	1	0	17	669.546	0.0	Basic nitrogen compounds
2142	50	67	0	1	0	18	681.546	0.0	Basic nitrogen compounds
2143	37	69	0	1	0	4	527.562	0.0	Basic nitrogen compounds
2144	38	69	0	1	0	5	539.562	1e-06	Basic nitrogen compounds
2145	39	69	0	1	0	6	551.562	1e-06	Basic nitrogen compounds
2146	40	69	0	1	0	7	563.562	1e-06	Basic nitrogen compounds
2147	41	69	0	1	0	8	575.562	1e-06	Basic nitrogen compounds
2148	42	69	0	1	0	9	587.562	1e-06	Basic nitrogen compounds
2149	43	69	0	1	0	10	599.562	1e-06	Basic nitrogen compounds
2150	44	69	0	1	0	11	611.562	1e-06	Basic nitrogen compounds
2151	45	69	0	1	0	12	623.562	1e-06	Basic nitrogen compounds
2152	46	69	0	1	0	13	635.562	1e-06	Basic nitrogen compounds
2153	47	69	0	1	0	14	647.562	0.0	Basic nitrogen compounds
2154	48	69	0	1	0	15	659.562	0.0	Basic nitrogen compounds
2155	49	69	0	1	0	16	671.562	0.0	Basic nitrogen compounds
2156	50	69	0	1	0	17	683.562	0.0	Basic nitrogen compounds
2157	51	69	0	1	0	18	695.562	0.0	Basic nitrogen compounds
2158	38	71	0	1	0	4	541.578	0.0	Basic nitrogen compounds
2159	39	71	0	1	0	5	553.578	1e-06	Basic nitrogen compounds
2160	40	71	0	1	0	6	565.578	1e-06	Basic nitrogen compounds
2161	41	71	0	1	0	7	577.578	1e-06	Basic nitrogen compounds
2162	42	71	0	1	0	8	589.578	1e-06	Basic nitrogen compounds
2163	43	71	0	1	0	9	601.578	1e-06	Basic nitrogen compounds
2164	44	71	0	1	0	10	613.578	1e-06	Basic nitrogen compounds
2165	45	71	0	1	0	11	625.578	1e-06	Basic nitrogen compounds
2166	46	71	0	1	0	12	637.578	1e-06	Basic nitrogen compounds
2167	47	71	0	1	0	13	649.578	1e-06	Basic nitrogen compounds
2168	48	71	0	1	0	14	661.578	0.0	Basic nitrogen compounds
2169	49	71	0	1	0	15	673.578	0.0	Basic nitrogen compounds
2170	50	71	0	1	0	16	685.578	0.0	Basic nitrogen compounds
2171	51	71	0	1	0	17	697.578	0.0	Basic nitrogen compounds
2172	52	71	0	1	0	18	709.578	0.0	Basic nitrogen compounds
2173	39	73	0	1	0	4	555.594	0.0	Basic nitrogen compounds
2174	40	73	0	1	0	5	567.594	0.0	Basic nitrogen compounds
2175	41	73	0	1	0	6	579.594	1e-06	Basic nitrogen compounds
2176	42	73	0	1	0	7	591.594	1e-06	Basic nitrogen compounds
2177	43	73	0	1	0	8	603.594	1e-06	Basic nitrogen compounds
2178	44	73	0	1	0	9	615.594	1e-06	Basic nitrogen compounds
2179	45	73	0	1	0	10	627.594	1e-06	Basic nitrogen compounds
2180	46	73	0	1	0	11	639.594	1e-06	Basic nitrogen compounds
2181	47	73	0	1	0	12	651.594	1e-06	Basic nitrogen compounds
2182	48	73	0	1	0	13	663.594	0.0	Basic nitrogen compounds
2183	49	73	0	1	0	14	675.594	0.0	Basic nitrogen compounds
2184	50	73	0	1	0	15	687.594	0.0	Basic nitrogen compounds
2185	51	73	0	1	0	16	699.594	0.0	Basic nitrogen compounds
2186	52	73	0	1	0	17	711.594	0.0	Basic nitrogen compounds
2187	40	75	0	1	0	4	569.61	0.0	Basic nitrogen compounds
2188	41	75	0	1	0	5	581.61	0.0	Basic nitrogen compounds
2189	42	75	0	1	0	6	593.61	1e-06	Basic nitrogen compounds
2190	43	75	0	1	0	7	605.61	1e-06	Basic nitrogen compounds
2191	44	75	0	1	0	8	617.61	1e-06	Basic nitrogen compounds
2192	45	75	0	1	0	9	629.61	1e-06	Basic nitrogen compounds
2193	46	75	0	1	0	10	641.61	1e-06	Basic nitrogen compounds
2194	47	75	0	1	0	11	653.61	1e-06	Basic nitrogen compounds
2195	48	75	0	1	0	12	665.61	1e-06	Basic nitrogen compounds
2196	49	75	0	1	0	13	677.61	0.0	Basic nitrogen compounds
2197	50	75	0	1	0	14	689.61	0.0	Basic nitrogen compounds
2198	51	75	0	1	0	15	701.61	0.0	Basic nitrogen compounds
2199	52	75	0	1	0	16	713.61	0.0	Basic nitrogen compounds
2200	53	75	0	1	0	17	725.61	0.0	Basic nitrogen compounds
2201	42	77	0	1	0	5	595.626	0.0	Basic nitrogen compounds
2202	43	77	0	1	0	6	607.626	1e-06	Basic nitrogen compounds
2203	44	77	0	1	0	7	619.626	1e-06	Basic nitrogen compounds
2204	45	77	0	1	0	8	631.626	1e-06	Basic nitrogen compounds
2205	46	77	0	1	0	9	643.626	1e-06	Basic nitrogen compounds
2206	47	77	0	1	0	10	655.626	1e-06	Basic nitrogen compounds
2207	48	77	0	1	0	11	667.626	1e-06	Basic nitrogen compounds
2208	49	77	0	1	0	12	679.626	1e-06	Basic nitrogen compounds
2209	50	77	0	1	0	13	691.626	0.0	Basic nitrogen compounds
2210	51	77	0	1	0	14	703.626	0.0	Basic nitrogen compounds
2211	52	77	0	1	0	15	715.626	0.0	Basic nitrogen compounds
2212	53	77	0	1	0	16	727.626	0.0	Basic nitrogen compounds
2213	54	77	0	1	0	17	739.626	0.0	Basic nitrogen compounds
2214	42	79	0	1	0	4	597.642	0.0	Basic nitrogen compounds
2215	43	79	0	1	0	5	609.642	0.0	Basic nitrogen compounds
2216	44	79	0	1	0	6	621.642	1e-06	Basic nitrogen compounds
2217	45	79	0	1	0	7	633.642	1e-06	Basic nitrogen compounds
2218	46	79	0	1	0	8	645.642	1e-06	Basic nitrogen compounds
2219	47	79	0	1	0	9	657.642	1e-06	Basic nitrogen compounds
2220	48	79	0	1	0	10	669.642	1e-06	Basic nitrogen compounds
2221	49	79	0	1	0	11	681.642	1e-06	Basic nitrogen compounds
2222	50	79	0	1	0	12	693.642	0.0	Basic nitrogen compounds
2223	51	79	0	1	0	13	705.642	0.0	Basic nitrogen compounds
2224	52	79	0	1	0	14	717.642	0.0	Basic nitrogen compounds
2225	53	79	0	1	0	15	729.642	0.0	Basic nitrogen compounds
2226	54	79	0	1	0	16	741.642	0.0	Basic nitrogen compounds
2227	43	81	0	1	0	4	611.658	0.0	Basic nitrogen compounds
2228	44	81	0	1	0	5	623.658	0.0	Basic nitrogen compounds
2229	45	81	0	1	0	6	635.658	1e-06	Basic nitrogen compounds
2230	46	81	0	1	0	7	647.658	1e-06	Basic nitrogen compounds
2231	47	81	0	1	0	8	659.658	1e-06	Basic nitrogen compounds
2232	48	81	0	1	0	9	671.658	1e-06	Basic nitrogen compounds
2233	49	81	0	1	0	10	683.658	1e-06	Basic nitrogen compounds
2234	50	81	0	1	0	11	695.658	0.0	Basic nitrogen compounds
2235	51	81	0	1	0	12	707.658	0.0	Basic nitrogen compounds
2236	52	81	0	1	0	13	719.658	0.0	Basic nitrogen compounds
2237	53	81	0	1	0	14	731.658	0.0	Basic nitrogen compounds
2238	54	81	0	1	0	15	743.658	0.0	Basic nitrogen compounds
2239	55	81	0	1	0	16	755.658	0.0	Basic nitrogen compounds
2240	45	83	0	1	0	5	637.674	0.0	Basic nitrogen compounds
2241	46	83	0	1	0	6	649.674	0.0	Basic nitrogen compounds
2242	47	83	0	1	0	7	661.674	1e-06	Basic nitrogen compounds
2243	48	83	0	1	0	8	673.674	1e-06	Basic nitrogen compounds
2244	49	83	0	1	0	9	685.674	1e-06	Basic nitrogen compounds
2245	50	83	0	1	0	10	697.674	0.0	Basic nitrogen compounds
2246	51	83	0	1	0	11	709.674	0.0	Basic nitrogen compounds
2247	52	83	0	1	0	12	721.674	0.0	Basic nitrogen compounds
2248	53	83	0	1	0	13	733.674	0.0	Basic nitrogen compounds
2249	54	83	0	1	0	14	745.674	0.0	Basic nitrogen compounds
2250	55	83	0	1	0	15	757.674	0.0	Basic nitrogen compounds
2251	56	83	0	1	0	16	769.674	0.0	Basic nitrogen compounds
2252	46	85	0	1	0	5	651.69	0.0	Basic nitrogen compounds
2253	47	85	0	1	0	6	663.69	0.0	Basic nitrogen compounds
2254	48	85	0	1	0	7	675.69	1e-06	Basic nitrogen compounds
2255	49	85	0	1	0	8	687.69	1e-06	Basic nitrogen compounds
2256	50	85	0	1	0	9	699.69	0.0	Basic nitrogen compounds
2257	51	85	0	1	0	10	711.69	0.0	Basic nitrogen compounds
2258	52	85	0	1	0	11	723.69	0.0	Basic nitrogen compounds
2259	53	85	0	1	0	12	735.69	0.0	Basic nitrogen compounds
2260	54	85	0	1	0	13	747.69	0.0	Basic nitrogen compounds
2261	55	85	0	1	0	14	759.69	0.0	Basic nitrogen compounds
2262	56	85	0	1	0	15	771.69	0.0	Basic nitrogen compounds
2263	89	85	0	1	0	48	1167.69	0.0	Basic nitrogen compounds
2264	47	87	0	1	0	5	665.706	0.0	Basic nitrogen compounds
2265	48	87	0	1	0	6	677.706	0.0	Basic nitrogen compounds
2266	49	87	0	1	0	7	689.706	0.0	Basic nitrogen compounds
2267	50	87	0	1	0	8	701.706	0.0	Basic nitrogen compounds
2268	51	87	0	1	0	9	713.706	0.0	Basic nitrogen compounds
2269	52	87	0	1	0	10	725.706	0.0	Basic nitrogen compounds
2270	53	87	0	1	0	11	737.706	0.0	Basic nitrogen compounds
2271	54	87	0	1	0	12	749.706	0.0	Basic nitrogen compounds
2272	55	87	0	1	0	13	761.706	0.0	Basic nitrogen compounds
2273	56	87	0	1	0	14	773.706	0.0	Basic nitrogen compounds
2274	84	87	0	1	0	42	1109.71	0.0	Basic nitrogen compounds
2275	48	89	0	1	0	5	679.722	0.0	Basic nitrogen compounds
2276	49	89	0	1	0	6	691.722	0.0	Basic nitrogen compounds
2277	50	89	0	1	0	7	703.722	0.0	Basic nitrogen compounds
2278	51	89	0	1	0	8	715.722	0.0	Basic nitrogen compounds
2279	52	89	0	1	0	9	727.722	0.0	Basic nitrogen compounds
2280	53	89	0	1	0	10	739.722	0.0	Basic nitrogen compounds
2281	54	89	0	1	0	11	751.722	0.0	Basic nitrogen compounds
2282	55	89	0	1	0	12	763.722	0.0	Basic nitrogen compounds
2283	56	89	0	1	0	13	775.722	0.0	Basic nitrogen compounds
2284	57	89	0	1	0	14	787.722	0.0	Basic nitrogen compounds
2285	91	89	0	1	0	48	1195.72	0.0	Basic nitrogen compounds
2286	49	91	0	1	0	5	693.738	0.0	Basic nitrogen compounds
2287	50	91	0	1	0	6	705.738	0.0	Basic nitrogen compounds
2288	51	91	0	1	0	7	717.738	0.0	Basic nitrogen compounds
2289	52	91	0	1	0	8	729.738	0.0	Basic nitrogen compounds
2290	53	91	0	1	0	9	741.738	0.0	Basic nitrogen compounds
2291	54	91	0	1	0	10	753.738	0.0	Basic nitrogen compounds
2292	55	91	0	1	0	11	765.738	0.0	Basic nitrogen compounds
2293	56	91	0	1	0	12	777.738	0.0	Basic nitrogen compounds
2294	57	91	0	1	0	13	789.738	0.0	Basic nitrogen compounds
2295	58	91	0	1	0	14	801.738	0.0	Basic nitrogen compounds
2296	88	91	0	1	0	44	1161.74	0.0	Basic nitrogen compounds
2297	51	93	0	1	0	6	719.754	0.0	Basic nitrogen compounds
2298	52	93	0	1	0	7	731.754	0.0	Basic nitrogen compounds
2299	53	93	0	1	0	8	743.754	0.0	Basic nitrogen compounds
2300	54	93	0	1	0	9	755.754	0.0	Basic nitrogen compounds
2301	55	93	0	1	0	10	767.754	0.0	Basic nitrogen compounds
2302	57	93	0	1	0	12	791.754	0.0	Basic nitrogen compounds
2303	58	93	0	1	0	13	803.754	0.0	Basic nitrogen compounds
2304	59	93	0	1	0	14	815.754	0.0	Basic nitrogen compounds
2305	60	93	0	1	0	15	827.754	0.0	Basic nitrogen compounds
2306	61	93	0	1	0	16	839.754	0.0	Basic nitrogen compounds
2307	52	95	0	1	0	6	733.77	0.0	Basic nitrogen compounds
2308	53	95	0	1	0	7	745.77	0.0	Basic nitrogen compounds
2309	54	95	0	1	0	8	757.77	0.0	Basic nitrogen compounds
2310	55	95	0	1	0	9	769.77	0.0	Basic nitrogen compounds
2311	56	95	0	1	0	10	781.77	0.0	Basic nitrogen compounds
2312	57	95	0	1	0	11	793.77	0.0	Basic nitrogen compounds
2313	58	95	0	1	0	12	805.77	0.0	Basic nitrogen compounds
2314	59	95	0	1	0	13	817.77	0.0	Basic nitrogen compounds
2315	60	95	0	1	0	14	829.77	0.0	Basic nitrogen compounds
2316	52	97	0	1	0	5	735.786	0.0	Basic nitrogen compounds
2317	53	97	0	1	0	6	747.786	0.0	Basic nitrogen compounds
2318	54	97	0	1	0	7	759.786	0.0	Basic nitrogen compounds
2319	55	97	0	1	0	8	771.786	0.0	Basic nitrogen compounds
2320	56	97	0	1	0	9	783.786	0.0	Basic nitrogen compounds
2321	57	97	0	1	0	10	795.786	0.0	Basic nitrogen compounds
2322	58	97	0	1	0	11	807.786	0.0	Basic nitrogen compounds
2323	59	97	0	1	0	12	819.786	0.0	Basic nitrogen compounds
2324	60	97	0	1	0	13	831.786	0.0	Basic nitrogen compounds
2325	61	97	0	1	0	14	843.786	0.0	Basic nitrogen compounds
2326	62	97	0	1	0	15	855.786	0.0	Basic nitrogen compounds
2327	53	99	0	1	0	5	749.802	0.0	Basic nitrogen compounds
2328	54	99	0	1	0	6	761.802	0.0	Basic nitrogen compounds
2329	56	99	0	1	0	8	785.802	0.0	Basic nitrogen compounds
2330	57	99	0	1	0	9	797.802	0.0	Basic nitrogen compounds
2331	58	99	0	1	0	10	809.802	0.0	Basic nitrogen compounds
2332	59	99	0	1	0	11	821.802	0.0	Basic nitrogen compounds
2333	60	99	0	1	0	12	833.802	0.0	Basic nitrogen compounds
2334	61	99	0	1	0	13	845.802	0.0	Basic nitrogen compounds
2335	62	99	0	1	0	14	857.802	0.0	Basic nitrogen compounds
2336	63	99	0	1	0	15	869.802	0.0	Basic nitrogen compounds
2337	88	99	0	1	0	40	1169.8	0.0	Basic nitrogen compounds
2338	54	101	0	1	0	5	763.818	0.0	Basic nitrogen compounds
2339	55	101	0	1	0	6	775.818	0.0	Basic nitrogen compounds
2340	56	101	0	1	0	7	787.818	0.0	Basic nitrogen compounds
2341	57	101	0	1	0	8	799.818	0.0	Basic nitrogen compounds
2342	58	101	0	1	0	9	811.818	0.0	Basic nitrogen compounds
2343	59	101	0	1	0	10	823.818	0.0	Basic nitrogen compounds
2344	62	101	0	1	0	13	859.818	0.0	Basic nitrogen compounds
2345	63	101	0	1	0	14	871.818	0.0	Basic nitrogen compounds
2346	55	103	0	1	0	5	777.834	0.0	Basic nitrogen compounds
2347	56	103	0	1	0	6	789.834	0.0	Basic nitrogen compounds
2348	57	103	0	1	0	7	801.834	0.0	Basic nitrogen compounds
2349	58	103	0	1	0	8	813.834	0.0	Basic nitrogen compounds
2350	59	103	0	1	0	9	825.834	0.0	Basic nitrogen compounds
2351	60	103	0	1	0	10	837.834	0.0	Basic nitrogen compounds
2352	61	103	0	1	0	11	849.834	0.0	Basic nitrogen compounds
2353	62	103	0	1	0	12	861.834	0.0	Basic nitrogen compounds
2354	64	103	0	1	0	14	885.834	0.0	Basic nitrogen compounds
2355	65	103	0	1	0	15	897.834	0.0	Basic nitrogen compounds
2356	56	105	0	1	0	5	791.85	0.0	Basic nitrogen compounds
2357	58	105	0	1	0	7	815.85	0.0	Basic nitrogen compounds
2358	59	105	0	1	0	8	827.85	0.0	Basic nitrogen compounds
2359	60	105	0	1	0	9	839.85	0.0	Basic nitrogen compounds
2360	60	107	0	1	0	8	841.866	0.0	Basic nitrogen compounds
2361	61	107	0	1	0	9	853.866	0.0	Basic nitrogen compounds
2362	63	107	0	1	0	11	877.866	0.0	Basic nitrogen compounds
2363	64	107	0	1	0	12	889.866	0.0	Basic nitrogen compounds
2364	65	107	0	1	0	13	901.866	0.0	Basic nitrogen compounds
2365	59	109	0	1	0	6	831.882	0.0	Basic nitrogen compounds
2366	61	109	0	1	0	8	855.882	0.0	Basic nitrogen compounds
2367	65	111	0	1	0	11	905.898	0.0	Basic nitrogen compounds
2368	61	113	0	1	0	6	859.914	0.0	Basic nitrogen compounds
2369	62	113	0	1	0	7	871.914	0.0	Basic nitrogen compounds
2370	63	113	0	1	0	8	883.914	0.0	Basic nitrogen compounds
2371	65	115	0	1	0	9	909.93	0.0	Basic nitrogen compounds
2372	88	123	0	1	0	28	1193.99	0.0	Basic nitrogen compounds
2373	83	125	0	1	0	22	1136.01	0.0	Basic nitrogen compounds
2374	80	161	0	1	0	1	1136.3	0.0	Basic nitrogen compounds
2375	10	10	0	0	1	6	162.14	1e-06	Thiophenic compounds
2376	13	10	0	0	1	9	198.14	0.003337	Thiophenic compounds
2377	14	10	0	0	1	10	210.14	2.7e-05	Thiophenic compounds
2378	15	10	0	0	1	11	222.14	5e-06	Thiophenic compounds
2379	16	10	0	0	1	12	234.14	5.9e-05	Thiophenic compounds
2380	17	10	0	0	1	13	246.14	3e-06	Thiophenic compounds
2381	18	10	0	0	1	14	258.14	2e-06	Thiophenic compounds
2382	20	10	0	0	1	16	282.14	2.2e-05	Thiophenic compounds
2383	11	12	0	0	1	6	176.156	4.1e-05	Thiophenic compounds
2384	14	12	0	0	1	9	212.156	0.008398	Thiophenic compounds
2385	15	12	0	0	1	10	224.156	8.7e-05	Thiophenic compounds
2386	16	12	0	0	1	11	236.156	4.5e-05	Thiophenic compounds
2387	17	12	0	0	1	12	248.156	0.000383	Thiophenic compounds
2388	18	12	0	0	1	13	260.156	8e-06	Thiophenic compounds
2389	19	12	0	0	1	14	272.156	1.3e-05	Thiophenic compounds
2390	21	12	0	0	1	16	296.156	3e-06	Thiophenic compounds
2391	10	14	0	0	1	4	166.172	7e-06	Thiophenic compounds
2392	11	14	0	0	1	5	178.172	0.0	Thiophenic compounds
2393	12	14	0	0	1	6	190.172	5.5e-05	Thiophenic compounds
2394	13	14	0	0	1	7	202.172	2.4e-05	Thiophenic compounds
2395	14	14	0	0	1	8	214.172	6e-06	Thiophenic compounds
2396	15	14	0	0	1	9	226.172	0.007617	Thiophenic compounds
2397	16	14	0	0	1	10	238.172	0.00024	Thiophenic compounds
2398	17	14	0	0	1	11	250.172	9.3e-05	Thiophenic compounds
2399	18	14	0	0	1	12	262.172	0.000912	Thiophenic compounds
2400	19	14	0	0	1	13	274.172	5.1e-05	Thiophenic compounds
2401	20	14	0	0	1	14	286.172	5.2e-05	Thiophenic compounds
2402	21	14	0	0	1	15	298.172	2.8e-05	Thiophenic compounds
2403	22	14	0	0	1	16	310.172	4e-06	Thiophenic compounds
2404	23	14	0	0	1	17	322.172	0.000124	Thiophenic compounds
2405	11	16	0	0	1	4	180.188	9.5e-05	Thiophenic compounds
2406	13	16	0	0	1	6	204.188	5.1e-05	Thiophenic compounds
2407	14	16	0	0	1	7	216.188	1.7e-05	Thiophenic compounds
2408	15	16	0	0	1	8	228.188	3.5e-05	Thiophenic compounds
2409	16	16	0	0	1	9	240.188	0.004639	Thiophenic compounds
2410	17	16	0	0	1	10	252.188	0.000664	Thiophenic compounds
2411	18	16	0	0	1	11	264.188	0.000182	Thiophenic compounds
2412	19	16	0	0	1	12	276.188	0.001231	Thiophenic compounds
2413	20	16	0	0	1	13	288.188	0.000153	Thiophenic compounds
2414	21	16	0	0	1	14	300.188	6.2e-05	Thiophenic compounds
2415	22	16	0	0	1	15	312.188	6e-05	Thiophenic compounds
2416	23	16	0	0	1	16	324.188	7e-06	Thiophenic compounds
2417	11	18	0	0	1	3	182.204	5e-06	Thiophenic compounds
2418	12	18	0	0	1	4	194.204	0.000592	Thiophenic compounds
2419	13	18	0	0	1	5	206.204	7e-06	Thiophenic compounds
2420	14	18	0	0	1	6	218.204	5.2e-05	Thiophenic compounds
2421	15	18	0	0	1	7	230.204	7.4e-05	Thiophenic compounds
2422	16	18	0	0	1	8	242.204	0.000103	Thiophenic compounds
2423	17	18	0	0	1	9	254.204	0.002475	Thiophenic compounds
2424	18	18	0	0	1	10	266.204	0.000903	Thiophenic compounds
2425	19	18	0	0	1	11	278.204	0.000362	Thiophenic compounds
2426	20	18	0	0	1	12	290.204	0.001139	Thiophenic compounds
2427	21	18	0	0	1	13	302.204	0.000273	Thiophenic compounds
2428	22	18	0	0	1	14	314.204	0.000136	Thiophenic compounds
2429	23	18	0	0	1	15	326.204	0.000102	Thiophenic compounds
2430	24	18	0	0	1	16	338.204	5e-06	Thiophenic compounds
2431	25	18	0	0	1	17	350.204	2.3e-05	Thiophenic compounds
2432	12	20	0	0	1	3	196.22	8e-06	Thiophenic compounds
2433	13	20	0	0	1	4	208.22	0.000132	Thiophenic compounds
2434	14	20	0	0	1	5	220.22	5.1e-05	Thiophenic compounds
2435	15	20	0	0	1	6	232.22	6.4e-05	Thiophenic compounds
2436	16	20	0	0	1	7	244.22	9.9e-05	Thiophenic compounds
2437	17	20	0	0	1	8	256.22	0.000212	Thiophenic compounds
2438	18	20	0	0	1	9	268.22	0.001103	Thiophenic compounds
2439	19	20	0	0	1	10	280.22	0.001067	Thiophenic compounds
2440	20	20	0	0	1	11	292.22	0.000583	Thiophenic compounds
2441	21	20	0	0	1	12	304.22	0.001024	Thiophenic compounds
2442	22	20	0	0	1	13	316.22	0.000402	Thiophenic compounds
2443	23	20	0	0	1	14	328.22	0.000213	Thiophenic compounds
2444	24	20	0	0	1	15	340.22	0.000114	Thiophenic compounds
2445	25	20	0	0	1	16	352.22	3e-05	Thiophenic compounds
2446	26	20	0	0	1	17	364.22	0.000154	Thiophenic compounds
2447	13	22	0	0	1	3	210.236	2.2e-05	Thiophenic compounds
2448	14	22	0	0	1	4	222.236	0.000107	Thiophenic compounds
2449	15	22	0	0	1	5	234.236	0.000188	Thiophenic compounds
2450	16	22	0	0	1	6	246.236	0.000134	Thiophenic compounds
2451	17	22	0	0	1	7	258.236	0.000163	Thiophenic compounds
2452	18	22	0	0	1	8	270.236	0.00035	Thiophenic compounds
2453	19	22	0	0	1	9	282.236	0.000602	Thiophenic compounds
2454	20	22	0	0	1	10	294.236	0.000935	Thiophenic compounds
2455	21	22	0	0	1	11	306.236	0.000688	Thiophenic compounds
2456	22	22	0	0	1	12	318.236	0.000778	Thiophenic compounds
2457	23	22	0	0	1	13	330.236	0.000496	Thiophenic compounds
2458	24	22	0	0	1	14	342.236	0.000296	Thiophenic compounds
2459	25	22	0	0	1	15	354.236	0.000148	Thiophenic compounds
2460	26	22	0	0	1	16	366.236	3.4e-05	Thiophenic compounds
2461	27	22	0	0	1	17	378.236	8.3e-05	Thiophenic compounds
2462	28	22	0	0	1	18	390.236	2e-06	Thiophenic compounds
2463	14	24	0	0	1	3	224.252	5.2e-05	Thiophenic compounds
2464	15	24	0	0	1	4	236.252	0.000125	Thiophenic compounds
2465	16	24	0	0	1	5	248.252	0.000396	Thiophenic compounds
2466	17	24	0	0	1	6	260.252	0.000218	Thiophenic compounds
2467	18	24	0	0	1	7	272.252	0.00023	Thiophenic compounds
2468	19	24	0	0	1	8	284.252	0.000416	Thiophenic compounds
2469	20	24	0	0	1	9	296.252	0.000513	Thiophenic compounds
2470	21	24	0	0	1	10	308.252	0.000685	Thiophenic compounds
2471	22	24	0	0	1	11	320.252	0.000641	Thiophenic compounds
2472	23	24	0	0	1	12	332.252	0.000527	Thiophenic compounds
2473	24	24	0	0	1	13	344.252	0.000425	Thiophenic compounds
2474	25	24	0	0	1	14	356.252	0.000296	Thiophenic compounds
2475	26	24	0	0	1	15	368.252	0.000162	Thiophenic compounds
2476	27	24	0	0	1	16	380.252	5.1e-05	Thiophenic compounds
2477	28	24	0	0	1	17	392.252	4.2e-05	Thiophenic compounds
2478	15	26	0	0	1	3	238.268	7.7e-05	Thiophenic compounds
2479	16	26	0	0	1	4	250.268	0.000147	Thiophenic compounds
2480	17	26	0	0	1	5	262.268	0.000362	Thiophenic compounds
2481	18	26	0	0	1	6	274.268	0.000298	Thiophenic compounds
2482	19	26	0	0	1	7	286.268	0.000223	Thiophenic compounds
2483	20	26	0	0	1	8	298.268	0.000425	Thiophenic compounds
2484	21	26	0	0	1	9	310.268	0.000589	Thiophenic compounds
2485	22	26	0	0	1	10	322.268	0.000548	Thiophenic compounds
2486	23	26	0	0	1	11	334.268	0.000554	Thiophenic compounds
2487	24	26	0	0	1	12	346.268	0.000394	Thiophenic compounds
2488	25	26	0	0	1	13	358.268	0.000336	Thiophenic compounds
2489	26	26	0	0	1	14	370.268	0.000232	Thiophenic compounds
2490	27	26	0	0	1	15	382.268	0.000148	Thiophenic compounds
2491	28	26	0	0	1	16	394.268	6.9e-05	Thiophenic compounds
2492	29	26	0	0	1	17	406.268	6.4e-05	Thiophenic compounds
2493	30	26	0	0	1	18	418.268	8e-06	Thiophenic compounds
2494	16	28	0	0	1	3	252.284	8.9e-05	Thiophenic compounds
2495	17	28	0	0	1	4	264.284	0.000152	Thiophenic compounds
2496	18	28	0	0	1	5	276.284	0.00035	Thiophenic compounds
2497	19	28	0	0	1	6	288.284	0.000349	Thiophenic compounds
2498	20	28	0	0	1	7	300.284	0.000298	Thiophenic compounds
2499	21	28	0	0	1	8	312.284	0.000551	Thiophenic compounds
2500	22	28	0	0	1	9	324.284	0.000689	Thiophenic compounds
2501	23	28	0	0	1	10	336.284	0.000505	Thiophenic compounds
2502	24	28	0	0	1	11	348.284	0.000479	Thiophenic compounds
2503	25	28	0	0	1	12	360.284	0.000386	Thiophenic compounds
2504	26	28	0	0	1	13	372.284	0.000277	Thiophenic compounds
2505	27	28	0	0	1	14	384.284	0.000234	Thiophenic compounds
2506	28	28	0	0	1	15	396.284	0.000152	Thiophenic compounds
2507	29	28	0	0	1	16	408.284	8.1e-05	Thiophenic compounds
2508	30	28	0	0	1	17	420.284	0.000109	Thiophenic compounds
2509	31	28	0	0	1	18	432.284	3.4e-05	Thiophenic compounds
2510	32	28	0	0	1	19	444.284	1.1e-05	Thiophenic compounds
2511	17	30	0	0	1	3	266.3	8.8e-05	Thiophenic compounds
2512	18	30	0	0	1	4	278.3	0.000164	Thiophenic compounds
2513	19	30	0	0	1	5	290.3	0.000275	Thiophenic compounds
2514	20	30	0	0	1	6	302.3	0.000368	Thiophenic compounds
2515	21	30	0	0	1	7	314.3	0.000385	Thiophenic compounds
2516	22	30	0	0	1	8	326.3	0.000469	Thiophenic compounds
2517	23	30	0	0	1	9	338.3	0.000822	Thiophenic compounds
2518	24	30	0	0	1	10	350.3	0.000473	Thiophenic compounds
2519	25	30	0	0	1	11	362.3	0.000367	Thiophenic compounds
2520	26	30	0	0	1	12	374.3	0.00034	Thiophenic compounds
2521	27	30	0	0	1	13	386.3	0.000225	Thiophenic compounds
2522	28	30	0	0	1	14	398.3	0.000197	Thiophenic compounds
2523	29	30	0	0	1	15	410.3	0.000152	Thiophenic compounds
2524	30	30	0	0	1	16	422.3	0.000106	Thiophenic compounds
2525	31	30	0	0	1	17	434.3	9e-05	Thiophenic compounds
2526	32	30	0	0	1	18	446.3	4.2e-05	Thiophenic compounds
2527	33	30	0	0	1	19	458.3	6e-06	Thiophenic compounds
2528	18	32	0	0	1	3	280.316	8.8e-05	Thiophenic compounds
2529	19	32	0	0	1	4	292.316	0.000161	Thiophenic compounds
2530	20	32	0	0	1	5	304.316	0.000264	Thiophenic compounds
2531	21	32	0	0	1	6	316.316	0.000334	Thiophenic compounds
2532	22	32	0	0	1	7	328.316	0.00039	Thiophenic compounds
2533	23	32	0	0	1	8	340.316	0.000378	Thiophenic compounds
2534	24	32	0	0	1	9	352.316	0.001195	Thiophenic compounds
2535	25	32	0	0	1	10	364.316	0.000403	Thiophenic compounds
2536	26	32	0	0	1	11	376.316	0.000313	Thiophenic compounds
2537	27	32	0	0	1	12	388.316	0.000303	Thiophenic compounds
2538	28	32	0	0	1	13	400.316	0.000231	Thiophenic compounds
2539	29	32	0	0	1	14	412.316	0.000164	Thiophenic compounds
2540	30	32	0	0	1	15	424.316	0.00016	Thiophenic compounds
2541	31	32	0	0	1	16	436.316	0.000134	Thiophenic compounds
2542	32	32	0	0	1	17	448.316	0.000331	Thiophenic compounds
2543	33	32	0	0	1	18	460.316	7.9e-05	Thiophenic compounds
2544	34	32	0	0	1	19	472.316	3e-05	Thiophenic compounds
2545	19	34	0	0	1	3	294.332	0.000107	Thiophenic compounds
2546	20	34	0	0	1	4	306.332	0.000171	Thiophenic compounds
2547	21	34	0	0	1	5	318.332	0.000239	Thiophenic compounds
2548	22	34	0	0	1	6	330.332	0.000293	Thiophenic compounds
2549	23	34	0	0	1	7	342.332	0.000297	Thiophenic compounds
2550	24	34	0	0	1	8	354.332	0.000351	Thiophenic compounds
2551	25	34	0	0	1	9	366.332	0.000941	Thiophenic compounds
2552	26	34	0	0	1	10	378.332	0.000411	Thiophenic compounds
2553	27	34	0	0	1	11	390.332	0.000327	Thiophenic compounds
2554	28	34	0	0	1	12	402.332	0.000266	Thiophenic compounds
2555	29	34	0	0	1	13	414.332	0.00019	Thiophenic compounds
2556	30	34	0	0	1	14	426.332	0.000153	Thiophenic compounds
2557	31	34	0	0	1	15	438.332	0.000154	Thiophenic compounds
2558	32	34	0	0	1	16	450.332	0.000122	Thiophenic compounds
2559	33	34	0	0	1	17	462.332	0.000301	Thiophenic compounds
2560	34	34	0	0	1	18	474.332	8.3e-05	Thiophenic compounds
2561	35	34	0	0	1	19	486.332	4.4e-05	Thiophenic compounds
2562	20	36	0	0	1	3	308.348	0.000101	Thiophenic compounds
2563	21	36	0	0	1	4	320.348	0.000146	Thiophenic compounds
2564	22	36	0	0	1	5	332.348	0.000252	Thiophenic compounds
2565	23	36	0	0	1	6	344.348	0.000259	Thiophenic compounds
2566	24	36	0	0	1	7	356.348	0.000247	Thiophenic compounds
2567	25	36	0	0	1	8	368.348	0.000301	Thiophenic compounds
2568	26	36	0	0	1	9	380.348	0.000591	Thiophenic compounds
2569	27	36	0	0	1	10	392.348	0.000401	Thiophenic compounds
2570	28	36	0	0	1	11	404.348	0.0003	Thiophenic compounds
2571	29	36	0	0	1	12	416.348	0.000259	Thiophenic compounds
2572	30	36	0	0	1	13	428.348	0.000207	Thiophenic compounds
2573	31	36	0	0	1	14	440.348	0.000161	Thiophenic compounds
2574	32	36	0	0	1	15	452.348	0.000121	Thiophenic compounds
2575	33	36	0	0	1	16	464.348	0.000102	Thiophenic compounds
2576	34	36	0	0	1	17	476.348	0.000288	Thiophenic compounds
2577	35	36	0	0	1	18	488.348	0.000106	Thiophenic compounds
2578	36	36	0	0	1	19	500.348	3.7e-05	Thiophenic compounds
2579	21	38	0	0	1	3	322.364	0.000101	Thiophenic compounds
2580	22	38	0	0	1	4	334.364	0.000173	Thiophenic compounds
2581	23	38	0	0	1	5	346.364	0.000234	Thiophenic compounds
2582	24	38	0	0	1	6	358.364	0.000222	Thiophenic compounds
2583	25	38	0	0	1	7	370.364	0.000257	Thiophenic compounds
2584	26	38	0	0	1	8	382.364	0.000218	Thiophenic compounds
2585	27	38	0	0	1	9	394.364	0.000465	Thiophenic compounds
2586	28	38	0	0	1	10	406.364	0.000435	Thiophenic compounds
2587	29	38	0	0	1	11	418.364	0.00025	Thiophenic compounds
2588	30	38	0	0	1	12	430.364	0.000212	Thiophenic compounds
2589	31	38	0	0	1	13	442.364	0.00019	Thiophenic compounds
2590	32	38	0	0	1	14	454.364	0.000148	Thiophenic compounds
2591	33	38	0	0	1	15	466.364	0.000154	Thiophenic compounds
2592	34	38	0	0	1	16	478.364	7.2e-05	Thiophenic compounds
2593	35	38	0	0	1	17	490.364	0.000122	Thiophenic compounds
2594	36	38	0	0	1	18	502.364	8.6e-05	Thiophenic compounds
2595	37	38	0	0	1	19	514.364	3.6e-05	Thiophenic compounds
2596	22	40	0	0	1	3	336.38	0.000113	Thiophenic compounds
2597	23	40	0	0	1	4	348.38	0.000165	Thiophenic compounds
2598	24	40	0	0	1	5	360.38	0.000214	Thiophenic compounds
2599	25	40	0	0	1	6	372.38	0.000237	Thiophenic compounds
2600	26	40	0	0	1	7	384.38	0.000217	Thiophenic compounds
2601	27	40	0	0	1	8	396.38	0.000216	Thiophenic compounds
2602	28	40	0	0	1	9	408.38	0.000362	Thiophenic compounds
2603	29	40	0	0	1	10	420.38	0.000357	Thiophenic compounds
2604	30	40	0	0	1	11	432.38	0.00025	Thiophenic compounds
2605	31	40	0	0	1	12	444.38	0.000225	Thiophenic compounds
2606	32	40	0	0	1	13	456.38	0.000172	Thiophenic compounds
2607	33	40	0	0	1	14	468.38	0.000161	Thiophenic compounds
2608	34	40	0	0	1	15	480.38	0.000131	Thiophenic compounds
2609	35	40	0	0	1	16	492.38	8.4e-05	Thiophenic compounds
2610	36	40	0	0	1	17	504.38	6.6e-05	Thiophenic compounds
2611	37	40	0	0	1	18	516.38	5.6e-05	Thiophenic compounds
2612	38	40	0	0	1	19	528.38	5.7e-05	Thiophenic compounds
2613	23	42	0	0	1	3	350.396	0.000132	Thiophenic compounds
2614	24	42	0	0	1	4	362.396	0.000171	Thiophenic compounds
2615	25	42	0	0	1	5	374.396	0.000185	Thiophenic compounds
2616	26	42	0	0	1	6	386.396	0.000203	Thiophenic compounds
2617	27	42	0	0	1	7	398.396	0.000181	Thiophenic compounds
2618	28	42	0	0	1	8	410.396	0.000194	Thiophenic compounds
2619	29	42	0	0	1	9	422.396	0.00032	Thiophenic compounds
2620	30	42	0	0	1	10	434.396	0.00036	Thiophenic compounds
2621	31	42	0	0	1	11	446.396	0.000214	Thiophenic compounds
2622	32	42	0	0	1	12	458.396	0.000196	Thiophenic compounds
2623	33	42	0	0	1	13	470.396	0.000187	Thiophenic compounds
2624	34	42	0	0	1	14	482.396	0.000153	Thiophenic compounds
2625	35	42	0	0	1	15	494.396	9.2e-05	Thiophenic compounds
2626	36	42	0	0	1	16	506.396	8.3e-05	Thiophenic compounds
2627	37	42	0	0	1	17	518.396	5.3e-05	Thiophenic compounds
2628	38	42	0	0	1	18	530.396	5e-05	Thiophenic compounds
2629	39	42	0	0	1	19	542.396	3.4e-05	Thiophenic compounds
2630	24	44	0	0	1	3	364.412	0.000162	Thiophenic compounds
2631	25	44	0	0	1	4	376.412	0.000162	Thiophenic compounds
2632	26	44	0	0	1	5	388.412	0.000227	Thiophenic compounds
2633	27	44	0	0	1	6	400.412	0.000239	Thiophenic compounds
2634	28	44	0	0	1	7	412.412	0.000188	Thiophenic compounds
2635	29	44	0	0	1	8	424.412	0.000192	Thiophenic compounds
2636	30	44	0	0	1	9	436.412	0.000285	Thiophenic compounds
2637	31	44	0	0	1	10	448.412	0.000285	Thiophenic compounds
2638	32	44	0	0	1	11	460.412	0.000214	Thiophenic compounds
2639	33	44	0	0	1	12	472.412	0.000199	Thiophenic compounds
2640	34	44	0	0	1	13	484.412	0.000173	Thiophenic compounds
2641	35	44	0	0	1	14	496.412	0.000117	Thiophenic compounds
2642	36	44	0	0	1	15	508.412	0.000114	Thiophenic compounds
2643	37	44	0	0	1	16	520.412	6.9e-05	Thiophenic compounds
2644	38	44	0	0	1	17	532.412	6.8e-05	Thiophenic compounds
2645	39	44	0	0	1	18	544.412	5.4e-05	Thiophenic compounds
2646	40	44	0	0	1	19	556.412	2.3e-05	Thiophenic compounds
2647	25	46	0	0	1	3	378.428	0.000142	Thiophenic compounds
2648	26	46	0	0	1	4	390.428	0.000139	Thiophenic compounds
2649	27	46	0	0	1	5	402.428	0.000186	Thiophenic compounds
2650	28	46	0	0	1	6	414.428	0.000176	Thiophenic compounds
2651	29	46	0	0	1	7	426.428	0.000176	Thiophenic compounds
2652	30	46	0	0	1	8	438.428	0.000202	Thiophenic compounds
2653	31	46	0	0	1	9	450.428	0.000232	Thiophenic compounds
2654	32	46	0	0	1	10	462.428	0.000283	Thiophenic compounds
2655	33	46	0	0	1	11	474.428	0.000195	Thiophenic compounds
2656	34	46	0	0	1	12	486.428	0.000156	Thiophenic compounds
2657	35	46	0	0	1	13	498.428	0.000165	Thiophenic compounds
2658	36	46	0	0	1	14	510.428	0.000125	Thiophenic compounds
2659	37	46	0	0	1	15	522.428	8.8e-05	Thiophenic compounds
2660	38	46	0	0	1	16	534.428	7.7e-05	Thiophenic compounds
2661	39	46	0	0	1	17	546.428	7.4e-05	Thiophenic compounds
2662	40	46	0	0	1	18	558.428	5.6e-05	Thiophenic compounds
2663	41	46	0	0	1	19	570.428	2.2e-05	Thiophenic compounds
2664	26	48	0	0	1	3	392.444	0.000144	Thiophenic compounds
2665	27	48	0	0	1	4	404.444	0.000157	Thiophenic compounds
2666	28	48	0	0	1	5	416.444	0.000183	Thiophenic compounds
2667	29	48	0	0	1	6	428.444	0.000188	Thiophenic compounds
2668	30	48	0	0	1	7	440.444	0.000143	Thiophenic compounds
2669	31	48	0	0	1	8	452.444	0.000159	Thiophenic compounds
2670	32	48	0	0	1	9	464.444	0.000252	Thiophenic compounds
2671	33	48	0	0	1	10	476.444	0.000255	Thiophenic compounds
2672	34	48	0	0	1	11	488.444	0.000158	Thiophenic compounds
2673	35	48	0	0	1	12	500.444	0.000146	Thiophenic compounds
2674	36	48	0	0	1	13	512.444	0.000133	Thiophenic compounds
2675	37	48	0	0	1	14	524.444	0.000123	Thiophenic compounds
2676	38	48	0	0	1	15	536.444	7.6e-05	Thiophenic compounds
2677	39	48	0	0	1	16	548.444	9.7e-05	Thiophenic compounds
2678	40	48	0	0	1	17	560.444	5.5e-05	Thiophenic compounds
2679	41	48	0	0	1	18	572.444	4.8e-05	Thiophenic compounds
2680	42	48	0	0	1	19	584.444	2e-05	Thiophenic compounds
2681	27	50	0	0	1	3	406.46	0.000145	Thiophenic compounds
2682	28	50	0	0	1	4	418.46	0.000168	Thiophenic compounds
2683	29	50	0	0	1	5	430.46	0.000185	Thiophenic compounds
2684	30	50	0	0	1	6	442.46	0.000197	Thiophenic compounds
2685	31	50	0	0	1	7	454.46	0.000163	Thiophenic compounds
2686	32	50	0	0	1	8	466.46	0.000167	Thiophenic compounds
2687	33	50	0	0	1	9	478.46	0.000218	Thiophenic compounds
2688	34	50	0	0	1	10	490.46	0.000229	Thiophenic compounds
2689	35	50	0	0	1	11	502.46	0.000164	Thiophenic compounds
2690	36	50	0	0	1	12	514.46	0.000118	Thiophenic compounds
2691	37	50	0	0	1	13	526.46	0.000116	Thiophenic compounds
2692	38	50	0	0	1	14	538.46	0.000125	Thiophenic compounds
2693	39	50	0	0	1	15	550.46	7.4e-05	Thiophenic compounds
2694	40	50	0	0	1	16	562.46	8.7e-05	Thiophenic compounds
2695	41	50	0	0	1	17	574.46	7e-05	Thiophenic compounds
2696	42	50	0	0	1	18	586.46	3.9e-05	Thiophenic compounds
2697	43	50	0	0	1	19	598.46	3.1e-05	Thiophenic compounds
2698	28	52	0	0	1	3	420.476	0.000149	Thiophenic compounds
2699	29	52	0	0	1	4	432.476	0.00015	Thiophenic compounds
2700	30	52	0	0	1	5	444.476	0.000194	Thiophenic compounds
2701	31	52	0	0	1	6	456.476	0.000168	Thiophenic compounds
2702	32	52	0	0	1	7	468.476	0.000173	Thiophenic compounds
2703	33	52	0	0	1	8	480.476	0.000137	Thiophenic compounds
2704	34	52	0	0	1	9	492.476	0.000216	Thiophenic compounds
2705	35	52	0	0	1	10	504.476	0.000197	Thiophenic compounds
2706	36	52	0	0	1	11	516.476	0.000136	Thiophenic compounds
2707	37	52	0	0	1	12	528.476	0.000122	Thiophenic compounds
2708	38	52	0	0	1	13	540.476	9.4e-05	Thiophenic compounds
2709	39	52	0	0	1	14	552.476	8.3e-05	Thiophenic compounds
2710	40	52	0	0	1	15	564.476	8.6e-05	Thiophenic compounds
2711	41	52	0	0	1	16	576.476	8.4e-05	Thiophenic compounds
2712	42	52	0	0	1	17	588.476	4.6e-05	Thiophenic compounds
2713	43	52	0	0	1	18	600.476	5.4e-05	Thiophenic compounds
2714	44	52	0	0	1	19	612.476	3.3e-05	Thiophenic compounds
2715	29	54	0	0	1	3	434.492	0.000155	Thiophenic compounds
2716	30	54	0	0	1	4	446.492	0.000142	Thiophenic compounds
2717	31	54	0	0	1	5	458.492	0.000156	Thiophenic compounds
2718	32	54	0	0	1	6	470.492	0.000191	Thiophenic compounds
2719	33	54	0	0	1	7	482.492	0.000129	Thiophenic compounds
2720	34	54	0	0	1	8	494.492	0.000124	Thiophenic compounds
2721	35	54	0	0	1	9	506.492	0.000212	Thiophenic compounds
2722	36	54	0	0	1	10	518.492	0.000198	Thiophenic compounds
2723	37	54	0	0	1	11	530.492	0.000159	Thiophenic compounds
2724	38	54	0	0	1	12	542.492	0.000106	Thiophenic compounds
2725	39	54	0	0	1	13	554.492	0.000106	Thiophenic compounds
2726	40	54	0	0	1	14	566.492	8.7e-05	Thiophenic compounds
2727	41	54	0	0	1	15	578.492	6.7e-05	Thiophenic compounds
2728	42	54	0	0	1	16	590.492	6.8e-05	Thiophenic compounds
2729	43	54	0	0	1	17	602.492	4.7e-05	Thiophenic compounds
2730	44	54	0	0	1	18	614.492	3.2e-05	Thiophenic compounds
2731	45	54	0	0	1	19	626.492	4e-06	Thiophenic compounds
2732	30	56	0	0	1	3	448.508	0.000137	Thiophenic compounds
2733	31	56	0	0	1	4	460.508	0.000143	Thiophenic compounds
2734	32	56	0	0	1	5	472.508	0.000156	Thiophenic compounds
2735	33	56	0	0	1	6	484.508	0.000163	Thiophenic compounds
2736	34	56	0	0	1	7	496.508	0.000145	Thiophenic compounds
2737	35	56	0	0	1	8	508.508	0.000122	Thiophenic compounds
2738	36	56	0	0	1	9	520.508	0.000183	Thiophenic compounds
2739	37	56	0	0	1	10	532.508	0.000138	Thiophenic compounds
2740	38	56	0	0	1	11	544.508	0.00012	Thiophenic compounds
2741	39	56	0	0	1	12	556.508	9.2e-05	Thiophenic compounds
2742	40	56	0	0	1	13	568.508	8e-05	Thiophenic compounds
2743	41	56	0	0	1	14	580.508	8.3e-05	Thiophenic compounds
2744	42	56	0	0	1	15	592.508	4.3e-05	Thiophenic compounds
2745	43	56	0	0	1	16	604.508	3.9e-05	Thiophenic compounds
2746	44	56	0	0	1	17	616.508	3.9e-05	Thiophenic compounds
2747	45	56	0	0	1	18	628.508	1.2e-05	Thiophenic compounds
2748	46	56	0	0	1	19	640.508	1.8e-05	Thiophenic compounds
2749	31	58	0	0	1	3	462.524	0.000119	Thiophenic compounds
2750	32	58	0	0	1	4	474.524	0.000107	Thiophenic compounds
2751	33	58	0	0	1	5	486.524	0.000119	Thiophenic compounds
2752	34	58	0	0	1	6	498.524	0.000152	Thiophenic compounds
2753	35	58	0	0	1	7	510.524	0.000126	Thiophenic compounds
2754	36	58	0	0	1	8	522.524	0.000119	Thiophenic compounds
2755	37	58	0	0	1	9	534.524	0.000173	Thiophenic compounds
2756	38	58	0	0	1	10	546.524	0.000147	Thiophenic compounds
2757	39	58	0	0	1	11	558.524	0.000114	Thiophenic compounds
2758	40	58	0	0	1	12	570.524	8.8e-05	Thiophenic compounds
2759	41	58	0	0	1	13	582.524	6.2e-05	Thiophenic compounds
2760	42	58	0	0	1	14	594.524	6.6e-05	Thiophenic compounds
2761	43	58	0	0	1	15	606.524	5.2e-05	Thiophenic compounds
2762	44	58	0	0	1	16	618.524	4.5e-05	Thiophenic compounds
2763	45	58	0	0	1	17	630.524	2.9e-05	Thiophenic compounds
2764	46	58	0	0	1	18	642.524	1.1e-05	Thiophenic compounds
2765	47	58	0	0	1	19	654.524	7e-06	Thiophenic compounds
2766	32	60	0	0	1	3	476.54	7.7e-05	Thiophenic compounds
2767	33	60	0	0	1	4	488.54	0.000113	Thiophenic compounds
2768	34	60	0	0	1	5	500.54	0.000113	Thiophenic compounds
2769	35	60	0	0	1	6	512.54	0.00011	Thiophenic compounds
2770	36	60	0	0	1	7	524.54	9.1e-05	Thiophenic compounds
2771	37	60	0	0	1	8	536.54	9.5e-05	Thiophenic compounds
2772	38	60	0	0	1	9	548.54	0.00012	Thiophenic compounds
2773	39	60	0	0	1	10	560.54	0.000145	Thiophenic compounds
2774	40	60	0	0	1	11	572.54	0.00011	Thiophenic compounds
2775	41	60	0	0	1	12	584.54	6.6e-05	Thiophenic compounds
2776	42	60	0	0	1	13	596.54	6.3e-05	Thiophenic compounds
2777	43	60	0	0	1	14	608.54	4.4e-05	Thiophenic compounds
2778	44	60	0	0	1	15	620.54	3.1e-05	Thiophenic compounds
2779	45	60	0	0	1	16	632.54	2.3e-05	Thiophenic compounds
2780	46	60	0	0	1	17	644.54	6e-05	Thiophenic compounds
2781	47	60	0	0	1	18	656.54	1.2e-05	Thiophenic compounds
2782	48	60	0	0	1	19	668.54	2.1e-05	Thiophenic compounds
2783	33	62	0	0	1	3	490.556	7.9e-05	Thiophenic compounds
2784	34	62	0	0	1	4	502.556	9.3e-05	Thiophenic compounds
2785	35	62	0	0	1	5	514.556	0.00011	Thiophenic compounds
2786	36	62	0	0	1	6	526.556	9.7e-05	Thiophenic compounds
2787	37	62	0	0	1	7	538.556	8.7e-05	Thiophenic compounds
2788	38	62	0	0	1	8	550.556	0.000108	Thiophenic compounds
2789	39	62	0	0	1	9	562.556	0.000133	Thiophenic compounds
2790	40	62	0	0	1	10	574.556	0.000135	Thiophenic compounds
2791	41	62	0	0	1	11	586.556	9e-05	Thiophenic compounds
2792	42	62	0	0	1	12	598.556	6.3e-05	Thiophenic compounds
2793	43	62	0	0	1	13	610.556	4.9e-05	Thiophenic compounds
2794	44	62	0	0	1	14	622.556	5.1e-05	Thiophenic compounds
2795	45	62	0	0	1	15	634.556	4.8e-05	Thiophenic compounds
2796	46	62	0	0	1	16	646.556	4.4e-05	Thiophenic compounds
2797	47	62	0	0	1	17	658.556	4.4e-05	Thiophenic compounds
2798	48	62	0	0	1	18	670.556	2.3e-05	Thiophenic compounds
2799	49	62	0	0	1	19	682.556	6e-06	Thiophenic compounds
2800	34	64	0	0	1	3	504.572	4.3e-05	Thiophenic compounds
2801	35	64	0	0	1	4	516.572	7.8e-05	Thiophenic compounds
2802	36	64	0	0	1	5	528.572	9.5e-05	Thiophenic compounds
2803	37	64	0	0	1	6	540.572	8e-05	Thiophenic compounds
2804	38	64	0	0	1	7	552.572	7.9e-05	Thiophenic compounds
2805	39	64	0	0	1	8	564.572	9.9e-05	Thiophenic compounds
2806	40	64	0	0	1	9	576.572	0.000153	Thiophenic compounds
2807	41	64	0	0	1	10	588.572	9.9e-05	Thiophenic compounds
2808	42	64	0	0	1	11	600.572	9.5e-05	Thiophenic compounds
2809	43	64	0	0	1	12	612.572	0.000104	Thiophenic compounds
2810	44	64	0	0	1	13	624.572	8.9e-05	Thiophenic compounds
2811	45	64	0	0	1	14	636.572	7.9e-05	Thiophenic compounds
2812	46	64	0	0	1	15	648.572	5.1e-05	Thiophenic compounds
2813	47	64	0	0	1	16	660.572	5e-05	Thiophenic compounds
2814	48	64	0	0	1	17	672.572	8e-06	Thiophenic compounds
2815	49	64	0	0	1	18	684.572	1.8e-05	Thiophenic compounds
2816	50	64	0	0	1	19	696.572	4e-06	Thiophenic compounds
2817	35	66	0	0	1	3	518.588	2.2e-05	Thiophenic compounds
2818	36	66	0	0	1	4	530.588	5.3e-05	Thiophenic compounds
2819	37	66	0	0	1	5	542.588	7.7e-05	Thiophenic compounds
2820	38	66	0	0	1	6	554.588	6.2e-05	Thiophenic compounds
2821	39	66	0	0	1	7	566.588	7.9e-05	Thiophenic compounds
2822	40	66	0	0	1	8	578.588	7.2e-05	Thiophenic compounds
2823	41	66	0	0	1	9	590.588	9.4e-05	Thiophenic compounds
2824	42	66	0	0	1	10	602.588	7.1e-05	Thiophenic compounds
2825	43	66	0	0	1	11	614.588	6.6e-05	Thiophenic compounds
2826	44	66	0	0	1	12	626.588	6.6e-05	Thiophenic compounds
2827	45	66	0	0	1	13	638.588	3.5e-05	Thiophenic compounds
2828	46	66	0	0	1	14	650.588	3.2e-05	Thiophenic compounds
2829	47	66	0	0	1	15	662.588	6e-06	Thiophenic compounds
2830	48	66	0	0	1	16	674.588	2.4e-05	Thiophenic compounds
2831	49	66	0	0	1	17	686.588	1.3e-05	Thiophenic compounds
2832	50	66	0	0	1	18	698.588	1.7e-05	Thiophenic compounds
2833	51	66	0	0	1	19	710.588	4e-06	Thiophenic compounds
2834	37	68	0	0	1	4	544.604	4.7e-05	Thiophenic compounds
2835	38	68	0	0	1	5	556.604	5.1e-05	Thiophenic compounds
2836	39	68	0	0	1	6	568.604	5.7e-05	Thiophenic compounds
2837	40	68	0	0	1	7	580.604	7.3e-05	Thiophenic compounds
2838	41	68	0	0	1	8	592.604	0.00011	Thiophenic compounds
2839	42	68	0	0	1	9	604.604	7.3e-05	Thiophenic compounds
2840	43	68	0	0	1	10	616.604	0.0001	Thiophenic compounds
2841	44	68	0	0	1	11	628.604	5.8e-05	Thiophenic compounds
2842	45	68	0	0	1	12	640.604	6.9e-05	Thiophenic compounds
2843	46	68	0	0	1	13	652.604	2.5e-05	Thiophenic compounds
2844	47	68	0	0	1	14	664.604	3.3e-05	Thiophenic compounds
2845	48	68	0	0	1	15	676.604	2.8e-05	Thiophenic compounds
2846	49	68	0	0	1	16	688.604	1.6e-05	Thiophenic compounds
2847	50	68	0	0	1	17	700.604	3.2e-05	Thiophenic compounds
2848	51	68	0	0	1	18	712.604	1.3e-05	Thiophenic compounds
2849	37	70	0	0	1	3	546.62	1.5e-05	Thiophenic compounds
2850	38	70	0	0	1	4	558.62	3.1e-05	Thiophenic compounds
2851	39	70	0	0	1	5	570.62	4.3e-05	Thiophenic compounds
2852	40	70	0	0	1	6	582.62	5.4e-05	Thiophenic compounds
2853	41	70	0	0	1	7	594.62	3.9e-05	Thiophenic compounds
2854	42	70	0	0	1	8	606.62	0.000117	Thiophenic compounds
2855	43	70	0	0	1	9	618.62	8.9e-05	Thiophenic compounds
2856	44	70	0	0	1	10	630.62	7.4e-05	Thiophenic compounds
2857	45	70	0	0	1	11	642.62	6.8e-05	Thiophenic compounds
2858	46	70	0	0	1	12	654.62	5.1e-05	Thiophenic compounds
2859	47	70	0	0	1	13	666.62	3.1e-05	Thiophenic compounds
2860	48	70	0	0	1	14	678.62	3.7e-05	Thiophenic compounds
2861	49	70	0	0	1	15	690.62	1.4e-05	Thiophenic compounds
2862	50	70	0	0	1	16	702.62	4.4e-05	Thiophenic compounds
2863	51	70	0	0	1	17	714.62	4e-06	Thiophenic compounds
2864	52	70	0	0	1	18	726.62	2e-05	Thiophenic compounds
2865	53	70	0	0	1	19	738.62	1.2e-05	Thiophenic compounds
2866	38	72	0	0	1	3	560.636	4e-06	Thiophenic compounds
2867	39	72	0	0	1	4	572.636	0.000275	Thiophenic compounds
2868	40	72	0	0	1	5	584.636	4.2e-05	Thiophenic compounds
2869	41	72	0	0	1	6	596.636	0.000187	Thiophenic compounds
2870	42	72	0	0	1	7	608.636	0.000135	Thiophenic compounds
2871	43	72	0	0	1	8	620.636	9.4e-05	Thiophenic compounds
2872	44	72	0	0	1	9	632.636	7.6e-05	Thiophenic compounds
2873	45	72	0	0	1	10	644.636	5.6e-05	Thiophenic compounds
2874	46	72	0	0	1	11	656.636	3.1e-05	Thiophenic compounds
2875	47	72	0	0	1	12	668.636	4.8e-05	Thiophenic compounds
2876	48	72	0	0	1	13	680.636	1.4e-05	Thiophenic compounds
2877	49	72	0	0	1	14	692.636	1e-05	Thiophenic compounds
2878	50	72	0	0	1	15	704.636	2.6e-05	Thiophenic compounds
2879	51	72	0	0	1	16	716.636	1.3e-05	Thiophenic compounds
2880	52	72	0	0	1	17	728.636	8e-06	Thiophenic compounds
2881	53	72	0	0	1	18	740.636	1.9e-05	Thiophenic compounds
2882	54	72	0	0	1	19	752.636	4e-06	Thiophenic compounds
2883	39	74	0	0	1	3	574.652	6e-06	Thiophenic compounds
2884	40	74	0	0	1	4	586.652	0.000243	Thiophenic compounds
2885	41	74	0	0	1	5	598.652	0.000211	Thiophenic compounds
2886	42	74	0	0	1	6	610.652	3.6e-05	Thiophenic compounds
2887	43	74	0	0	1	7	622.652	0.000117	Thiophenic compounds
2888	44	74	0	0	1	8	634.652	8.4e-05	Thiophenic compounds
2889	45	74	0	0	1	9	646.652	4.3e-05	Thiophenic compounds
2890	46	74	0	0	1	10	658.652	4.9e-05	Thiophenic compounds
2891	47	74	0	0	1	11	670.652	5.1e-05	Thiophenic compounds
2892	48	74	0	0	1	12	682.652	5.2e-05	Thiophenic compounds
2893	49	74	0	0	1	13	694.652	3e-05	Thiophenic compounds
2894	50	74	0	0	1	14	706.652	1.9e-05	Thiophenic compounds
2895	51	74	0	0	1	15	718.652	1.1e-05	Thiophenic compounds
2896	52	74	0	0	1	16	730.652	9e-06	Thiophenic compounds
2897	54	74	0	0	1	18	754.652	1.2e-05	Thiophenic compounds
2898	55	74	0	0	1	19	766.652	4e-06	Thiophenic compounds
2899	41	76	0	0	1	4	600.668	7e-06	Thiophenic compounds
2900	42	76	0	0	1	5	612.668	2.1e-05	Thiophenic compounds
2901	43	76	0	0	1	6	624.668	0.00015	Thiophenic compounds
2902	44	76	0	0	1	7	636.668	0.000105	Thiophenic compounds
2903	45	76	0	0	1	8	648.668	8.1e-05	Thiophenic compounds
2904	46	76	0	0	1	9	660.668	5.3e-05	Thiophenic compounds
2905	47	76	0	0	1	10	672.668	6.8e-05	Thiophenic compounds
2906	48	76	0	0	1	11	684.668	1.9e-05	Thiophenic compounds
2907	49	76	0	0	1	12	696.668	1.8e-05	Thiophenic compounds
2908	50	76	0	0	1	13	708.668	2.3e-05	Thiophenic compounds
2909	51	76	0	0	1	14	720.668	9e-06	Thiophenic compounds
2910	52	76	0	0	1	15	732.668	5e-06	Thiophenic compounds
2911	53	76	0	0	1	16	744.668	4e-06	Thiophenic compounds
2912	54	76	0	0	1	17	756.668	4e-06	Thiophenic compounds
2913	55	76	0	0	1	18	768.668	5e-06	Thiophenic compounds
2914	44	78	0	0	1	6	638.684	0.000131	Thiophenic compounds
2915	45	78	0	0	1	7	650.684	9.5e-05	Thiophenic compounds
2916	46	78	0	0	1	8	662.684	7.4e-05	Thiophenic compounds
2917	47	78	0	0	1	9	674.684	5.1e-05	Thiophenic compounds
2918	48	78	0	0	1	10	686.684	1.1e-05	Thiophenic compounds
2919	49	78	0	0	1	11	698.684	4e-06	Thiophenic compounds
2920	50	78	0	0	1	12	710.684	2.5e-05	Thiophenic compounds
2921	51	78	0	0	1	13	722.684	5e-06	Thiophenic compounds
2922	52	78	0	0	1	14	734.684	1.4e-05	Thiophenic compounds
2923	53	78	0	0	1	15	746.684	1.7e-05	Thiophenic compounds
2924	54	78	0	0	1	16	758.684	1.7e-05	Thiophenic compounds
2925	55	78	0	0	1	17	770.684	4.1e-05	Thiophenic compounds
2926	56	78	0	0	1	18	782.684	9e-06	Thiophenic compounds
2927	57	78	0	0	1	19	794.684	4e-06	Thiophenic compounds
2928	43	80	0	0	1	4	628.7	0.00018	Thiophenic compounds
2929	45	80	0	0	1	6	652.7	0.000101	Thiophenic compounds
2930	46	80	0	0	1	7	664.7	9.3e-05	Thiophenic compounds
2931	47	80	0	0	1	8	676.7	5.6e-05	Thiophenic compounds
2932	48	80	0	0	1	9	688.7	2.6e-05	Thiophenic compounds
2933	49	80	0	0	1	10	700.7	2e-05	Thiophenic compounds
2934	50	80	0	0	1	11	712.7	1e-05	Thiophenic compounds
2935	51	80	0	0	1	12	724.7	3e-05	Thiophenic compounds
2936	52	80	0	0	1	13	736.7	1.2e-05	Thiophenic compounds
2937	53	80	0	0	1	14	748.7	5e-06	Thiophenic compounds
2938	55	80	0	0	1	16	772.7	9e-06	Thiophenic compounds
2939	57	80	0	0	1	18	796.7	3.2e-05	Thiophenic compounds
2940	58	80	0	0	1	19	808.7	4e-06	Thiophenic compounds
2941	44	82	0	0	1	4	642.716	0.000148	Thiophenic compounds
2942	45	82	0	0	1	5	654.716	0.000135	Thiophenic compounds
2943	46	82	0	0	1	6	666.716	0.000104	Thiophenic compounds
2944	47	82	0	0	1	7	678.716	6.1e-05	Thiophenic compounds
2945	48	82	0	0	1	8	690.716	4.6e-05	Thiophenic compounds
2946	49	82	0	0	1	9	702.716	2.6e-05	Thiophenic compounds
2947	50	82	0	0	1	10	714.716	4e-06	Thiophenic compounds
2948	51	82	0	0	1	11	726.716	4.6e-05	Thiophenic compounds
2949	52	82	0	0	1	12	738.716	4e-06	Thiophenic compounds
2950	53	82	0	0	1	13	750.716	9e-06	Thiophenic compounds
2951	54	82	0	0	1	14	762.716	4e-06	Thiophenic compounds
2952	55	82	0	0	1	15	774.716	5e-06	Thiophenic compounds
2953	57	82	0	0	1	17	798.716	5e-06	Thiophenic compounds
2954	45	84	0	0	1	4	656.732	0.000147	Thiophenic compounds
2955	46	84	0	0	1	5	668.732	0.00013	Thiophenic compounds
2956	47	84	0	0	1	6	680.732	8.6e-05	Thiophenic compounds
2957	48	84	0	0	1	7	692.732	7.5e-05	Thiophenic compounds
2958	49	84	0	0	1	8	704.732	4.9e-05	Thiophenic compounds
2959	50	84	0	0	1	9	716.732	5.8e-05	Thiophenic compounds
2960	51	84	0	0	1	10	728.732	3.3e-05	Thiophenic compounds
2961	52	84	0	0	1	11	740.732	1.1e-05	Thiophenic compounds
2962	53	84	0	0	1	12	752.732	2.7e-05	Thiophenic compounds
2963	54	84	0	0	1	13	764.732	6e-06	Thiophenic compounds
2964	55	84	0	0	1	14	776.732	3.5e-05	Thiophenic compounds
2965	56	84	0	0	1	15	788.732	1.4e-05	Thiophenic compounds
2966	58	84	0	0	1	17	812.732	4e-06	Thiophenic compounds
2967	46	86	0	0	1	4	670.748	0.000139	Thiophenic compounds
2968	47	86	0	0	1	5	682.748	8.7e-05	Thiophenic compounds
2969	48	86	0	0	1	6	694.748	8.1e-05	Thiophenic compounds
2970	49	86	0	0	1	7	706.748	5.2e-05	Thiophenic compounds
2971	50	86	0	0	1	8	718.748	2.1e-05	Thiophenic compounds
2972	51	86	0	0	1	9	730.748	3.2e-05	Thiophenic compounds
2973	52	86	0	0	1	10	742.748	8e-06	Thiophenic compounds
2974	53	86	0	0	1	11	754.748	2.7e-05	Thiophenic compounds
2975	54	86	0	0	1	12	766.748	2e-05	Thiophenic compounds
2976	55	86	0	0	1	13	778.748	1.5e-05	Thiophenic compounds
2977	56	86	0	0	1	14	790.748	9e-06	Thiophenic compounds
2978	57	86	0	0	1	15	802.748	4e-06	Thiophenic compounds
2979	60	86	0	0	1	18	838.748	4e-06	Thiophenic compounds
2980	47	88	0	0	1	4	684.764	0.000124	Thiophenic compounds
2981	48	88	0	0	1	5	696.764	9.3e-05	Thiophenic compounds
2982	49	88	0	0	1	6	708.764	5.3e-05	Thiophenic compounds
2983	50	88	0	0	1	7	720.764	4.6e-05	Thiophenic compounds
2984	51	88	0	0	1	8	732.764	1.8e-05	Thiophenic compounds
2985	52	88	0	0	1	9	744.764	3.3e-05	Thiophenic compounds
2986	53	88	0	0	1	10	756.764	2.6e-05	Thiophenic compounds
2987	54	88	0	0	1	11	768.764	2.8e-05	Thiophenic compounds
2988	56	88	0	0	1	13	792.764	8e-06	Thiophenic compounds
2989	57	88	0	0	1	14	804.764	1.5e-05	Thiophenic compounds
2990	58	88	0	0	1	15	816.764	1.1e-05	Thiophenic compounds
2991	48	90	0	0	1	4	698.78	0.000104	Thiophenic compounds
2992	49	90	0	0	1	5	710.78	7.6e-05	Thiophenic compounds
2993	50	90	0	0	1	6	722.78	7.3e-05	Thiophenic compounds
2994	51	90	0	0	1	7	734.78	3.7e-05	Thiophenic compounds
2995	52	90	0	0	1	8	746.78	4.9e-05	Thiophenic compounds
2996	53	90	0	0	1	9	758.78	1.9e-05	Thiophenic compounds
2997	54	90	0	0	1	10	770.78	1e-05	Thiophenic compounds
2998	57	90	0	0	1	13	806.78	7e-06	Thiophenic compounds
2999	58	90	0	0	1	14	818.78	5e-06	Thiophenic compounds
3000	59	90	0	0	1	15	830.78	5e-06	Thiophenic compounds
3001	49	92	0	0	1	4	712.796	7.9e-05	Thiophenic compounds
3002	50	92	0	0	1	5	724.796	5.5e-05	Thiophenic compounds
3003	51	92	0	0	1	6	736.796	4.2e-05	Thiophenic compounds
3004	52	92	0	0	1	7	748.796	4.6e-05	Thiophenic compounds
3005	53	92	0	0	1	8	760.796	2.2e-05	Thiophenic compounds
3006	54	92	0	0	1	9	772.796	2.1e-05	Thiophenic compounds
3007	56	92	0	0	1	11	796.796	1.4e-05	Thiophenic compounds
3008	57	92	0	0	1	12	808.796	4e-06	Thiophenic compounds
3009	58	92	0	0	1	13	820.796	5e-06	Thiophenic compounds
3010	60	92	0	0	1	15	844.796	5e-06	Thiophenic compounds
3011	62	92	0	0	1	17	868.796	1.3e-05	Thiophenic compounds
3012	50	94	0	0	1	4	726.812	8.4e-05	Thiophenic compounds
3013	51	94	0	0	1	5	738.812	2.3e-05	Thiophenic compounds
3014	52	94	0	0	1	6	750.812	1.6e-05	Thiophenic compounds
3015	53	94	0	0	1	7	762.812	4e-05	Thiophenic compounds
3016	54	94	0	0	1	8	774.812	4e-06	Thiophenic compounds
3017	55	94	0	0	1	9	786.812	2e-05	Thiophenic compounds
3018	56	94	0	0	1	10	798.812	5e-06	Thiophenic compounds
3019	57	94	0	0	1	11	810.812	8e-06	Thiophenic compounds
3020	59	94	0	0	1	13	834.812	5e-06	Thiophenic compounds
3021	64	94	0	0	1	18	894.812	6e-06	Thiophenic compounds
3022	51	96	0	0	1	4	740.828	7.9e-05	Thiophenic compounds
3023	52	96	0	0	1	5	752.828	3.3e-05	Thiophenic compounds
3024	53	96	0	0	1	6	764.828	5e-05	Thiophenic compounds
3025	54	96	0	0	1	7	776.828	4.3e-05	Thiophenic compounds
3026	55	96	0	0	1	8	788.828	1.2e-05	Thiophenic compounds
3027	56	96	0	0	1	9	800.828	1.6e-05	Thiophenic compounds
3028	58	96	0	0	1	11	824.828	1.5e-05	Thiophenic compounds
3029	63	96	0	0	1	16	884.828	5e-06	Thiophenic compounds
3030	65	96	0	0	1	18	908.828	5e-06	Thiophenic compounds
3031	52	98	0	0	1	4	754.844	6.5e-05	Thiophenic compounds
3032	53	98	0	0	1	5	766.844	4.5e-05	Thiophenic compounds
3033	54	98	0	0	1	6	778.844	4.9e-05	Thiophenic compounds
3034	55	98	0	0	1	7	790.844	2.7e-05	Thiophenic compounds
3035	58	98	0	0	1	10	826.844	1.2e-05	Thiophenic compounds
3036	60	98	0	0	1	12	850.844	6e-06	Thiophenic compounds
3037	61	98	0	0	1	13	862.844	1e-05	Thiophenic compounds
3038	66	98	0	0	1	18	922.844	6e-06	Thiophenic compounds
3039	53	100	0	0	1	4	768.86	5.1e-05	Thiophenic compounds
3040	54	100	0	0	1	5	780.86	2.7e-05	Thiophenic compounds
3041	55	100	0	0	1	6	792.86	5e-06	Thiophenic compounds
3042	56	100	0	0	1	7	804.86	2.8e-05	Thiophenic compounds
3043	58	100	0	0	1	9	828.86	4e-06	Thiophenic compounds
3044	59	100	0	0	1	10	840.86	5e-06	Thiophenic compounds
3045	60	100	0	0	1	11	852.86	5e-06	Thiophenic compounds
3046	61	100	0	0	1	12	864.86	5e-06	Thiophenic compounds
3047	54	102	0	0	1	4	782.876	4.6e-05	Thiophenic compounds
3048	55	102	0	0	1	5	794.876	3e-05	Thiophenic compounds
3049	56	102	0	0	1	6	806.876	1e-05	Thiophenic compounds
3050	58	102	0	0	1	8	830.876	1.2e-05	Thiophenic compounds
3051	59	102	0	0	1	9	842.876	2e-05	Thiophenic compounds
3052	61	102	0	0	1	11	866.876	1.7e-05	Thiophenic compounds
3053	62	102	0	0	1	12	878.876	2.7e-05	Thiophenic compounds
3054	66	102	0	0	1	16	926.876	6e-06	Thiophenic compounds
3055	55	104	0	0	1	4	796.892	5e-05	Thiophenic compounds
3056	56	104	0	0	1	5	808.892	5e-06	Thiophenic compounds
3057	57	104	0	0	1	6	820.892	3.8e-05	Thiophenic compounds
3058	59	104	0	0	1	8	844.892	5e-06	Thiophenic compounds
3059	56	106	0	0	1	4	810.908	3.2e-05	Thiophenic compounds
3060	57	106	0	0	1	5	822.908	1.5e-05	Thiophenic compounds
3061	59	106	0	0	1	7	846.908	1.4e-05	Thiophenic compounds
3062	58	108	0	0	1	5	836.924	4e-06	Thiophenic compounds
3063	58	110	0	0	1	4	838.94	5e-06	Thiophenic compounds
3064	62	110	0	0	1	8	886.94	1e-05	Thiophenic compounds
3065	64	110	0	0	1	10	910.94	6e-06	Thiophenic compounds
3066	65	110	0	0	1	11	922.94	5e-06	Thiophenic compounds
3067	66	110	0	0	1	12	934.94	7e-06	Thiophenic compounds
3068	59	112	0	0	1	4	852.956	5e-06	Thiophenic compounds
3069	61	112	0	0	1	6	876.956	5e-06	Thiophenic compounds
3070	65	112	0	0	1	10	924.956	1.1e-05	Thiophenic compounds
3071	61	114	0	0	1	5	878.972	1e-05	Thiophenic compounds
3072	69	114	0	0	1	13	974.972	5e-06	Thiophenic compounds
3073	62	116	0	0	1	5	892.988	5e-06	Thiophenic compounds
3074	63	116	0	0	1	6	904.988	1.6e-05	Thiophenic compounds
3075	64	118	0	0	1	6	919.004	1.6e-05	Thiophenic compounds
3076	66	122	0	0	1	6	947.036	6e-06	Thiophenic compounds
3077	14	12	0	0	1	9	212.156	3.1e-05	Sulfidic compounds
3078	14	14	0	0	1	8	214.172	1.5e-05	Sulfidic compounds
3079	15	14	0	0	1	9	226.172	4.8e-05	Sulfidic compounds
3080	14	16	0	0	1	7	216.188	3.1e-05	Sulfidic compounds
3081	15	16	0	0	1	8	228.188	2.8e-05	Sulfidic compounds
3082	16	16	0	0	1	9	240.188	7.7e-05	Sulfidic compounds
3083	12	18	0	0	1	4	194.204	7e-06	Sulfidic compounds
3084	14	18	0	0	1	6	218.204	5e-06	Sulfidic compounds
3085	15	18	0	0	1	7	230.204	1.3e-05	Sulfidic compounds
3086	16	18	0	0	1	8	242.204	3e-05	Sulfidic compounds
3087	17	18	0	0	1	9	254.204	0.000133	Sulfidic compounds
3088	12	20	0	0	1	3	196.22	2e-06	Sulfidic compounds
3089	14	20	0	0	1	5	220.22	2e-06	Sulfidic compounds
3090	15	20	0	0	1	6	232.22	1e-06	Sulfidic compounds
3091	16	20	0	0	1	7	244.22	3.2e-05	Sulfidic compounds
3092	17	20	0	0	1	8	256.22	3.2e-05	Sulfidic compounds
3093	18	20	0	0	1	9	268.22	3e-05	Sulfidic compounds
3094	19	20	0	0	1	10	280.22	9.9e-05	Sulfidic compounds
3095	12	22	0	0	1	2	198.236	1e-06	Sulfidic compounds
3096	13	22	0	0	1	3	210.236	1e-06	Sulfidic compounds
3097	14	22	0	0	1	4	222.236	7e-06	Sulfidic compounds
3098	16	22	0	0	1	6	246.236	2.6e-05	Sulfidic compounds
3099	17	22	0	0	1	7	258.236	0.000177	Sulfidic compounds
3100	18	22	0	0	1	8	270.236	4e-05	Sulfidic compounds
3101	19	22	0	0	1	9	282.236	3.5e-05	Sulfidic compounds
3102	20	22	0	0	1	10	294.236	5.9e-05	Sulfidic compounds
3103	13	24	0	0	1	2	212.252	5e-06	Sulfidic compounds
3104	14	24	0	0	1	3	224.252	1.4e-05	Sulfidic compounds
3105	16	24	0	0	1	5	248.252	5e-05	Sulfidic compounds
3106	17	24	0	0	1	6	260.252	5.6e-05	Sulfidic compounds
3107	18	24	0	0	1	7	272.252	7.2e-05	Sulfidic compounds
3108	19	24	0	0	1	8	284.252	7.5e-05	Sulfidic compounds
3109	20	24	0	0	1	9	296.252	0.000148	Sulfidic compounds
3110	21	24	0	0	1	10	308.252	2.8e-05	Sulfidic compounds
3111	14	26	0	0	1	2	226.268	5e-06	Sulfidic compounds
3112	15	26	0	0	1	3	238.268	2e-05	Sulfidic compounds
3113	16	26	0	0	1	4	250.268	9.2e-05	Sulfidic compounds
3114	17	26	0	0	1	5	262.268	0.00016	Sulfidic compounds
3115	18	26	0	0	1	6	274.268	0.000147	Sulfidic compounds
3116	19	26	0	0	1	7	286.268	0.000137	Sulfidic compounds
3117	20	26	0	0	1	8	298.268	0.000115	Sulfidic compounds
3118	21	26	0	0	1	9	310.268	4.2e-05	Sulfidic compounds
3119	22	26	0	0	1	10	322.268	4.3e-05	Sulfidic compounds
3120	15	28	0	0	1	2	240.284	9e-06	Sulfidic compounds
3121	16	28	0	0	1	3	252.284	0.000108	Sulfidic compounds
3122	17	28	0	0	1	4	264.284	0.000235	Sulfidic compounds
3123	18	28	0	0	1	5	276.284	0.000394	Sulfidic compounds
3124	19	28	0	0	1	6	288.284	0.000258	Sulfidic compounds
3125	20	28	0	0	1	7	300.284	0.000231	Sulfidic compounds
3126	21	28	0	0	1	8	312.284	0.000124	Sulfidic compounds
3127	22	28	0	0	1	9	324.284	6.1e-05	Sulfidic compounds
3128	23	28	0	0	1	10	336.284	3.2e-05	Sulfidic compounds
3129	16	30	0	0	1	2	254.3	1.4e-05	Sulfidic compounds
3130	17	30	0	0	1	3	266.3	0.00018	Sulfidic compounds
3131	18	30	0	0	1	4	278.3	0.000504	Sulfidic compounds
3132	19	30	0	0	1	5	290.3	0.000608	Sulfidic compounds
3133	20	30	0	0	1	6	302.3	0.000444	Sulfidic compounds
3134	21	30	0	0	1	7	314.3	0.000346	Sulfidic compounds
3135	22	30	0	0	1	8	326.3	0.000145	Sulfidic compounds
3136	23	30	0	0	1	9	338.3	8.3e-05	Sulfidic compounds
3137	24	30	0	0	1	10	350.3	3.6e-05	Sulfidic compounds
3138	17	32	0	0	1	2	268.316	3.7e-05	Sulfidic compounds
3139	18	32	0	0	1	3	280.316	0.000392	Sulfidic compounds
3140	19	32	0	0	1	4	292.316	0.000678	Sulfidic compounds
3141	20	32	0	0	1	5	304.316	0.000823	Sulfidic compounds
3142	21	32	0	0	1	6	316.316	0.000485	Sulfidic compounds
3143	22	32	0	0	1	7	328.316	0.000313	Sulfidic compounds
3144	23	32	0	0	1	8	340.316	0.000168	Sulfidic compounds
3145	24	32	0	0	1	9	352.316	0.000111	Sulfidic compounds
3146	25	32	0	0	1	10	364.316	4.8e-05	Sulfidic compounds
3147	18	34	0	0	1	2	282.332	7.3e-05	Sulfidic compounds
3148	19	34	0	0	1	3	294.332	0.000497	Sulfidic compounds
3149	20	34	0	0	1	4	306.332	0.00086	Sulfidic compounds
3150	21	34	0	0	1	5	318.332	0.000754	Sulfidic compounds
3151	22	34	0	0	1	6	330.332	0.000643	Sulfidic compounds
3152	23	34	0	0	1	7	342.332	0.000325	Sulfidic compounds
3153	24	34	0	0	1	8	354.332	0.000177	Sulfidic compounds
3154	25	34	0	0	1	9	366.332	7.7e-05	Sulfidic compounds
3155	26	34	0	0	1	10	378.332	3.6e-05	Sulfidic compounds
3156	19	36	0	0	1	2	296.348	5e-05	Sulfidic compounds
3157	20	36	0	0	1	3	308.348	0.000444	Sulfidic compounds
3158	21	36	0	0	1	4	320.348	0.00076	Sulfidic compounds
3159	22	36	0	0	1	5	332.348	0.000827	Sulfidic compounds
3160	23	36	0	0	1	6	344.348	0.000531	Sulfidic compounds
3161	24	36	0	0	1	7	356.348	0.000311	Sulfidic compounds
3162	25	36	0	0	1	8	368.348	0.000148	Sulfidic compounds
3163	26	36	0	0	1	9	380.348	0.000107	Sulfidic compounds
3164	27	36	0	0	1	10	392.348	3.3e-05	Sulfidic compounds
3165	20	38	0	0	1	2	310.364	7.9e-05	Sulfidic compounds
3166	21	38	0	0	1	3	322.364	0.000418	Sulfidic compounds
3167	22	38	0	0	1	4	334.364	0.000699	Sulfidic compounds
3168	23	38	0	0	1	5	346.364	0.000673	Sulfidic compounds
3169	24	38	0	0	1	6	358.364	0.000525	Sulfidic compounds
3170	25	38	0	0	1	7	370.364	0.000317	Sulfidic compounds
3171	26	38	0	0	1	8	382.364	0.000133	Sulfidic compounds
3172	27	38	0	0	1	9	394.364	7.7e-05	Sulfidic compounds
3173	28	38	0	0	1	10	406.364	1.7e-05	Sulfidic compounds
3174	21	40	0	0	1	2	324.38	5.7e-05	Sulfidic compounds
3175	22	40	0	0	1	3	336.38	0.000365	Sulfidic compounds
3176	23	40	0	0	1	4	348.38	0.000606	Sulfidic compounds
3177	24	40	0	0	1	5	360.38	0.000616	Sulfidic compounds
3178	25	40	0	0	1	6	372.38	0.000435	Sulfidic compounds
3179	26	40	0	0	1	7	384.38	0.00029	Sulfidic compounds
3180	27	40	0	0	1	8	396.38	0.00015	Sulfidic compounds
3181	28	40	0	0	1	9	408.38	8.5e-05	Sulfidic compounds
3182	29	40	0	0	1	10	420.38	5.4e-05	Sulfidic compounds
3183	22	42	0	0	1	2	338.396	5.1e-05	Sulfidic compounds
3184	23	42	0	0	1	3	350.396	0.00027	Sulfidic compounds
3185	24	42	0	0	1	4	362.396	0.000501	Sulfidic compounds
3186	25	42	0	0	1	5	374.396	0.000565	Sulfidic compounds
3187	26	42	0	0	1	6	386.396	0.00043	Sulfidic compounds
3188	27	42	0	0	1	7	398.396	0.000259	Sulfidic compounds
3189	28	42	0	0	1	8	410.396	0.000149	Sulfidic compounds
3190	29	42	0	0	1	9	422.396	6.7e-05	Sulfidic compounds
3191	30	42	0	0	1	10	434.396	4.1e-05	Sulfidic compounds
3192	23	44	0	0	1	2	352.412	1.8e-05	Sulfidic compounds
3193	24	44	0	0	1	3	364.412	0.000248	Sulfidic compounds
3194	25	44	0	0	1	4	376.412	0.00044	Sulfidic compounds
3195	26	44	0	0	1	5	388.412	0.000505	Sulfidic compounds
3196	27	44	0	0	1	6	400.412	0.000422	Sulfidic compounds
3197	28	44	0	0	1	7	412.412	0.00022	Sulfidic compounds
3198	29	44	0	0	1	8	424.412	0.000166	Sulfidic compounds
3199	30	44	0	0	1	9	436.412	6.1e-05	Sulfidic compounds
3200	31	44	0	0	1	10	448.412	4.6e-05	Sulfidic compounds
3201	24	46	0	0	1	2	366.428	4.2e-05	Sulfidic compounds
3202	25	46	0	0	1	3	378.428	0.000239	Sulfidic compounds
3203	26	46	0	0	1	4	390.428	0.00041	Sulfidic compounds
3204	27	46	0	0	1	5	402.428	0.000455	Sulfidic compounds
3205	28	46	0	0	1	6	414.428	0.000349	Sulfidic compounds
3206	29	46	0	0	1	7	426.428	0.000213	Sulfidic compounds
3207	30	46	0	0	1	8	438.428	0.000114	Sulfidic compounds
3208	31	46	0	0	1	9	450.428	5.5e-05	Sulfidic compounds
3209	32	46	0	0	1	10	462.428	3.7e-05	Sulfidic compounds
3210	25	48	0	0	1	2	380.444	9e-06	Sulfidic compounds
3211	26	48	0	0	1	3	392.444	0.000189	Sulfidic compounds
3212	27	48	0	0	1	4	404.444	0.000366	Sulfidic compounds
3213	28	48	0	0	1	5	416.444	0.000419	Sulfidic compounds
3214	29	48	0	0	1	6	428.444	0.000384	Sulfidic compounds
3215	30	48	0	0	1	7	440.444	0.00021	Sulfidic compounds
3216	31	48	0	0	1	8	452.444	8.6e-05	Sulfidic compounds
3217	32	48	0	0	1	9	464.444	4.1e-05	Sulfidic compounds
3218	33	48	0	0	1	10	476.444	1.3e-05	Sulfidic compounds
3219	26	50	0	0	1	2	394.46	2e-05	Sulfidic compounds
3220	27	50	0	0	1	3	406.46	0.000171	Sulfidic compounds
3221	28	50	0	0	1	4	418.46	0.000291	Sulfidic compounds
3222	29	50	0	0	1	5	430.46	0.000368	Sulfidic compounds
3223	30	50	0	0	1	6	442.46	0.000289	Sulfidic compounds
3224	31	50	0	0	1	7	454.46	0.000162	Sulfidic compounds
3225	32	50	0	0	1	8	466.46	9.3e-05	Sulfidic compounds
3226	33	50	0	0	1	9	478.46	8e-06	Sulfidic compounds
3227	34	50	0	0	1	10	490.46	9e-06	Sulfidic compounds
3228	28	52	0	0	1	3	420.476	0.000144	Sulfidic compounds
3229	29	52	0	0	1	4	432.476	0.000298	Sulfidic compounds
3230	30	52	0	0	1	5	444.476	0.000359	Sulfidic compounds
3231	31	52	0	0	1	6	456.476	0.000292	Sulfidic compounds
3232	32	52	0	0	1	7	468.476	0.000144	Sulfidic compounds
3233	33	52	0	0	1	8	480.476	0.000109	Sulfidic compounds
3234	34	52	0	0	1	9	492.476	3.8e-05	Sulfidic compounds
3235	35	52	0	0	1	10	504.476	6e-06	Sulfidic compounds
3236	28	54	0	0	1	2	422.492	3e-06	Sulfidic compounds
3237	29	54	0	0	1	3	434.492	0.00012	Sulfidic compounds
3238	30	54	0	0	1	4	446.492	0.000233	Sulfidic compounds
3239	31	54	0	0	1	5	458.492	0.000263	Sulfidic compounds
3240	32	54	0	0	1	6	470.492	0.000233	Sulfidic compounds
3241	33	54	0	0	1	7	482.492	0.000132	Sulfidic compounds
3242	34	54	0	0	1	8	494.492	5.8e-05	Sulfidic compounds
3243	35	54	0	0	1	9	506.492	1.3e-05	Sulfidic compounds
3244	29	56	0	0	1	2	436.508	1e-05	Sulfidic compounds
3245	30	56	0	0	1	3	448.508	0.000112	Sulfidic compounds
3246	31	56	0	0	1	4	460.508	2.9e-05	Sulfidic compounds
3247	32	56	0	0	1	5	472.508	0.000221	Sulfidic compounds
3248	33	56	0	0	1	6	484.508	0.000173	Sulfidic compounds
3249	34	56	0	0	1	7	496.508	0.000107	Sulfidic compounds
3250	35	56	0	0	1	8	508.508	5.2e-05	Sulfidic compounds
3251	30	58	0	0	1	2	450.524	3e-06	Sulfidic compounds
3252	31	58	0	0	1	3	462.524	0.000107	Sulfidic compounds
3253	32	58	0	0	1	4	474.524	4e-06	Sulfidic compounds
3254	33	58	0	0	1	5	486.524	0.000148	Sulfidic compounds
3255	34	58	0	0	1	6	498.524	0.000133	Sulfidic compounds
3256	35	58	0	0	1	7	510.524	9.2e-05	Sulfidic compounds
3257	36	58	0	0	1	8	522.524	4.4e-05	Sulfidic compounds
3258	37	58	0	0	1	9	534.524	1.7e-05	Sulfidic compounds
3259	32	60	0	0	1	3	476.54	6.9e-05	Sulfidic compounds
3260	33	60	0	0	1	4	488.54	0.00012	Sulfidic compounds
3261	34	60	0	0	1	5	500.54	0.000109	Sulfidic compounds
3262	35	60	0	0	1	6	512.54	0.000124	Sulfidic compounds
3263	36	60	0	0	1	7	524.54	7e-05	Sulfidic compounds
3264	37	60	0	0	1	8	536.54	1.1e-05	Sulfidic compounds
3265	38	60	0	0	1	9	548.54	3.3e-05	Sulfidic compounds
3266	32	62	0	0	1	2	478.556	1e-05	Sulfidic compounds
3267	33	62	0	0	1	3	490.556	4.8e-05	Sulfidic compounds
3268	34	62	0	0	1	4	502.556	9.7e-05	Sulfidic compounds
3269	35	62	0	0	1	5	514.556	7.1e-05	Sulfidic compounds
3270	36	62	0	0	1	6	526.556	0.000125	Sulfidic compounds
3271	37	62	0	0	1	7	538.556	6.6e-05	Sulfidic compounds
3272	38	62	0	0	1	8	550.556	2.9e-05	Sulfidic compounds
3273	39	62	0	0	1	9	562.556	5.8e-05	Sulfidic compounds
3274	34	64	0	0	1	3	504.572	4.6e-05	Sulfidic compounds
3275	35	64	0	0	1	4	516.572	8.5e-05	Sulfidic compounds
3276	36	64	0	0	1	5	528.572	8.6e-05	Sulfidic compounds
3277	37	64	0	0	1	6	540.572	7.4e-05	Sulfidic compounds
3278	38	64	0	0	1	7	552.572	4.8e-05	Sulfidic compounds
3279	39	64	0	0	1	8	564.572	2.4e-05	Sulfidic compounds
3280	40	64	0	0	1	9	576.572	4.9e-05	Sulfidic compounds
3281	34	66	0	0	1	2	506.588	4e-06	Sulfidic compounds
3282	35	66	0	0	1	3	518.588	2.6e-05	Sulfidic compounds
3283	36	66	0	0	1	4	530.588	8.6e-05	Sulfidic compounds
3284	37	66	0	0	1	5	542.588	4.6e-05	Sulfidic compounds
3285	38	66	0	0	1	6	554.588	5.7e-05	Sulfidic compounds
3286	39	66	0	0	1	7	566.588	5e-06	Sulfidic compounds
3287	40	66	0	0	1	8	578.588	3.4e-05	Sulfidic compounds
3288	41	66	0	0	1	9	590.588	4e-06	Sulfidic compounds
3289	36	68	0	0	1	3	532.604	6e-05	Sulfidic compounds
3290	37	68	0	0	1	4	544.604	3.9e-05	Sulfidic compounds
3291	38	68	0	0	1	5	556.604	9.5e-05	Sulfidic compounds
3292	39	68	0	0	1	6	568.604	3.6e-05	Sulfidic compounds
3293	40	68	0	0	1	7	580.604	6e-05	Sulfidic compounds
3294	41	68	0	0	1	8	592.604	1.2e-05	Sulfidic compounds
3295	37	70	0	0	1	3	546.62	1.2e-05	Sulfidic compounds
3296	38	70	0	0	1	4	558.62	9e-06	Sulfidic compounds
3297	39	70	0	0	1	5	570.62	1.3e-05	Sulfidic compounds
3298	40	70	0	0	1	6	582.62	6.3e-05	Sulfidic compounds
3299	42	70	0	0	1	8	606.62	1.8e-05	Sulfidic compounds
3300	38	72	0	0	1	3	560.636	3.5e-05	Sulfidic compounds
3301	39	72	0	0	1	4	572.636	2e-05	Sulfidic compounds
3302	40	72	0	0	1	5	584.636	0.000141	Sulfidic compounds
3303	41	72	0	0	1	6	596.636	2.8e-05	Sulfidic compounds
3304	42	72	0	0	1	7	608.636	5e-06	Sulfidic compounds
3305	39	74	0	0	1	3	574.652	4e-06	Sulfidic compounds
3306	40	74	0	0	1	4	586.652	1.8e-05	Sulfidic compounds
3307	41	74	0	0	1	5	598.652	2.3e-05	Sulfidic compounds
3308	42	74	0	0	1	6	610.652	4e-06	Sulfidic compounds
3309	40	76	0	0	1	3	588.668	2.4e-05	Sulfidic compounds
3310	41	76	0	0	1	4	600.668	5e-05	Sulfidic compounds
3311	42	76	0	0	1	5	612.668	7.8e-05	Sulfidic compounds
3312	42	78	0	0	1	4	614.684	6.3e-05	Sulfidic compounds
3313	42	80	0	0	1	3	616.7	1.2e-05	Sulfidic compounds
3314	45	80	0	0	1	6	652.7	5e-06	Sulfidic compounds
3315	13	10	1	0	0	9	182.08	9e-06	Acidic fraction
3316	12	10	2	0	0	8	186.08	1.1e-05	Acidic fraction
3317	28	10	2	0	0	24	378.08	2.8e-05	Acidic fraction
3318	11	12	2	0	0	6	176.096	1.2e-05	Acidic fraction
3319	13	12	1	0	0	8	184.096	0.000789	Acidic fraction
3320	14	12	1	0	0	9	196.096	6.6e-05	Acidic fraction
3321	13	12	2	0	0	8	200.096	4.3e-05	Acidic fraction
3322	15	12	1	0	0	10	208.096	2e-05	Acidic fraction
3323	14	12	2	0	0	9	212.096	9e-06	Acidic fraction
3324	16	12	1	0	0	11	220.096	7.5e-05	Acidic fraction
3325	15	12	2	0	0	10	224.096	1.6e-05	Acidic fraction
3326	17	12	1	0	0	12	232.096	8e-06	Acidic fraction
3327	19	12	1	0	0	14	256.096	3.5e-05	Acidic fraction
3328	18	12	2	0	0	13	260.096	6e-06	Acidic fraction
3329	24	12	1	0	0	19	316.096	9e-06	Acidic fraction
3330	12	14	1	0	0	6	174.112	9e-06	Acidic fraction
3331	11	14	2	0	0	5	178.112	0.000167	Acidic fraction
3332	13	14	1	0	0	7	186.112	1.2e-05	Acidic fraction
3333	12	14	2	0	0	6	190.112	5e-05	Acidic fraction
3334	14	14	1	0	0	8	198.112	0.002829	Acidic fraction
3335	13	14	2	0	0	7	202.112	9e-06	Acidic fraction
3336	15	14	1	0	0	9	210.112	0.000187	Acidic fraction
3337	14	14	2	0	0	8	214.112	3.2e-05	Acidic fraction
3338	16	14	1	0	0	10	222.112	3.6e-05	Acidic fraction
3339	15	14	2	0	0	9	226.112	7e-06	Acidic fraction
3340	17	14	1	0	0	11	234.112	0.000528	Acidic fraction
3341	16	14	2	0	0	10	238.112	2e-05	Acidic fraction
3342	18	14	1	0	0	12	246.112	5.2e-05	Acidic fraction
3343	19	14	1	0	0	13	258.112	3.5e-05	Acidic fraction
3344	20	14	1	0	0	14	270.112	0.000233	Acidic fraction
3345	19	14	2	0	0	13	274.112	0.000105	Acidic fraction
3346	21	14	1	0	0	15	282.112	1.3e-05	Acidic fraction
3347	23	14	1	0	0	17	306.112	8e-06	Acidic fraction
3348	11	16	1	0	0	4	164.128	0.006303	Acidic fraction
3349	12	16	1	0	0	5	176.128	0.000166	Acidic fraction
3350	11	16	2	0	0	4	180.128	2.9e-05	Acidic fraction
3351	13	16	1	0	0	6	188.128	0.000201	Acidic fraction
3352	12	16	2	0	0	5	192.128	6.9e-05	Acidic fraction
3353	14	16	1	0	0	7	200.128	1.6e-05	Acidic fraction
3354	13	16	2	0	0	6	204.128	0.000383	Acidic fraction
3355	15	16	1	0	0	8	212.128	0.002751	Acidic fraction
3356	14	16	2	0	0	7	216.128	1e-05	Acidic fraction
3357	16	16	1	0	0	9	224.128	0.000289	Acidic fraction
3358	15	16	2	0	0	8	228.128	7.2e-05	Acidic fraction
3359	17	16	1	0	0	10	236.128	3.7e-05	Acidic fraction
3360	16	16	2	0	0	9	240.128	3e-05	Acidic fraction
3361	18	16	1	0	0	11	248.128	0.000981	Acidic fraction
3362	17	16	2	0	0	10	252.128	3.6e-05	Acidic fraction
3363	19	16	1	0	0	12	260.128	0.000171	Acidic fraction
3364	20	16	1	0	0	13	272.128	0.000203	Acidic fraction
3365	19	16	2	0	0	12	276.128	8e-06	Acidic fraction
3366	21	16	1	0	0	14	284.128	0.00038	Acidic fraction
3367	20	16	2	0	0	13	288.128	0.000503	Acidic fraction
3368	22	16	1	0	0	15	296.128	6.9e-05	Acidic fraction
3369	23	16	1	0	0	16	308.128	3.1e-05	Acidic fraction
3370	24	16	1	0	0	17	320.128	5.9e-05	Acidic fraction
3371	9	18	2	0	0	1	158.144	2.1e-05	Acidic fraction
3372	10	18	2	0	0	2	170.144	1.3e-05	Acidic fraction
3373	12	18	1	0	0	4	178.144	0.000321	Acidic fraction
3374	11	18	2	0	0	3	182.144	2.6e-05	Acidic fraction
3375	13	18	1	0	0	5	190.144	0.000608	Acidic fraction
3376	12	18	2	0	0	4	194.144	3.1e-05	Acidic fraction
3377	14	18	1	0	0	6	202.144	0.000591	Acidic fraction
3378	13	18	2	0	0	5	206.144	4.1e-05	Acidic fraction
3379	15	18	1	0	0	7	214.144	0.000107	Acidic fraction
3380	14	18	2	0	0	6	218.144	2.6e-05	Acidic fraction
3381	16	18	1	0	0	8	226.144	0.002438	Acidic fraction
3382	15	18	2	0	0	7	230.144	1.2e-05	Acidic fraction
3383	17	18	1	0	0	9	238.144	0.00063	Acidic fraction
3384	16	18	2	0	0	8	242.144	2.4e-05	Acidic fraction
3385	18	18	1	0	0	10	250.144	9.2e-05	Acidic fraction
3386	17	18	2	0	0	9	254.144	3e-05	Acidic fraction
3387	19	18	1	0	0	11	262.144	0.000916	Acidic fraction
3388	18	18	2	0	0	10	266.144	1.4e-05	Acidic fraction
3389	20	18	1	0	0	12	274.144	0.000399	Acidic fraction
3390	19	18	2	0	0	11	278.144	7e-06	Acidic fraction
3391	21	18	1	0	0	13	286.144	0.000382	Acidic fraction
3392	20	18	2	0	0	12	290.144	1.3e-05	Acidic fraction
3393	22	18	1	0	0	14	298.144	0.000472	Acidic fraction
3394	21	18	2	0	0	13	302.144	0.000971	Acidic fraction
3395	23	18	1	0	0	15	310.144	9e-05	Acidic fraction
3396	22	18	2	0	0	14	314.144	1.6e-05	Acidic fraction
3397	24	18	1	0	0	16	322.144	8.7e-05	Acidic fraction
3398	25	18	1	0	0	17	334.144	0.000121	Acidic fraction
3399	24	18	2	0	0	16	338.144	2.8e-05	Acidic fraction
3400	26	18	1	0	0	18	346.144	1.5e-05	Acidic fraction
3401	10	20	2	0	0	1	172.16	0.002418	Acidic fraction
3402	11	20	2	0	0	2	184.16	0.00012	Acidic fraction
3403	13	20	1	0	0	4	192.16	0.000314	Acidic fraction
3404	12	20	2	0	0	3	196.16	0.00072	Acidic fraction
3405	14	20	1	0	0	5	204.16	0.000724	Acidic fraction
3406	13	20	2	0	0	4	208.16	0.000304	Acidic fraction
3407	15	20	1	0	0	6	216.16	0.001036	Acidic fraction
3408	14	20	2	0	0	5	220.16	8.1e-05	Acidic fraction
3409	16	20	1	0	0	7	228.16	0.000368	Acidic fraction
3410	15	20	2	0	0	6	232.16	3.1e-05	Acidic fraction
3411	17	20	1	0	0	8	240.16	0.001991	Acidic fraction
3412	16	20	2	0	0	7	244.16	1.4e-05	Acidic fraction
3413	18	20	1	0	0	9	252.16	0.001198	Acidic fraction
3414	17	20	2	0	0	8	256.16	1.1e-05	Acidic fraction
3415	19	20	1	0	0	10	264.16	0.000251	Acidic fraction
3416	18	20	2	0	0	9	268.16	2.6e-05	Acidic fraction
3417	20	20	1	0	0	11	276.16	0.000604	Acidic fraction
3418	19	20	2	0	0	10	280.16	1.2e-05	Acidic fraction
3419	21	20	1	0	0	12	288.16	0.000525	Acidic fraction
3420	20	20	2	0	0	11	292.16	1.2e-05	Acidic fraction
3421	22	20	1	0	0	13	300.16	0.000527	Acidic fraction
3422	21	20	2	0	0	12	304.16	1.9e-05	Acidic fraction
3423	23	20	1	0	0	14	312.16	0.000358	Acidic fraction
3424	22	20	2	0	0	13	316.16	0.001031	Acidic fraction
3425	24	20	1	0	0	15	324.16	0.000145	Acidic fraction
3426	23	20	2	0	0	14	328.16	2.1e-05	Acidic fraction
3427	25	20	1	0	0	16	336.16	0.000127	Acidic fraction
3428	24	20	2	0	0	15	340.16	1.1e-05	Acidic fraction
3429	26	20	1	0	0	17	348.16	0.000132	Acidic fraction
3430	25	20	2	0	0	16	352.16	1.9e-05	Acidic fraction
3431	27	20	1	0	0	18	360.16	6.2e-05	Acidic fraction
3432	26	20	2	0	0	17	364.16	2.4e-05	Acidic fraction
3433	12	22	1	0	0	2	182.176	5e-06	Acidic fraction
3434	11	22	2	0	0	1	186.176	0.001202	Acidic fraction
3435	13	22	1	0	0	3	194.176	1.3e-05	Acidic fraction
3436	12	22	2	0	0	2	198.176	0.000229	Acidic fraction
3437	14	22	1	0	0	4	206.176	0.01023	Acidic fraction
3438	13	22	2	0	0	3	210.176	0.000472	Acidic fraction
3439	15	22	1	0	0	5	218.176	0.000787	Acidic fraction
3440	14	22	2	0	0	4	222.176	0.008679	Acidic fraction
3441	16	22	1	0	0	6	230.176	0.001522	Acidic fraction
3442	15	22	2	0	0	5	234.176	0.001071	Acidic fraction
3443	17	22	1	0	0	7	242.176	0.00093	Acidic fraction
3444	16	22	2	0	0	6	246.176	6e-05	Acidic fraction
3445	18	22	1	0	0	8	254.176	0.001736	Acidic fraction
3446	17	22	2	0	0	7	258.176	2.8e-05	Acidic fraction
3447	19	22	1	0	0	9	266.176	0.001601	Acidic fraction
3448	18	22	2	0	0	8	270.176	2e-05	Acidic fraction
3449	20	22	1	0	0	10	278.176	0.000542	Acidic fraction
3450	19	22	2	0	0	9	282.176	1.1e-05	Acidic fraction
3451	21	22	1	0	0	11	290.176	0.000578	Acidic fraction
3452	20	22	2	0	0	10	294.176	0.000141	Acidic fraction
3453	22	22	1	0	0	12	302.176	0.000518	Acidic fraction
3454	21	22	2	0	0	11	306.176	2.1e-05	Acidic fraction
3455	23	22	1	0	0	13	314.176	0.000543	Acidic fraction
3456	22	22	2	0	0	12	318.176	1.1e-05	Acidic fraction
3457	24	22	1	0	0	14	326.176	0.000298	Acidic fraction
3458	23	22	2	0	0	13	330.176	0.0007	Acidic fraction
3459	25	22	1	0	0	15	338.176	0.000134	Acidic fraction
3460	24	22	2	0	0	14	342.176	6.4e-05	Acidic fraction
3461	26	22	1	0	0	16	350.176	0.000136	Acidic fraction
3462	25	22	2	0	0	15	354.176	9e-06	Acidic fraction
3463	27	22	1	0	0	17	362.176	0.000106	Acidic fraction
3464	26	22	2	0	0	16	366.176	1.4e-05	Acidic fraction
3465	28	22	1	0	0	18	374.176	8.1e-05	Acidic fraction
3466	27	22	2	0	0	17	378.176	3.8e-05	Acidic fraction
3467	29	22	1	0	0	19	386.176	1.6e-05	Acidic fraction
3468	30	22	2	0	0	20	414.176	1e-05	Acidic fraction
3469	12	24	1	0	0	1	184.192	8e-06	Acidic fraction
3470	12	24	2	0	0	1	200.192	0.026027	Acidic fraction
3471	13	24	2	0	0	2	212.192	0.000107	Acidic fraction
3472	15	24	1	0	0	4	220.192	0.010689	Acidic fraction
3473	14	24	2	0	0	3	224.192	0.000178	Acidic fraction
3474	16	24	1	0	0	5	232.192	0.000794	Acidic fraction
3475	15	24	2	0	0	4	236.192	0.000836	Acidic fraction
3476	17	24	1	0	0	6	244.192	0.001408	Acidic fraction
3477	16	24	2	0	0	5	248.192	0.000169	Acidic fraction
3478	18	24	1	0	0	7	256.192	0.001583	Acidic fraction
3479	17	24	2	0	0	6	260.192	3e-05	Acidic fraction
3480	19	24	1	0	0	8	268.192	0.001601	Acidic fraction
3481	18	24	2	0	0	7	272.192	5.5e-05	Acidic fraction
3482	20	24	1	0	0	9	280.192	0.001741	Acidic fraction
3483	19	24	2	0	0	8	284.192	2.6e-05	Acidic fraction
3484	21	24	1	0	0	10	292.192	0.000942	Acidic fraction
3485	20	24	2	0	0	9	296.192	2.7e-05	Acidic fraction
3486	22	24	1	0	0	11	304.192	0.000597	Acidic fraction
3487	21	24	2	0	0	10	308.192	3.8e-05	Acidic fraction
3488	23	24	1	0	0	12	316.192	0.00049	Acidic fraction
3489	22	24	2	0	0	11	320.192	2.4e-05	Acidic fraction
3490	24	24	1	0	0	13	328.192	0.000507	Acidic fraction
3491	23	24	2	0	0	12	332.192	1.6e-05	Acidic fraction
3492	25	24	1	0	0	14	340.192	0.00025	Acidic fraction
3493	24	24	2	0	0	13	344.192	0.000447	Acidic fraction
3494	26	24	1	0	0	15	352.192	0.000121	Acidic fraction
3495	25	24	2	0	0	14	356.192	0.000112	Acidic fraction
3496	27	24	1	0	0	16	364.192	9.3e-05	Acidic fraction
3497	26	24	2	0	0	15	368.192	4.2e-05	Acidic fraction
3498	28	24	1	0	0	17	376.192	0.000114	Acidic fraction
3499	27	24	2	0	0	16	380.192	3.2e-05	Acidic fraction
3500	29	24	1	0	0	18	388.192	6.7e-05	Acidic fraction
3501	28	24	2	0	0	17	392.192	7.1e-05	Acidic fraction
3502	30	24	1	0	0	19	400.192	1.6e-05	Acidic fraction
3503	13	26	1	0	0	1	198.208	8e-06	Acidic fraction
3504	13	26	2	0	0	1	214.208	0.002681	Acidic fraction
3505	14	26	2	0	0	2	226.208	0.001328	Acidic fraction
3506	16	26	1	0	0	4	234.208	0.002649	Acidic fraction
3507	15	26	2	0	0	3	238.208	0.000162	Acidic fraction
3508	17	26	1	0	0	5	246.208	0.000565	Acidic fraction
3509	16	26	2	0	0	4	250.208	0.000268	Acidic fraction
3510	18	26	1	0	0	6	258.208	0.001383	Acidic fraction
3511	17	26	2	0	0	5	262.208	0.000109	Acidic fraction
3512	19	26	1	0	0	7	270.208	0.002212	Acidic fraction
3513	18	26	2	0	0	6	274.208	0.000139	Acidic fraction
3514	20	26	1	0	0	8	282.208	0.001357	Acidic fraction
3515	19	26	2	0	0	7	286.208	5.9e-05	Acidic fraction
3516	21	26	1	0	0	9	294.208	0.001687	Acidic fraction
3517	20	26	2	0	0	8	298.208	4e-05	Acidic fraction
3518	22	26	1	0	0	10	306.208	0.001123	Acidic fraction
3519	21	26	2	0	0	9	310.208	3.3e-05	Acidic fraction
3520	23	26	1	0	0	11	318.208	0.0007	Acidic fraction
3521	22	26	2	0	0	10	322.208	4.3e-05	Acidic fraction
3522	24	26	1	0	0	12	330.208	0.000463	Acidic fraction
3523	23	26	2	0	0	11	334.208	2.6e-05	Acidic fraction
3524	25	26	1	0	0	13	342.208	0.000419	Acidic fraction
3525	24	26	2	0	0	12	346.208	1e-05	Acidic fraction
3526	26	26	1	0	0	14	354.208	0.000274	Acidic fraction
3527	25	26	2	0	0	13	358.208	0.000331	Acidic fraction
3528	27	26	1	0	0	15	366.208	0.000168	Acidic fraction
3529	26	26	2	0	0	14	370.208	0.000164	Acidic fraction
3530	28	26	1	0	0	16	378.208	0.000102	Acidic fraction
3531	27	26	2	0	0	15	382.208	8.7e-05	Acidic fraction
3532	29	26	1	0	0	17	390.208	0.000113	Acidic fraction
3533	30	26	1	0	0	18	402.208	5.8e-05	Acidic fraction
3534	29	26	2	0	0	17	406.208	3.5e-05	Acidic fraction
3535	31	26	1	0	0	19	414.208	1.5e-05	Acidic fraction
3536	30	26	2	0	0	18	418.208	1e-05	Acidic fraction
3537	37	26	2	0	0	25	502.208	0.000165	Acidic fraction
3538	14	28	1	0	0	1	212.224	1.6e-05	Acidic fraction
3539	14	28	2	0	0	1	228.224	0.023406	Acidic fraction
3540	15	28	2	0	0	2	240.224	0.001199	Acidic fraction
3541	17	28	1	0	0	4	248.224	0.000558	Acidic fraction
3542	16	28	2	0	0	3	252.224	0.000519	Acidic fraction
3543	18	28	1	0	0	5	260.224	0.000523	Acidic fraction
3544	17	28	2	0	0	4	264.224	0.00024	Acidic fraction
3545	19	28	1	0	0	6	272.224	0.001505	Acidic fraction
3546	18	28	2	0	0	5	276.224	0.003019	Acidic fraction
3547	20	28	1	0	0	7	284.224	0.00209	Acidic fraction
3548	19	28	2	0	0	6	288.224	7e-05	Acidic fraction
3549	21	28	1	0	0	8	296.224	0.002265	Acidic fraction
3550	20	28	2	0	0	7	300.224	0.002239	Acidic fraction
3551	22	28	1	0	0	9	308.224	0.00143	Acidic fraction
3552	21	28	2	0	0	8	312.224	8.4e-05	Acidic fraction
3553	23	28	1	0	0	10	320.224	0.001132	Acidic fraction
3554	22	28	2	0	0	9	324.224	2.2e-05	Acidic fraction
3555	24	28	1	0	0	11	332.224	0.000775	Acidic fraction
3556	23	28	2	0	0	10	336.224	9e-06	Acidic fraction
3557	25	28	1	0	0	12	344.224	0.000506	Acidic fraction
3558	24	28	2	0	0	11	348.224	2.7e-05	Acidic fraction
3559	26	28	1	0	0	13	356.224	0.000424	Acidic fraction
3560	25	28	2	0	0	12	360.224	1.9e-05	Acidic fraction
3561	27	28	1	0	0	14	368.224	0.000268	Acidic fraction
3562	26	28	2	0	0	13	372.224	0.000185	Acidic fraction
3563	28	28	1	0	0	15	380.224	0.000149	Acidic fraction
3564	27	28	2	0	0	14	384.224	0.000234	Acidic fraction
3565	29	28	1	0	0	16	392.224	0.000111	Acidic fraction
3566	28	28	2	0	0	15	396.224	8.7e-05	Acidic fraction
3567	30	28	1	0	0	17	404.224	6.8e-05	Acidic fraction
3568	29	28	2	0	0	16	408.224	1e-05	Acidic fraction
3569	31	28	1	0	0	18	416.224	4.4e-05	Acidic fraction
3570	30	28	2	0	0	17	420.224	2.5e-05	Acidic fraction
3571	32	28	1	0	0	19	428.224	2e-05	Acidic fraction
3572	33	28	1	0	0	20	440.224	1.3e-05	Acidic fraction
3573	15	30	1	0	0	1	226.24	2.7e-05	Acidic fraction
3574	15	30	2	0	0	1	242.24	0.015657	Acidic fraction
3575	17	30	1	0	0	3	250.24	1e-05	Acidic fraction
3576	16	30	2	0	0	2	254.24	0.016615	Acidic fraction
3577	18	30	1	0	0	4	262.24	0.000425	Acidic fraction
3578	17	30	2	0	0	3	266.24	0.000296	Acidic fraction
3579	19	30	1	0	0	5	274.24	0.00048	Acidic fraction
3580	18	30	2	0	0	4	278.24	0.006943	Acidic fraction
3581	20	30	1	0	0	6	286.24	0.001307	Acidic fraction
3582	19	30	2	0	0	5	290.24	0.000165	Acidic fraction
3583	21	30	1	0	0	7	298.24	0.002175	Acidic fraction
3584	20	30	2	0	0	6	302.24	0.001247	Acidic fraction
3585	22	30	1	0	0	8	310.24	0.002294	Acidic fraction
3586	21	30	2	0	0	7	314.24	0.002022	Acidic fraction
3587	23	30	1	0	0	9	322.24	0.001474	Acidic fraction
3588	22	30	2	0	0	8	326.24	7.1e-05	Acidic fraction
3589	24	30	1	0	0	10	334.24	0.000998	Acidic fraction
3590	23	30	2	0	0	9	338.24	2.3e-05	Acidic fraction
3591	25	30	1	0	0	11	346.24	0.000764	Acidic fraction
3592	24	30	2	0	0	10	350.24	2.2e-05	Acidic fraction
3593	26	30	1	0	0	12	358.24	0.000543	Acidic fraction
3594	25	30	2	0	0	11	362.24	1.1e-05	Acidic fraction
3595	27	30	1	0	0	13	370.24	0.000407	Acidic fraction
3596	26	30	2	0	0	12	374.24	2.9e-05	Acidic fraction
3597	28	30	1	0	0	14	382.24	0.000274	Acidic fraction
3598	27	30	2	0	0	13	386.24	0.000122	Acidic fraction
3599	29	30	1	0	0	15	394.24	0.000179	Acidic fraction
3600	28	30	2	0	0	14	398.24	0.000195	Acidic fraction
3601	30	30	1	0	0	16	406.24	0.000129	Acidic fraction
3602	29	30	2	0	0	15	410.24	6.2e-05	Acidic fraction
3603	31	30	1	0	0	17	418.24	6.8e-05	Acidic fraction
3604	30	30	2	0	0	16	422.24	1.7e-05	Acidic fraction
3605	32	30	1	0	0	18	430.24	2.6e-05	Acidic fraction
3606	31	30	2	0	0	17	434.24	1.5e-05	Acidic fraction
3607	16	32	1	0	0	1	240.256	3.8e-05	Acidic fraction
3608	17	32	1	0	0	2	252.256	1.1e-05	Acidic fraction
3609	16	32	2	0	0	1	256.256	0.139487	Acidic fraction
3610	17	32	2	0	0	2	268.256	0.002397	Acidic fraction
3611	19	32	1	0	0	4	276.256	0.000471	Acidic fraction
3612	18	32	2	0	0	3	280.256	0.085077	Acidic fraction
3613	20	32	1	0	0	5	288.256	0.000501	Acidic fraction
3614	19	32	2	0	0	4	292.256	0.000236	Acidic fraction
3615	21	32	1	0	0	6	300.256	0.001164	Acidic fraction
3616	20	32	2	0	0	5	304.256	0.000653	Acidic fraction
3617	22	32	1	0	0	7	312.256	0.001845	Acidic fraction
3618	21	32	2	0	0	6	316.256	6.7e-05	Acidic fraction
3619	23	32	1	0	0	8	324.256	0.002177	Acidic fraction
3620	22	32	2	0	0	7	328.256	0.000105	Acidic fraction
3621	24	32	1	0	0	9	336.256	0.001434	Acidic fraction
3622	23	32	2	0	0	8	340.256	5e-05	Acidic fraction
3623	25	32	1	0	0	10	348.256	0.000908	Acidic fraction
3624	24	32	2	0	0	9	352.256	1.7e-05	Acidic fraction
3625	26	32	1	0	0	11	360.256	0.00072	Acidic fraction
3626	25	32	2	0	0	10	364.256	1.2e-05	Acidic fraction
3627	27	32	1	0	0	12	372.256	0.000552	Acidic fraction
3628	26	32	2	0	0	11	376.256	4.2e-05	Acidic fraction
3629	28	32	1	0	0	13	384.256	0.000387	Acidic fraction
3630	27	32	2	0	0	12	388.256	1.7e-05	Acidic fraction
3631	29	32	1	0	0	14	396.256	0.000232	Acidic fraction
3632	28	32	2	0	0	13	400.256	7.3e-05	Acidic fraction
3633	30	32	1	0	0	15	408.256	0.000145	Acidic fraction
3634	29	32	2	0	0	14	412.256	0.000152	Acidic fraction
3635	31	32	1	0	0	16	420.256	0.000105	Acidic fraction
3636	30	32	2	0	0	15	424.256	6.5e-05	Acidic fraction
3637	32	32	1	0	0	17	432.256	6.2e-05	Acidic fraction
3638	31	32	2	0	0	16	436.256	1.4e-05	Acidic fraction
3639	33	32	1	0	0	18	444.256	2.5e-05	Acidic fraction
3640	32	32	2	0	0	17	448.256	2e-05	Acidic fraction
3641	17	34	1	0	0	1	254.272	2.5e-05	Acidic fraction
3642	17	34	2	0	0	1	270.272	0.007776	Acidic fraction
3643	19	34	1	0	0	3	278.272	8e-06	Acidic fraction
3644	18	34	2	0	0	2	282.272	0.089499	Acidic fraction
3645	20	34	1	0	0	4	290.272	0.000516	Acidic fraction
3646	19	34	2	0	0	3	294.272	0.000216	Acidic fraction
3647	21	34	1	0	0	5	302.272	0.000441	Acidic fraction
3648	20	34	2	0	0	4	306.272	0.000292	Acidic fraction
3649	22	34	1	0	0	6	314.272	0.001031	Acidic fraction
3650	21	34	2	0	0	5	318.272	0.000137	Acidic fraction
3651	23	34	1	0	0	7	326.272	0.001584	Acidic fraction
3652	22	34	2	0	0	6	330.272	8.4e-05	Acidic fraction
3653	24	34	1	0	0	8	338.272	0.001993	Acidic fraction
3654	23	34	2	0	0	7	342.272	6.6e-05	Acidic fraction
3655	25	34	1	0	0	9	350.272	0.001249	Acidic fraction
3656	24	34	2	0	0	8	354.272	2.1e-05	Acidic fraction
3657	26	34	1	0	0	10	362.272	0.000832	Acidic fraction
3658	27	34	1	0	0	11	374.272	0.000688	Acidic fraction
3659	26	34	2	0	0	10	378.272	1.7e-05	Acidic fraction
3660	28	34	1	0	0	12	386.272	0.000478	Acidic fraction
3661	27	34	2	0	0	11	390.272	1.8e-05	Acidic fraction
3662	29	34	1	0	0	13	398.272	0.000335	Acidic fraction
3663	28	34	2	0	0	12	402.272	3.6e-05	Acidic fraction
3664	30	34	1	0	0	14	410.272	0.000217	Acidic fraction
3665	29	34	2	0	0	13	414.272	7.7e-05	Acidic fraction
3666	31	34	1	0	0	15	422.272	0.000124	Acidic fraction
3667	30	34	2	0	0	14	426.272	9.6e-05	Acidic fraction
3668	32	34	1	0	0	16	434.272	8.9e-05	Acidic fraction
3669	31	34	2	0	0	15	438.272	6.7e-05	Acidic fraction
3670	33	34	1	0	0	17	446.272	6.8e-05	Acidic fraction
3671	32	34	2	0	0	16	450.272	1.5e-05	Acidic fraction
3672	34	34	1	0	0	18	458.272	2.4e-05	Acidic fraction
3673	35	34	1	0	0	19	470.272	1.2e-05	Acidic fraction
3674	18	36	1	0	0	1	268.288	3.1e-05	Acidic fraction
3675	18	36	2	0	0	1	284.288	0.048782	Acidic fraction
3676	19	36	2	0	0	2	296.288	0.000303	Acidic fraction
3677	21	36	1	0	0	4	304.288	0.000459	Acidic fraction
3678	20	36	2	0	0	3	308.288	0.000458	Acidic fraction
3679	22	36	1	0	0	5	316.288	0.00057	Acidic fraction
3680	21	36	2	0	0	4	320.288	0.000204	Acidic fraction
3681	23	36	1	0	0	6	328.288	0.000854	Acidic fraction
3682	22	36	2	0	0	5	332.288	0.000179	Acidic fraction
3683	24	36	1	0	0	7	340.288	0.001353	Acidic fraction
3684	23	36	2	0	0	6	344.288	7e-05	Acidic fraction
3685	25	36	1	0	0	8	352.288	0.001727	Acidic fraction
3686	24	36	2	0	0	7	356.288	5.8e-05	Acidic fraction
3687	26	36	1	0	0	9	364.288	0.001175	Acidic fraction
3688	25	36	2	0	0	8	368.288	4.2e-05	Acidic fraction
3689	27	36	1	0	0	10	376.288	0.000863	Acidic fraction
3690	28	36	1	0	0	11	388.288	0.000628	Acidic fraction
3691	27	36	2	0	0	10	392.288	1.1e-05	Acidic fraction
3692	29	36	1	0	0	12	400.288	0.000419	Acidic fraction
3693	28	36	2	0	0	11	404.288	0.000437	Acidic fraction
3694	30	36	1	0	0	13	412.288	0.000317	Acidic fraction
3695	29	36	2	0	0	12	416.288	1.5e-05	Acidic fraction
3696	31	36	1	0	0	14	424.288	0.000188	Acidic fraction
3697	30	36	2	0	0	13	428.288	6.4e-05	Acidic fraction
3698	32	36	1	0	0	15	436.288	0.000115	Acidic fraction
3699	31	36	2	0	0	14	440.288	7.1e-05	Acidic fraction
3700	33	36	1	0	0	16	448.288	8.6e-05	Acidic fraction
3701	32	36	2	0	0	15	452.288	3.3e-05	Acidic fraction
3702	34	36	1	0	0	17	460.288	4.6e-05	Acidic fraction
3703	33	36	2	0	0	16	464.288	1.8e-05	Acidic fraction
3704	18	38	2	0	0	0	286.304	1.6e-05	Acidic fraction
3705	19	38	2	0	0	1	298.304	0.00066	Acidic fraction
3706	20	38	2	0	0	2	310.304	0.001102	Acidic fraction
3707	22	38	1	0	0	4	318.304	0.000501	Acidic fraction
3708	21	38	2	0	0	3	322.304	0.000244	Acidic fraction
3709	23	38	1	0	0	5	330.304	0.000393	Acidic fraction
3710	22	38	2	0	0	4	334.304	0.000196	Acidic fraction
3711	24	38	1	0	0	6	342.304	0.000826	Acidic fraction
3712	23	38	2	0	0	5	346.304	0.000139	Acidic fraction
3713	25	38	1	0	0	7	354.304	0.001172	Acidic fraction
3714	24	38	2	0	0	6	358.304	0.000118	Acidic fraction
3715	26	38	1	0	0	8	366.304	0.001328	Acidic fraction
3716	25	38	2	0	0	7	370.304	4.4e-05	Acidic fraction
3717	27	38	1	0	0	9	378.304	0.001113	Acidic fraction
3718	26	38	2	0	0	8	382.304	4.5e-05	Acidic fraction
3719	28	38	1	0	0	10	390.304	0.000701	Acidic fraction
3720	27	38	2	0	0	9	394.304	2.8e-05	Acidic fraction
3721	29	38	1	0	0	11	402.304	0.000529	Acidic fraction
3722	28	38	2	0	0	10	406.304	2.8e-05	Acidic fraction
3723	30	38	1	0	0	12	414.304	0.000368	Acidic fraction
3724	29	38	2	0	0	11	418.304	5e-05	Acidic fraction
3725	31	38	1	0	0	13	426.304	0.000278	Acidic fraction
3726	32	38	1	0	0	14	438.304	0.000196	Acidic fraction
3727	31	38	2	0	0	13	442.304	2.7e-05	Acidic fraction
3728	33	38	1	0	0	15	450.304	0.000128	Acidic fraction
3729	32	38	2	0	0	14	454.304	3.5e-05	Acidic fraction
3730	34	38	1	0	0	16	462.304	7.4e-05	Acidic fraction
3731	33	38	2	0	0	15	466.304	1.3e-05	Acidic fraction
3732	35	38	1	0	0	17	474.304	2.8e-05	Acidic fraction
3733	20	40	1	0	0	1	296.32	8e-06	Acidic fraction
3734	20	40	2	0	0	1	312.32	0.002277	Acidic fraction
3735	21	40	2	0	0	2	324.32	0.000185	Acidic fraction
3736	23	40	1	0	0	4	332.32	0.000524	Acidic fraction
3737	22	40	2	0	0	3	336.32	0.000247	Acidic fraction
3738	24	40	1	0	0	5	344.32	0.000343	Acidic fraction
3739	23	40	2	0	0	4	348.32	0.000181	Acidic fraction
3740	25	40	1	0	0	6	356.32	0.00073	Acidic fraction
3741	24	40	2	0	0	5	360.32	0.000135	Acidic fraction
3742	26	40	1	0	0	7	368.32	0.000959	Acidic fraction
3743	25	40	2	0	0	6	372.32	9.2e-05	Acidic fraction
3744	27	40	1	0	0	8	380.32	0.001262	Acidic fraction
3745	26	40	2	0	0	7	384.32	6.6e-05	Acidic fraction
3746	28	40	1	0	0	9	392.32	0.000953	Acidic fraction
3747	27	40	2	0	0	8	396.32	0.000171	Acidic fraction
3748	29	40	1	0	0	10	404.32	0.000635	Acidic fraction
3749	28	40	2	0	0	9	408.32	2.4e-05	Acidic fraction
3750	30	40	1	0	0	11	416.32	0.000414	Acidic fraction
3751	31	40	1	0	0	12	428.32	0.000324	Acidic fraction
3752	30	40	2	0	0	11	432.32	6.8e-05	Acidic fraction
3753	32	40	1	0	0	13	440.32	0.000255	Acidic fraction
3754	31	40	2	0	0	12	444.32	1.2e-05	Acidic fraction
3755	33	40	1	0	0	14	452.32	0.000164	Acidic fraction
3756	32	40	2	0	0	13	456.32	4e-05	Acidic fraction
3757	34	40	1	0	0	15	464.32	0.000113	Acidic fraction
3758	33	40	2	0	0	14	468.32	1.9e-05	Acidic fraction
3759	35	40	1	0	0	16	476.32	4.7e-05	Acidic fraction
3760	34	40	2	0	0	15	480.32	1.8e-05	Acidic fraction
3761	36	40	1	0	0	17	488.32	2.5e-05	Acidic fraction
3762	20	42	2	0	0	0	314.336	2.2e-05	Acidic fraction
3763	21	42	2	0	0	1	326.336	0.000479	Acidic fraction
3764	22	42	2	0	0	2	338.336	0.000297	Acidic fraction
3765	24	42	1	0	0	4	346.336	0.000462	Acidic fraction
3766	23	42	2	0	0	3	350.336	0.000194	Acidic fraction
3767	25	42	1	0	0	5	358.336	0.000373	Acidic fraction
3768	24	42	2	0	0	4	362.336	0.00016	Acidic fraction
3769	26	42	1	0	0	6	370.336	0.000738	Acidic fraction
3770	25	42	2	0	0	5	374.336	0.000133	Acidic fraction
3771	27	42	1	0	0	7	382.336	0.000901	Acidic fraction
3772	26	42	2	0	0	6	386.336	8.9e-05	Acidic fraction
3773	28	42	1	0	0	8	394.336	0.001001	Acidic fraction
3774	27	42	2	0	0	7	398.336	7.8e-05	Acidic fraction
3775	29	42	1	0	0	9	406.336	0.000789	Acidic fraction
3776	28	42	2	0	0	8	410.336	0.000977	Acidic fraction
3777	30	42	1	0	0	10	418.336	0.00051	Acidic fraction
3778	29	42	2	0	0	9	422.336	3.4e-05	Acidic fraction
3779	31	42	1	0	0	11	430.336	0.000412	Acidic fraction
3780	30	42	2	0	0	10	434.336	2.7e-05	Acidic fraction
3781	32	42	1	0	0	12	442.336	0.000294	Acidic fraction
3782	31	42	2	0	0	11	446.336	1.6e-05	Acidic fraction
3783	33	42	1	0	0	13	454.336	0.000196	Acidic fraction
3784	32	42	2	0	0	12	458.336	5.1e-05	Acidic fraction
3785	34	42	1	0	0	14	466.336	0.00012	Acidic fraction
3786	33	42	2	0	0	13	470.336	2.5e-05	Acidic fraction
3787	35	42	1	0	0	15	478.336	8.4e-05	Acidic fraction
3788	36	42	1	0	0	16	490.336	4.2e-05	Acidic fraction
3789	35	42	2	0	0	15	494.336	3e-05	Acidic fraction
3790	37	42	1	0	0	17	502.336	1.4e-05	Acidic fraction
3791	45	42	1	0	0	25	598.336	6.2e-05	Acidic fraction
3792	22	44	2	0	0	1	340.352	0.001401	Acidic fraction
3793	23	44	2	0	0	2	352.352	0.000195	Acidic fraction
3794	25	44	1	0	0	4	360.352	0.000404	Acidic fraction
3795	24	44	2	0	0	3	364.352	0.000218	Acidic fraction
3796	26	44	1	0	0	5	372.352	0.000345	Acidic fraction
3797	25	44	2	0	0	4	376.352	0.00019	Acidic fraction
3798	27	44	1	0	0	6	384.352	0.000917	Acidic fraction
3799	26	44	2	0	0	5	388.352	0.000112	Acidic fraction
3800	28	44	1	0	0	7	396.352	0.000706	Acidic fraction
3801	27	44	2	0	0	6	400.352	0.000191	Acidic fraction
3802	29	44	1	0	0	8	408.352	0.000848	Acidic fraction
3803	28	44	2	0	0	7	412.352	5.8e-05	Acidic fraction
3804	30	44	1	0	0	9	420.352	0.000629	Acidic fraction
3805	29	44	2	0	0	8	424.352	0.000137	Acidic fraction
3806	31	44	1	0	0	10	432.352	0.000495	Acidic fraction
3807	30	44	2	0	0	9	436.352	1.8e-05	Acidic fraction
3808	32	44	1	0	0	11	444.352	0.000366	Acidic fraction
3809	33	44	1	0	0	12	456.352	0.000233	Acidic fraction
3810	32	44	2	0	0	11	460.352	0.002955	Acidic fraction
3811	34	44	1	0	0	13	468.352	0.000144	Acidic fraction
3812	35	44	1	0	0	14	480.352	0.000127	Acidic fraction
3813	34	44	2	0	0	13	484.352	2.5e-05	Acidic fraction
3814	36	44	1	0	0	15	492.352	8.3e-05	Acidic fraction
3815	37	44	1	0	0	16	504.352	4.3e-05	Acidic fraction
3816	36	44	2	0	0	15	508.352	1.4e-05	Acidic fraction
3817	38	44	1	0	0	17	516.352	1.9e-05	Acidic fraction
3818	47	44	1	0	0	26	624.352	2.4e-05	Acidic fraction
3819	23	46	2	0	0	1	354.368	0.000762	Acidic fraction
3820	24	46	2	0	0	2	366.368	0.000266	Acidic fraction
3821	26	46	1	0	0	4	374.368	0.000451	Acidic fraction
3822	25	46	2	0	0	3	378.368	0.000202	Acidic fraction
3823	27	46	1	0	0	5	386.368	0.000342	Acidic fraction
3824	26	46	2	0	0	4	390.368	0.000188	Acidic fraction
3825	28	46	1	0	0	6	398.368	0.000523	Acidic fraction
3826	27	46	2	0	0	5	402.368	0.000145	Acidic fraction
3827	29	46	1	0	0	7	410.368	0.000619	Acidic fraction
3828	28	46	2	0	0	6	414.368	9.4e-05	Acidic fraction
3829	30	46	1	0	0	8	422.368	0.000701	Acidic fraction
3830	29	46	2	0	0	7	426.368	7.6e-05	Acidic fraction
3831	31	46	1	0	0	9	434.368	0.000593	Acidic fraction
3832	30	46	2	0	0	8	438.368	1.2e-05	Acidic fraction
3833	32	46	1	0	0	10	446.368	0.000389	Acidic fraction
3834	33	46	1	0	0	11	458.368	0.000315	Acidic fraction
3835	32	46	2	0	0	10	462.368	2.7e-05	Acidic fraction
3836	34	46	1	0	0	12	470.368	0.000239	Acidic fraction
3837	35	46	1	0	0	13	482.368	0.000145	Acidic fraction
3838	36	46	1	0	0	14	494.368	0.000101	Acidic fraction
3839	35	46	2	0	0	13	498.368	1.8e-05	Acidic fraction
3840	37	46	1	0	0	15	506.368	8.1e-05	Acidic fraction
3841	38	46	1	0	0	16	518.368	1.4e-05	Acidic fraction
3842	39	46	1	0	0	17	530.368	2.2e-05	Acidic fraction
3843	48	46	1	0	0	26	638.368	2.5e-05	Acidic fraction
3844	24	48	2	0	0	1	368.384	0.003253	Acidic fraction
3845	25	48	2	0	0	2	380.384	0.000201	Acidic fraction
3846	27	48	1	0	0	4	388.384	0.000433	Acidic fraction
3847	26	48	2	0	0	3	392.384	0.000204	Acidic fraction
3848	28	48	1	0	0	5	400.384	0.000291	Acidic fraction
3849	27	48	2	0	0	4	404.384	0.000169	Acidic fraction
3850	29	48	1	0	0	6	412.384	0.000501	Acidic fraction
3851	28	48	2	0	0	5	416.384	0.000125	Acidic fraction
3852	30	48	1	0	0	7	424.384	0.000516	Acidic fraction
3853	29	48	2	0	0	6	428.384	0.000164	Acidic fraction
3854	31	48	1	0	0	8	436.384	0.000744	Acidic fraction
3855	30	48	2	0	0	7	440.384	6.7e-05	Acidic fraction
3856	32	48	1	0	0	9	448.384	0.000518	Acidic fraction
3857	31	48	2	0	0	8	452.384	1.9e-05	Acidic fraction
3858	33	48	1	0	0	10	460.384	0.00033	Acidic fraction
3859	34	48	1	0	0	11	472.384	0.000277	Acidic fraction
3860	35	48	1	0	0	12	484.384	0.000187	Acidic fraction
3861	36	48	1	0	0	13	496.384	0.000132	Acidic fraction
3862	37	48	1	0	0	14	508.384	6.7e-05	Acidic fraction
3863	38	48	1	0	0	15	520.384	4.9e-05	Acidic fraction
3864	37	48	2	0	0	14	524.384	2.5e-05	Acidic fraction
3865	38	48	2	0	0	15	536.384	1.4e-05	Acidic fraction
3866	40	48	1	0	0	17	544.384	1.9e-05	Acidic fraction
3867	25	50	2	0	0	1	382.4	0.001176	Acidic fraction
3868	26	50	2	0	0	2	394.4	0.000252	Acidic fraction
3869	28	50	1	0	0	4	402.4	0.000411	Acidic fraction
3870	27	50	2	0	0	3	406.4	0.000178	Acidic fraction
3871	29	50	1	0	0	5	414.4	0.000272	Acidic fraction
3872	28	50	2	0	0	4	418.4	0.000129	Acidic fraction
3873	30	50	1	0	0	6	426.4	0.000437	Acidic fraction
3874	29	50	2	0	0	5	430.4	0.000184	Acidic fraction
3875	31	50	1	0	0	7	438.4	0.000516	Acidic fraction
3876	30	50	2	0	0	6	442.4	0.000197	Acidic fraction
3877	32	50	1	0	0	8	450.4	0.000549	Acidic fraction
3878	31	50	2	0	0	7	454.4	2.4e-05	Acidic fraction
3879	33	50	1	0	0	9	462.4	0.00044	Acidic fraction
3880	32	50	2	0	0	8	466.4	2.1e-05	Acidic fraction
3881	34	50	1	0	0	10	474.4	0.000309	Acidic fraction
3882	33	50	2	0	0	9	478.4	1.3e-05	Acidic fraction
3883	35	50	1	0	0	11	486.4	0.000256	Acidic fraction
3884	36	50	1	0	0	12	498.4	0.000169	Acidic fraction
3885	37	50	1	0	0	13	510.4	9.4e-05	Acidic fraction
3886	38	50	1	0	0	14	522.4	8.2e-05	Acidic fraction
3887	37	50	2	0	0	13	526.4	2.1e-05	Acidic fraction
3888	39	50	1	0	0	15	534.4	3.2e-05	Acidic fraction
3889	40	50	1	0	0	16	546.4	1.8e-05	Acidic fraction
3890	26	52	2	0	0	1	396.416	0.001215	Acidic fraction
3891	27	52	2	0	0	2	408.416	0.000215	Acidic fraction
3892	29	52	1	0	0	4	416.416	0.000369	Acidic fraction
3893	28	52	2	0	0	3	420.416	0.000175	Acidic fraction
3894	30	52	1	0	0	5	428.416	0.00025	Acidic fraction
3895	29	52	2	0	0	4	432.416	0.00015	Acidic fraction
3896	31	52	1	0	0	6	440.416	0.000426	Acidic fraction
3897	30	52	2	0	0	5	444.416	0.000172	Acidic fraction
3898	32	52	1	0	0	7	452.416	0.000439	Acidic fraction
3899	31	52	2	0	0	6	456.416	0.000122	Acidic fraction
3900	33	52	1	0	0	8	464.416	0.000513	Acidic fraction
3901	32	52	2	0	0	7	468.416	1.4e-05	Acidic fraction
3902	34	52	1	0	0	9	476.416	0.00035	Acidic fraction
3903	33	52	2	0	0	8	480.416	1.8e-05	Acidic fraction
3904	35	52	1	0	0	10	488.416	0.000277	Acidic fraction
3905	36	52	1	0	0	11	500.416	0.000191	Acidic fraction
3906	37	52	1	0	0	12	512.416	0.000145	Acidic fraction
3907	36	52	2	0	0	11	516.416	3.2e-05	Acidic fraction
3908	38	52	1	0	0	13	524.416	9.6e-05	Acidic fraction
3909	39	52	1	0	0	14	536.416	6.1e-05	Acidic fraction
3910	38	52	2	0	0	13	540.416	1.3e-05	Acidic fraction
3911	40	52	1	0	0	15	548.416	4.1e-05	Acidic fraction
3912	27	54	2	0	0	1	410.432	0.000308	Acidic fraction
3913	28	54	2	0	0	2	422.432	0.000211	Acidic fraction
3914	30	54	1	0	0	4	430.432	0.000339	Acidic fraction
3915	29	54	2	0	0	3	434.432	0.000188	Acidic fraction
3916	31	54	1	0	0	5	442.432	0.000218	Acidic fraction
3917	30	54	2	0	0	4	446.432	0.000151	Acidic fraction
3918	32	54	1	0	0	6	454.432	0.000342	Acidic fraction
3919	31	54	2	0	0	5	458.432	0.00014	Acidic fraction
3920	33	54	1	0	0	7	466.432	0.000349	Acidic fraction
3921	32	54	2	0	0	6	470.432	6.7e-05	Acidic fraction
3922	34	54	1	0	0	8	478.432	0.000423	Acidic fraction
3923	33	54	2	0	0	7	482.432	2.6e-05	Acidic fraction
3924	35	54	1	0	0	9	490.432	0.000333	Acidic fraction
3925	36	54	1	0	0	10	502.432	0.000242	Acidic fraction
3926	37	54	1	0	0	11	514.432	0.000178	Acidic fraction
3927	38	54	1	0	0	12	526.432	0.000137	Acidic fraction
3928	39	54	1	0	0	13	538.432	7.1e-05	Acidic fraction
3929	40	54	1	0	0	14	550.432	3.6e-05	Acidic fraction
3930	41	54	1	0	0	15	562.432	1.5e-05	Acidic fraction
3931	42	54	1	0	0	16	574.432	1.5e-05	Acidic fraction
3932	28	56	2	0	0	1	424.448	0.00039	Acidic fraction
3933	29	56	2	0	0	2	436.448	0.000168	Acidic fraction
3934	31	56	1	0	0	4	444.448	0.000321	Acidic fraction
3935	30	56	2	0	0	3	448.448	0.000187	Acidic fraction
3936	32	56	1	0	0	5	456.448	0.000202	Acidic fraction
3937	31	56	2	0	0	4	460.448	0.000138	Acidic fraction
3938	33	56	1	0	0	6	468.448	0.000312	Acidic fraction
3939	32	56	2	0	0	5	472.448	0.000176	Acidic fraction
3940	34	56	1	0	0	7	480.448	0.000329	Acidic fraction
3941	33	56	2	0	0	6	484.448	8.3e-05	Acidic fraction
3942	35	56	1	0	0	8	492.448	0.000397	Acidic fraction
3943	36	56	1	0	0	9	504.448	0.000286	Acidic fraction
3944	35	56	2	0	0	8	508.448	1.9e-05	Acidic fraction
3945	37	56	1	0	0	10	516.448	0.000192	Acidic fraction
3946	38	56	1	0	0	11	528.448	0.000179	Acidic fraction
3947	39	56	1	0	0	12	540.448	0.000118	Acidic fraction
3948	40	56	1	0	0	13	552.448	4.6e-05	Acidic fraction
3949	41	56	1	0	0	14	564.448	2.5e-05	Acidic fraction
3950	42	56	1	0	0	15	576.448	1.4e-05	Acidic fraction
3951	29	58	2	0	0	1	438.464	0.000167	Acidic fraction
3952	30	58	2	0	0	2	450.464	0.00021	Acidic fraction
3953	32	58	1	0	0	4	458.464	0.00024	Acidic fraction
3954	31	58	2	0	0	3	462.464	0.000129	Acidic fraction
3955	33	58	1	0	0	5	470.464	0.000192	Acidic fraction
3956	32	58	2	0	0	4	474.464	9.3e-05	Acidic fraction
3957	34	58	1	0	0	6	482.464	0.000285	Acidic fraction
3958	33	58	2	0	0	5	486.464	9.4e-05	Acidic fraction
3959	35	58	1	0	0	7	494.464	0.000263	Acidic fraction
3960	34	58	2	0	0	6	498.464	6.5e-05	Acidic fraction
3961	36	58	1	0	0	8	506.464	0.000312	Acidic fraction
3962	35	58	2	0	0	7	510.464	2.6e-05	Acidic fraction
3963	37	58	1	0	0	9	518.464	0.000253	Acidic fraction
3964	38	58	1	0	0	10	530.464	0.000221	Acidic fraction
3965	39	58	1	0	0	11	542.464	0.000132	Acidic fraction
3966	40	58	1	0	0	12	554.464	9.2e-05	Acidic fraction
3967	41	58	1	0	0	13	566.464	2.9e-05	Acidic fraction
3968	42	58	1	0	0	14	578.464	2.4e-05	Acidic fraction
3969	30	60	2	0	0	1	452.48	0.000157	Acidic fraction
3970	31	60	2	0	0	2	464.48	0.000158	Acidic fraction
3971	33	60	1	0	0	4	472.48	0.000236	Acidic fraction
3972	32	60	2	0	0	3	476.48	0.00015	Acidic fraction
3973	34	60	1	0	0	5	484.48	0.000159	Acidic fraction
3974	33	60	2	0	0	4	488.48	7.8e-05	Acidic fraction
3975	35	60	1	0	0	6	496.48	0.00025	Acidic fraction
3976	34	60	2	0	0	5	500.48	9.9e-05	Acidic fraction
3977	36	60	1	0	0	7	508.48	0.000274	Acidic fraction
3978	35	60	2	0	0	6	512.48	2.7e-05	Acidic fraction
3979	37	60	1	0	0	8	520.48	0.000322	Acidic fraction
3980	38	60	1	0	0	9	532.48	0.000243	Acidic fraction
3981	39	60	1	0	0	10	544.48	0.000177	Acidic fraction
3982	40	60	1	0	0	11	556.48	9.8e-05	Acidic fraction
3983	41	60	1	0	0	12	568.48	6.7e-05	Acidic fraction
3984	42	60	1	0	0	13	580.48	4.1e-05	Acidic fraction
3985	31	62	2	0	0	1	466.496	0.000102	Acidic fraction
3986	32	62	2	0	0	2	478.496	0.000135	Acidic fraction
3987	34	62	1	0	0	4	486.496	0.000208	Acidic fraction
3988	33	62	2	0	0	3	490.496	8.8e-05	Acidic fraction
3989	35	62	1	0	0	5	498.496	0.000128	Acidic fraction
3990	34	62	2	0	0	4	502.496	8.6e-05	Acidic fraction
3991	36	62	1	0	0	6	510.496	0.00024	Acidic fraction
3992	35	62	2	0	0	5	514.496	4e-05	Acidic fraction
3993	37	62	1	0	0	7	522.496	0.000226	Acidic fraction
3994	36	62	2	0	0	6	526.496	3.7e-05	Acidic fraction
3995	38	62	1	0	0	8	534.496	0.000309	Acidic fraction
3996	39	62	1	0	0	9	546.496	0.0002	Acidic fraction
3997	40	62	1	0	0	10	558.496	0.000126	Acidic fraction
3998	41	62	1	0	0	11	570.496	0.000104	Acidic fraction
3999	42	62	1	0	0	12	582.496	6.9e-05	Acidic fraction
4000	43	62	1	0	0	13	594.496	3.3e-05	Acidic fraction
4001	32	64	2	0	0	1	480.512	6.2e-05	Acidic fraction
4002	33	64	2	0	0	2	492.512	0.000128	Acidic fraction
4003	35	64	1	0	0	4	500.512	0.000174	Acidic fraction
4004	34	64	2	0	0	3	504.512	8.8e-05	Acidic fraction
4005	36	64	1	0	0	5	512.512	0.000133	Acidic fraction
4006	35	64	2	0	0	4	516.512	2.7e-05	Acidic fraction
4007	37	64	1	0	0	6	524.512	0.000164	Acidic fraction
4008	36	64	2	0	0	5	528.512	4.1e-05	Acidic fraction
4009	38	64	1	0	0	7	536.512	0.00022	Acidic fraction
4010	37	64	2	0	0	6	540.512	1.8e-05	Acidic fraction
4011	39	64	1	0	0	8	548.512	0.000225	Acidic fraction
4012	40	64	1	0	0	9	560.512	0.000137	Acidic fraction
4013	41	64	1	0	0	10	572.512	9e-05	Acidic fraction
4014	42	64	1	0	0	11	584.512	6.6e-05	Acidic fraction
4015	43	64	1	0	0	12	596.512	5.4e-05	Acidic fraction
4016	44	64	1	0	0	13	608.512	3.2e-05	Acidic fraction
4017	33	66	2	0	0	1	494.528	4.7e-05	Acidic fraction
4018	34	66	2	0	0	2	506.528	7.6e-05	Acidic fraction
4019	36	66	1	0	0	4	514.528	0.000147	Acidic fraction
4020	35	66	2	0	0	3	518.528	6.9e-05	Acidic fraction
4021	37	66	1	0	0	5	526.528	0.000106	Acidic fraction
4022	36	66	2	0	0	4	530.528	3e-05	Acidic fraction
4023	38	66	1	0	0	6	538.528	0.000149	Acidic fraction
4024	37	66	2	0	0	5	542.528	4.8e-05	Acidic fraction
4025	39	66	1	0	0	7	550.528	0.000162	Acidic fraction
4026	38	66	2	0	0	6	554.528	1.8e-05	Acidic fraction
4027	40	66	1	0	0	8	562.528	0.000155	Acidic fraction
4028	41	66	1	0	0	9	574.528	0.000153	Acidic fraction
4029	42	66	1	0	0	10	586.528	0.000114	Acidic fraction
4030	43	66	1	0	0	11	598.528	4.6e-05	Acidic fraction
4031	34	68	2	0	0	1	508.544	1.9e-05	Acidic fraction
4032	35	68	2	0	0	2	520.544	3.4e-05	Acidic fraction
4033	37	68	1	0	0	4	528.544	0.000123	Acidic fraction
4034	36	68	2	0	0	3	532.544	3.8e-05	Acidic fraction
4035	38	68	1	0	0	5	540.544	5.4e-05	Acidic fraction
4036	37	68	2	0	0	4	544.544	5.1e-05	Acidic fraction
4037	39	68	1	0	0	6	552.544	0.00016	Acidic fraction
4038	40	68	1	0	0	7	564.544	0.000131	Acidic fraction
4039	39	68	2	0	0	6	568.544	1.5e-05	Acidic fraction
4040	41	68	1	0	0	8	576.544	0.000171	Acidic fraction
4041	40	68	2	0	0	7	580.544	1.5e-05	Acidic fraction
4042	42	68	1	0	0	9	588.544	9e-05	Acidic fraction
4043	43	68	1	0	0	10	600.544	7e-05	Acidic fraction
4044	44	68	1	0	0	11	612.544	4.5e-05	Acidic fraction
4045	35	70	2	0	0	1	522.56	2.8e-05	Acidic fraction
4046	36	70	2	0	0	2	534.56	4.7e-05	Acidic fraction
4047	38	70	1	0	0	4	542.56	7.5e-05	Acidic fraction
4048	37	70	2	0	0	3	546.56	2.7e-05	Acidic fraction
4049	39	70	1	0	0	5	554.56	5.3e-05	Acidic fraction
4050	40	70	1	0	0	6	566.56	0.000131	Acidic fraction
4051	41	70	1	0	0	7	578.56	0.000111	Acidic fraction
4052	42	70	1	0	0	8	590.56	0.0001	Acidic fraction
4053	43	70	1	0	0	9	602.56	8.7e-05	Acidic fraction
4054	44	70	1	0	0	10	614.56	4e-05	Acidic fraction
4055	45	70	1	0	0	11	626.56	1.6e-05	Acidic fraction
4056	36	72	2	0	0	1	536.576	1.6e-05	Acidic fraction
4057	37	72	2	0	0	2	548.576	3.3e-05	Acidic fraction
4058	39	72	1	0	0	4	556.576	4.4e-05	Acidic fraction
4059	38	72	2	0	0	3	560.576	1.8e-05	Acidic fraction
4060	40	72	1	0	0	5	568.576	3.2e-05	Acidic fraction
4061	41	72	1	0	0	6	580.576	9.2e-05	Acidic fraction
4062	42	72	1	0	0	7	592.576	6.4e-05	Acidic fraction
4063	43	72	1	0	0	8	604.576	6.8e-05	Acidic fraction
4064	44	72	1	0	0	9	616.576	3.5e-05	Acidic fraction
4065	45	72	1	0	0	10	628.576	3.4e-05	Acidic fraction
4066	40	74	1	0	0	4	570.592	2e-05	Acidic fraction
4067	41	74	1	0	0	5	582.592	5.4e-05	Acidic fraction
4068	42	74	1	0	0	6	594.592	5.8e-05	Acidic fraction
4069	43	74	1	0	0	7	606.592	9.6e-05	Acidic fraction
4070	44	74	1	0	0	8	618.592	7e-05	Acidic fraction
4071	45	74	1	0	0	9	630.592	5.4e-05	Acidic fraction
4072	46	74	1	0	0	10	642.592	3.3e-05	Acidic fraction
4073	47	74	1	0	0	11	654.592	1.7e-05	Acidic fraction
4074	42	76	1	0	0	5	596.608	1.9e-05	Acidic fraction
4075	43	76	1	0	0	6	608.608	6.3e-05	Acidic fraction
4076	44	76	1	0	0	7	620.608	5.3e-05	Acidic fraction
4077	45	76	1	0	0	8	632.608	7.4e-05	Acidic fraction
4078	46	76	1	0	0	9	644.608	6e-05	Acidic fraction
4079	47	76	1	0	0	10	656.608	2.6e-05	Acidic fraction
4080	42	78	1	0	0	4	598.624	2.5e-05	Acidic fraction
4081	43	78	1	0	0	5	610.624	2.7e-05	Acidic fraction
4082	44	78	1	0	0	6	622.624	3e-05	Acidic fraction
4083	45	78	1	0	0	7	634.624	3e-05	Acidic fraction
4084	46	78	1	0	0	8	646.624	4.5e-05	Acidic fraction
4085	47	78	1	0	0	9	658.624	3.5e-05	Acidic fraction
4086	48	78	1	0	0	10	670.624	3.1e-05	Acidic fraction
4087	45	80	1	0	0	6	636.64	1.8e-05	Acidic fraction
4088	46	80	1	0	0	7	648.64	4.2e-05	Acidic fraction
4089	47	80	1	0	0	8	660.64	3.7e-05	Acidic fraction
4090	48	80	1	0	0	9	672.64	3.2e-05	Acidic fraction
4091	47	82	1	0	0	7	662.656	1.9e-05	Acidic fraction
4092	48	82	1	0	0	8	674.656	3.7e-05	Acidic fraction
4093	48	84	1	0	0	7	676.672	2.8e-05	Acidic fraction
4094	49	84	1	0	0	8	688.672	3.3e-05	Acidic fraction
4095	64	130	1	0	0	0	915.04	3e-05	Acidic fraction
4096	8	10	0	0	0	4	106.08	2.58993	Aromatics
4097	9	10	0	0	0	5	118.08	0.010424	Aromatics
4098	10	10	0	0	0	6	130.08	0.000644	Aromatics
4099	11	10	0	0	0	7	142.08	0.567743	Aromatics
4100	12	10	0	0	0	8	154.08	0.017485	Aromatics
4101	13	10	0	0	0	9	166.08	0.008024	Aromatics
4102	14	10	0	0	0	10	178.08	0.044642	Aromatics
4103	16	10	0	0	0	12	202.08	0.00014	Aromatics
4104	23	10	0	0	0	19	286.08	0.004253	Aromatics
4105	26	10	0	0	0	22	322.08	0.001213	Aromatics
4106	32	10	0	0	0	28	394.08	0.011616	Aromatics
4107	35	10	0	0	0	31	430.08	0.001897	Aromatics
4108	37	10	0	0	0	33	454.08	0.002217	Aromatics
4109	38	10	0	0	0	34	466.08	0.000192	Aromatics
4110	40	10	0	0	0	36	490.08	0.000376	Aromatics
4111	41	10	0	0	0	37	502.08	0.009865	Aromatics
4112	44	10	0	0	0	40	538.08	0.000185	Aromatics
4113	50	10	0	0	0	46	610.08	0.000209	Aromatics
4114	9	12	0	0	0	4	120.096	2.43049	Aromatics
4115	10	12	0	0	0	5	132.096	0.081972	Aromatics
4116	11	12	0	0	0	6	144.096	0.000611	Aromatics
4117	12	12	0	0	0	7	156.096	0.662235	Aromatics
4118	13	12	0	0	0	8	168.096	0.065587	Aromatics
4119	14	12	0	0	0	9	180.096	0.031876	Aromatics
4120	15	12	0	0	0	10	192.096	0.097408	Aromatics
4121	16	12	0	0	0	11	204.096	0.003556	Aromatics
4122	17	12	0	0	0	12	216.096	0.001322	Aromatics
4123	18	12	0	0	0	13	228.096	0.003802	Aromatics
4124	20	12	0	0	0	15	252.096	0.00011	Aromatics
4125	24	12	0	0	0	19	300.096	0.003542	Aromatics
4126	25	12	0	0	0	20	312.096	0.000121	Aromatics
4127	26	12	0	0	0	21	324.096	9e-05	Aromatics
4128	27	12	0	0	0	22	336.096	0.001038	Aromatics
4129	28	12	0	0	0	23	348.096	0.00021	Aromatics
4130	33	12	0	0	0	28	408.096	0.014086	Aromatics
4131	34	12	0	0	0	29	420.096	0.000154	Aromatics
4132	36	12	0	0	0	31	444.096	0.002697	Aromatics
4133	37	12	0	0	0	32	456.096	0.000139	Aromatics
4134	42	12	0	0	0	37	516.096	0.004714	Aromatics
4135	43	12	0	0	0	38	528.096	0.000165	Aromatics
4136	10	14	0	0	0	4	134.112	1.10726	Aromatics
4137	11	14	0	0	0	5	146.112	0.21261	Aromatics
4138	12	14	0	0	0	6	158.112	0.005726	Aromatics
4139	13	14	0	0	0	7	170.112	0.378327	Aromatics
4140	14	14	0	0	0	8	182.112	0.09918	Aromatics
4141	15	14	0	0	0	9	194.112	0.035191	Aromatics
4142	16	14	0	0	0	10	206.112	0.086196	Aromatics
4143	17	14	0	0	0	11	218.112	0.00939	Aromatics
4144	18	14	0	0	0	12	230.112	0.003936	Aromatics
4145	19	14	0	0	0	13	242.112	0.008241	Aromatics
4146	20	14	0	0	0	14	254.112	0.000844	Aromatics
4147	21	14	0	0	0	15	266.112	0.001609	Aromatics
4148	25	14	0	0	0	19	314.112	0.002195	Aromatics
4149	26	14	0	0	0	20	326.112	0.000545	Aromatics
4150	28	14	0	0	0	22	350.112	0.000436	Aromatics
4151	29	14	0	0	0	23	362.112	0.000528	Aromatics
4152	34	14	0	0	0	28	422.112	0.011324	Aromatics
4153	35	14	0	0	0	29	434.112	0.000804	Aromatics
4154	37	14	0	0	0	31	458.112	0.002294	Aromatics
4155	39	14	0	0	0	33	482.112	0.003296	Aromatics
4156	40	14	0	0	0	34	494.112	0.000344	Aromatics
4157	42	14	0	0	0	36	518.112	0.000153	Aromatics
4158	43	14	0	0	0	37	530.112	0.002277	Aromatics
4159	11	16	0	0	0	4	148.128	0.688715	Aromatics
4160	12	16	0	0	0	5	160.128	0.274677	Aromatics
4161	13	16	0	0	0	6	172.128	0.038731	Aromatics
4162	14	16	0	0	0	7	184.128	0.141665	Aromatics
4163	15	16	0	0	0	8	196.128	0.096016	Aromatics
4164	16	16	0	0	0	9	208.128	0.045461	Aromatics
4165	17	16	0	0	0	10	220.128	0.041962	Aromatics
4166	18	16	0	0	0	11	232.128	0.013073	Aromatics
4167	19	16	0	0	0	12	244.128	0.005342	Aromatics
4168	20	16	0	0	0	13	256.128	0.007188	Aromatics
4169	21	16	0	0	0	14	268.128	0.001575	Aromatics
4170	22	16	0	0	0	15	280.128	0.001609	Aromatics
4171	23	16	0	0	0	16	292.128	0.000266	Aromatics
4172	26	16	0	0	0	19	328.128	0.001434	Aromatics
4173	27	16	0	0	0	20	340.128	0.00046	Aromatics
4174	28	16	0	0	0	21	352.128	0.000105	Aromatics
4175	29	16	0	0	0	22	364.128	0.000421	Aromatics
4176	35	16	0	0	0	28	436.128	0.00586	Aromatics
4177	36	16	0	0	0	29	448.128	0.000833	Aromatics
4178	38	16	0	0	0	31	472.128	0.000311	Aromatics
4179	40	16	0	0	0	33	496.128	0.00139	Aromatics
4180	41	16	0	0	0	34	508.128	0.000283	Aromatics
4181	44	16	0	0	0	37	544.128	0.000721	Aromatics
4182	49	16	0	0	0	42	604.128	0.001097	Aromatics
4183	51	16	0	0	0	44	628.128	0.001022	Aromatics
4184	12	18	0	0	0	4	162.144	0.364209	Aromatics
4185	13	18	0	0	0	5	174.144	0.26352	Aromatics
4186	14	18	0	0	0	6	186.144	0.08534	Aromatics
4187	15	18	0	0	0	7	198.144	0.081834	Aromatics
4188	16	18	0	0	0	8	210.144	0.073313	Aromatics
4189	17	18	0	0	0	9	222.144	0.041193	Aromatics
4190	18	18	0	0	0	10	234.144	0.021336	Aromatics
4191	19	18	0	0	0	11	246.144	0.012231	Aromatics
4192	20	18	0	0	0	12	258.144	0.006979	Aromatics
4193	21	18	0	0	0	13	270.144	0.004361	Aromatics
4194	22	18	0	0	0	14	282.144	0.002224	Aromatics
4195	23	18	0	0	0	15	294.144	0.001102	Aromatics
4196	27	18	0	0	0	19	342.144	0.000518	Aromatics
4197	28	18	0	0	0	20	354.144	0.000532	Aromatics
4198	29	18	0	0	0	21	366.144	0.000211	Aromatics
4199	36	18	0	0	0	28	450.144	0.002016	Aromatics
4200	37	18	0	0	0	29	462.144	0.000995	Aromatics
4201	41	18	0	0	0	33	510.144	0.000519	Aromatics
4202	42	18	0	0	0	34	522.144	0.000288	Aromatics
4203	50	18	0	0	0	42	618.144	0.000489	Aromatics
4204	13	20	0	0	0	4	176.16	0.177956	Aromatics
4205	14	20	0	0	0	5	188.16	0.218016	Aromatics
4206	15	20	0	0	0	6	200.16	0.113191	Aromatics
4207	16	20	0	0	0	7	212.16	0.06128	Aromatics
4208	17	20	0	0	0	8	224.16	0.053183	Aromatics
4209	18	20	0	0	0	9	236.16	0.038793	Aromatics
4210	19	20	0	0	0	10	248.16	0.0158	Aromatics
4211	20	20	0	0	0	11	260.16	0.010623	Aromatics
4212	21	20	0	0	0	12	272.16	0.00651	Aromatics
4213	22	20	0	0	0	13	284.16	0.002782	Aromatics
4214	23	20	0	0	0	14	296.16	0.002989	Aromatics
4215	25	20	0	0	0	16	320.16	0.000237	Aromatics
4216	28	20	0	0	0	19	356.16	0.000442	Aromatics
4217	29	20	0	0	0	20	368.16	0.000301	Aromatics
4218	30	20	0	0	0	21	380.16	0.000208	Aromatics
4219	38	20	0	0	0	29	476.16	0.000221	Aromatics
4220	51	20	0	0	0	42	632.16	0.001043	Aromatics
4221	53	20	0	0	0	44	656.16	0.00025	Aromatics
4222	14	22	0	0	0	4	190.176	0.121954	Aromatics
4223	15	22	0	0	0	5	202.176	0.155548	Aromatics
4224	16	22	0	0	0	6	214.176	0.105005	Aromatics
4225	17	22	0	0	0	7	226.176	0.055229	Aromatics
4226	18	22	0	0	0	8	238.176	0.041539	Aromatics
4227	19	22	0	0	0	9	250.176	0.035503	Aromatics
4228	20	22	0	0	0	10	262.176	0.015347	Aromatics
4229	21	22	0	0	0	11	274.176	0.008949	Aromatics
4230	22	22	0	0	0	12	286.176	0.005622	Aromatics
4231	23	22	0	0	0	13	298.176	0.002489	Aromatics
4232	24	22	0	0	0	14	310.176	0.002874	Aromatics
4233	31	22	0	0	0	21	394.176	0.000493	Aromatics
4234	39	22	0	0	0	29	490.176	0.000137	Aromatics
4235	52	22	0	0	0	42	646.176	0.000427	Aromatics
4236	15	24	0	0	0	4	204.192	0.094103	Aromatics
4237	16	24	0	0	0	5	216.192	0.101935	Aromatics
4238	17	24	0	0	0	6	228.192	0.086079	Aromatics
4239	18	24	0	0	0	7	240.192	0.057572	Aromatics
4240	19	24	0	0	0	8	252.192	0.034029	Aromatics
4241	20	24	0	0	0	9	264.192	0.02874	Aromatics
4242	21	24	0	0	0	10	276.192	0.014866	Aromatics
4243	22	24	0	0	0	11	288.192	0.007229	Aromatics
4244	23	24	0	0	0	12	300.192	0.005203	Aromatics
4245	24	24	0	0	0	13	312.192	0.002894	Aromatics
4246	28	24	0	0	0	17	360.192	0.000176	Aromatics
4247	30	24	0	0	0	19	384.192	0.000217	Aromatics
4248	43	24	0	0	0	32	540.192	0.000304	Aromatics
4249	44	24	0	0	0	33	552.192	0.000299	Aromatics
4250	16	26	0	0	0	4	218.208	0.076221	Aromatics
4251	17	26	0	0	0	5	230.208	0.074765	Aromatics
4252	18	26	0	0	0	6	242.208	0.067376	Aromatics
4253	19	26	0	0	0	7	254.208	0.059253	Aromatics
4254	20	26	0	0	0	8	266.208	0.032307	Aromatics
4255	21	26	0	0	0	9	278.208	0.02299	Aromatics
4256	22	26	0	0	0	10	290.208	0.013646	Aromatics
4257	23	26	0	0	0	11	302.208	0.006784	Aromatics
4258	24	26	0	0	0	12	314.208	0.004423	Aromatics
4259	31	26	0	0	0	19	398.208	0.000632	Aromatics
4260	33	26	0	0	0	21	422.208	0.000121	Aromatics
4261	42	26	0	0	0	30	530.208	0.000432	Aromatics
4262	43	26	0	0	0	31	542.208	0.000308	Aromatics
4263	17	28	0	0	0	4	232.224	0.06885	Aromatics
4264	18	28	0	0	0	5	244.224	0.062166	Aromatics
4265	19	28	0	0	0	6	256.224	0.055279	Aromatics
4266	20	28	0	0	0	7	268.224	0.049326	Aromatics
4267	21	28	0	0	0	8	280.224	0.030629	Aromatics
4268	22	28	0	0	0	9	292.224	0.019698	Aromatics
4269	23	28	0	0	0	10	304.224	0.012418	Aromatics
4270	41	28	0	0	0	28	520.224	0.000317	Aromatics
4271	42	28	0	0	0	29	532.224	0.000359	Aromatics
4272	43	28	0	0	0	30	544.224	0.000482	Aromatics
4273	18	30	0	0	0	4	246.24	0.063347	Aromatics
4274	19	30	0	0	0	5	258.24	0.050255	Aromatics
4275	20	30	0	0	0	6	270.24	0.042642	Aromatics
4276	21	30	0	0	0	7	282.24	0.039001	Aromatics
4277	22	30	0	0	0	8	294.24	0.024811	Aromatics
4278	23	30	0	0	0	9	306.24	0.015047	Aromatics
4279	42	30	0	0	0	28	534.24	0.000256	Aromatics
4280	44	30	0	0	0	30	558.24	0.000345	Aromatics
4281	45	30	0	0	0	31	570.24	0.000182	Aromatics
4282	19	32	0	0	0	4	260.256	0.052879	Aromatics
4283	20	32	0	0	0	5	272.256	0.039279	Aromatics
4284	21	32	0	0	0	6	284.256	0.035082	Aromatics
4285	22	32	0	0	0	7	296.256	0.033928	Aromatics
4286	23	32	0	0	0	8	308.256	0.020513	Aromatics
4287	42	32	0	0	0	27	536.256	0.001284	Aromatics
4288	20	34	0	0	0	4	274.272	0.037152	Aromatics
4289	21	34	0	0	0	5	286.272	0.033796	Aromatics
4290	22	34	0	0	0	6	298.272	0.027951	Aromatics
4291	23	34	0	0	0	7	310.272	0.024882	Aromatics
4292	43	34	0	0	0	27	550.272	0.001395	Aromatics
4293	21	36	0	0	0	4	288.288	0.032154	Aromatics
4294	22	36	0	0	0	5	300.288	0.028408	Aromatics
4295	23	36	0	0	0	6	312.288	0.021325	Aromatics
4296	44	36	0	0	0	27	564.288	0.002278	Aromatics
4297	47	36	0	0	0	30	600.288	0.000381	Aromatics
4298	48	36	0	0	0	31	612.288	0.000241	Aromatics
4299	22	38	0	0	0	4	302.304	0.027707	Aromatics
4300	23	38	0	0	0	5	314.304	0.023944	Aromatics
4301	45	38	0	0	0	27	578.304	0.006043	Aromatics
4302	46	38	0	0	0	28	590.304	0.000551	Aromatics
4303	47	38	0	0	0	29	602.304	0.000729	Aromatics
4304	48	38	0	0	0	30	614.304	0.001287	Aromatics
4305	46	40	0	0	0	27	592.32	0.009909	Aromatics
4306	47	40	0	0	0	28	604.32	0.001609	Aromatics
4307	48	40	0	0	0	29	616.32	0.001402	Aromatics
4308	49	40	0	0	0	30	628.32	0.003125	Aromatics
4309	47	42	0	0	0	27	606.336	0.01121	Aromatics
4310	48	42	0	0	0	28	618.336	0.003288	Aromatics
4311	49	42	0	0	0	29	630.336	0.001206	Aromatics
4312	50	42	0	0	0	30	642.336	0.003428	Aromatics
4313	51	42	0	0	0	31	654.336	0.000897	Aromatics
4314	53	42	0	0	0	33	678.336	0.000221	Aromatics
4315	48	44	0	0	0	27	620.352	0.009795	Aromatics
4316	49	44	0	0	0	28	632.352	0.003759	Aromatics
4317	50	44	0	0	0	29	644.352	0.000884	Aromatics
4318	51	44	0	0	0	30	656.352	0.003097	Aromatics
4319	52	44	0	0	0	31	668.352	0.000504	Aromatics
4320	49	46	0	0	0	27	634.368	0.006724	Aromatics
4321	50	46	0	0	0	28	646.368	0.002995	Aromatics
4322	52	46	0	0	0	30	670.368	0.002718	Aromatics
4323	50	48	0	0	0	27	648.384	0.004309	Aromatics
4324	51	48	0	0	0	28	660.384	0.00268	Aromatics
4325	52	48	0	0	0	29	672.384	0.000655	Aromatics
4326	51	50	0	0	0	27	662.4	0.00217	Aromatics
4327	52	50	0	0	0	28	674.4	0.001726	Aromatics
4328	52	52	0	0	0	27	676.416	0.001141	Aromatics
4329	54	52	0	0	0	29	700.416	0.000347	Aromatics
4330	47	54	0	0	0	21	618.432	0.000269	Aromatics
4331	51	74	0	0	0	15	686.592	0.000247	Aromatics
4332	52	76	0	0	0	15	700.608	0.000552	Aromatics
4333	53	76	0	0	0	16	712.608	0.000285	Aromatics
4334	52	78	0	0	0	14	702.624	0.000256	Aromatics
4335	55	80	0	0	0	16	740.64	0.000376	Aromatics
4336	54	82	0	0	0	14	730.656	0.00036	Aromatics
4337	55	84	0	0	0	14	744.672	0.000228	Aromatics
4338	16	11	0	1	0	12	217.098	2e-05	Neutral nitrogen compounds
4339	16	11	1	1	0	12	233.098	0.0	Neutral nitrogen compounds
4340	18	11	0	1	0	14	241.098	0.0	Neutral nitrogen compounds
4341	17	11	1	1	0	13	245.098	0.0	Neutral nitrogen compounds
4342	14	13	0	1	0	9	195.114	5.6e-05	Neutral nitrogen compounds
4343	15	13	0	1	0	10	207.114	1e-06	Neutral nitrogen compounds
4344	15	13	1	1	0	10	223.114	1e-06	Neutral nitrogen compounds
4345	17	13	0	1	0	12	231.114	6.4e-05	Neutral nitrogen compounds
4346	18	13	0	1	0	13	243.114	2e-06	Neutral nitrogen compounds
4347	17	13	1	1	0	12	247.114	0.0	Neutral nitrogen compounds
4348	19	13	0	1	0	14	255.114	1e-06	Neutral nitrogen compounds
4349	18	13	1	1	0	13	259.114	0.0	Neutral nitrogen compounds
4350	20	13	0	1	0	15	267.114	1.1e-05	Neutral nitrogen compounds
4351	19	13	1	1	0	14	271.114	0.0	Neutral nitrogen compounds
4352	21	13	0	1	0	16	279.114	0.0	Neutral nitrogen compounds
4353	20	13	1	1	0	15	283.114	0.0	Neutral nitrogen compounds
4354	22	13	0	1	0	17	291.114	0.0	Neutral nitrogen compounds
4355	15	15	0	1	0	9	209.13	5.4e-05	Neutral nitrogen compounds
4356	16	15	0	1	0	10	221.13	6e-06	Neutral nitrogen compounds
4357	17	15	0	1	0	11	233.13	0.0	Neutral nitrogen compounds
4358	16	15	1	1	0	10	237.13	0.0	Neutral nitrogen compounds
4359	18	15	0	1	0	12	245.13	8.5e-05	Neutral nitrogen compounds
4360	19	15	0	1	0	13	257.13	1.2e-05	Neutral nitrogen compounds
4361	18	15	1	1	0	12	261.13	0.0	Neutral nitrogen compounds
4362	20	15	0	1	0	14	269.13	4e-06	Neutral nitrogen compounds
4363	19	15	1	1	0	13	273.13	0.0	Neutral nitrogen compounds
4364	18	15	2	1	0	12	277.13	0.0	Neutral nitrogen compounds
4365	21	15	0	1	0	15	281.13	3.1e-05	Neutral nitrogen compounds
4366	20	15	1	1	0	14	285.13	0.0	Neutral nitrogen compounds
4367	22	15	0	1	0	16	293.13	1e-06	Neutral nitrogen compounds
4368	21	15	1	1	0	15	297.13	0.0	Neutral nitrogen compounds
4369	23	15	0	1	0	17	305.13	1e-06	Neutral nitrogen compounds
4370	22	15	1	1	0	16	309.13	0.0	Neutral nitrogen compounds
4371	24	15	0	1	0	18	317.13	1e-06	Neutral nitrogen compounds
4372	24	15	1	1	0	18	333.13	0.0	Neutral nitrogen compounds
4373	26	15	0	1	0	20	341.13	0.0	Neutral nitrogen compounds
4374	13	17	0	1	0	6	187.146	0.0	Neutral nitrogen compounds
4375	16	17	0	1	0	9	223.146	3.7e-05	Neutral nitrogen compounds
4376	17	17	0	1	0	10	235.146	1.3e-05	Neutral nitrogen compounds
4377	18	17	0	1	0	11	247.146	1e-06	Neutral nitrogen compounds
4378	17	17	1	1	0	10	251.146	0.0	Neutral nitrogen compounds
4379	19	17	0	1	0	12	259.146	7.1e-05	Neutral nitrogen compounds
4380	18	17	1	1	0	11	263.146	0.0	Neutral nitrogen compounds
4381	20	17	0	1	0	13	271.146	2.4e-05	Neutral nitrogen compounds
4382	21	17	0	1	0	14	283.146	9e-06	Neutral nitrogen compounds
4383	20	17	1	1	0	13	287.146	0.0	Neutral nitrogen compounds
4384	19	17	2	1	0	12	291.146	0.0	Neutral nitrogen compounds
4385	22	17	0	1	0	15	295.146	3.8e-05	Neutral nitrogen compounds
4386	21	17	1	1	0	14	299.146	0.0	Neutral nitrogen compounds
4387	23	17	0	1	0	16	307.146	7e-06	Neutral nitrogen compounds
4388	22	17	1	1	0	15	311.146	0.0	Neutral nitrogen compounds
4389	24	17	0	1	0	17	319.146	4e-06	Neutral nitrogen compounds
4390	23	17	1	1	0	16	323.146	0.0	Neutral nitrogen compounds
4391	25	17	0	1	0	18	331.146	5e-06	Neutral nitrogen compounds
4392	24	17	1	1	0	17	335.146	0.0	Neutral nitrogen compounds
4393	26	17	0	1	0	19	343.146	0.0	Neutral nitrogen compounds
4394	25	17	1	1	0	18	347.146	0.0	Neutral nitrogen compounds
4395	27	17	0	1	0	20	355.146	0.0	Neutral nitrogen compounds
4396	28	17	0	1	0	21	367.146	0.0	Neutral nitrogen compounds
4397	14	19	0	1	0	6	201.162	0.0	Neutral nitrogen compounds
4398	16	19	0	1	0	8	225.162	0.0	Neutral nitrogen compounds
4399	17	19	0	1	0	9	237.162	2.9e-05	Neutral nitrogen compounds
4400	18	19	0	1	0	10	249.162	1.8e-05	Neutral nitrogen compounds
4401	19	19	0	1	0	11	261.162	7e-06	Neutral nitrogen compounds
4402	18	19	1	1	0	10	265.162	0.0	Neutral nitrogen compounds
4403	20	19	0	1	0	12	273.162	4e-05	Neutral nitrogen compounds
4404	19	19	1	1	0	11	277.162	0.0	Neutral nitrogen compounds
4405	21	19	0	1	0	13	285.162	2.8e-05	Neutral nitrogen compounds
4406	20	19	1	1	0	12	289.162	0.0	Neutral nitrogen compounds
4407	22	19	0	1	0	14	297.162	1.2e-05	Neutral nitrogen compounds
4408	21	19	1	1	0	13	301.162	0.0	Neutral nitrogen compounds
4409	20	19	2	1	0	12	305.162	0.0	Neutral nitrogen compounds
4410	23	19	0	1	0	15	309.162	2.7e-05	Neutral nitrogen compounds
4411	22	19	1	1	0	14	313.162	0.0	Neutral nitrogen compounds
4412	21	19	2	1	0	13	317.162	0.0	Neutral nitrogen compounds
4413	24	19	0	1	0	16	321.162	1.1e-05	Neutral nitrogen compounds
4414	23	19	1	1	0	15	325.162	0.0	Neutral nitrogen compounds
4415	25	19	0	1	0	17	333.162	6e-06	Neutral nitrogen compounds
4416	24	19	1	1	0	16	337.162	0.0	Neutral nitrogen compounds
4417	26	19	0	1	0	18	345.162	6e-06	Neutral nitrogen compounds
4418	25	19	1	1	0	17	349.162	0.0	Neutral nitrogen compounds
4419	27	19	0	1	0	19	357.162	2e-06	Neutral nitrogen compounds
4420	26	19	1	1	0	18	361.162	0.0	Neutral nitrogen compounds
4421	28	19	0	1	0	20	369.162	1e-06	Neutral nitrogen compounds
4422	27	19	1	1	0	19	373.162	0.0	Neutral nitrogen compounds
4423	29	19	0	1	0	21	381.162	0.0	Neutral nitrogen compounds
4424	30	19	0	1	0	22	393.162	0.0	Neutral nitrogen compounds
4425	31	19	0	1	0	23	405.162	0.0	Neutral nitrogen compounds
4426	15	21	0	1	0	6	215.178	0.0	Neutral nitrogen compounds
4427	16	21	0	1	0	7	227.178	0.0	Neutral nitrogen compounds
4428	17	21	0	1	0	8	239.178	0.0	Neutral nitrogen compounds
4429	18	21	0	1	0	9	251.178	2.2e-05	Neutral nitrogen compounds
4430	19	21	0	1	0	10	263.178	1.8e-05	Neutral nitrogen compounds
4431	18	21	1	1	0	9	267.178	0.0	Neutral nitrogen compounds
4432	20	21	0	1	0	11	275.178	1.7e-05	Neutral nitrogen compounds
4433	19	21	1	1	0	10	279.178	0.0	Neutral nitrogen compounds
4434	21	21	0	1	0	12	287.178	2.4e-05	Neutral nitrogen compounds
4435	20	21	1	1	0	11	291.178	0.0	Neutral nitrogen compounds
4436	22	21	0	1	0	13	299.178	2.4e-05	Neutral nitrogen compounds
4437	21	21	1	1	0	12	303.178	0.0	Neutral nitrogen compounds
4438	20	21	2	1	0	11	307.178	0.0	Neutral nitrogen compounds
4439	23	21	0	1	0	14	311.178	1.4e-05	Neutral nitrogen compounds
4440	22	21	1	1	0	13	315.178	0.0	Neutral nitrogen compounds
4441	21	21	2	1	0	12	319.178	0.0	Neutral nitrogen compounds
4442	24	21	0	1	0	15	323.178	1.5e-05	Neutral nitrogen compounds
4443	23	21	1	1	0	14	327.178	0.0	Neutral nitrogen compounds
4444	22	21	2	1	0	13	331.178	0.0	Neutral nitrogen compounds
4445	25	21	0	1	0	16	335.178	1.3e-05	Neutral nitrogen compounds
4446	24	21	1	1	0	15	339.178	0.0	Neutral nitrogen compounds
4447	26	21	0	1	0	17	347.178	6e-06	Neutral nitrogen compounds
4448	25	21	1	1	0	16	351.178	0.0	Neutral nitrogen compounds
4449	27	21	0	1	0	18	359.178	5e-06	Neutral nitrogen compounds
4450	26	21	1	1	0	17	363.178	0.0	Neutral nitrogen compounds
4451	28	21	0	1	0	19	371.178	3e-06	Neutral nitrogen compounds
4452	27	21	1	1	0	18	375.178	0.0	Neutral nitrogen compounds
4453	29	21	0	1	0	20	383.178	1e-06	Neutral nitrogen compounds
4454	28	21	1	1	0	19	387.178	0.0	Neutral nitrogen compounds
4455	30	21	0	1	0	21	395.178	1e-06	Neutral nitrogen compounds
4456	31	21	0	1	0	22	407.178	0.0	Neutral nitrogen compounds
4457	32	21	0	1	0	23	419.178	0.0	Neutral nitrogen compounds
4458	16	23	0	1	0	6	229.194	0.0	Neutral nitrogen compounds
4459	17	23	0	1	0	7	241.194	0.0	Neutral nitrogen compounds
4460	18	23	0	1	0	8	253.194	1e-06	Neutral nitrogen compounds
4461	19	23	0	1	0	9	265.194	1.3e-05	Neutral nitrogen compounds
4462	20	23	0	1	0	10	277.194	1.6e-05	Neutral nitrogen compounds
4463	19	23	1	1	0	9	281.194	0.0	Neutral nitrogen compounds
4464	21	23	0	1	0	11	289.194	2.3e-05	Neutral nitrogen compounds
4465	20	23	1	1	0	10	293.194	0.0	Neutral nitrogen compounds
4466	22	23	0	1	0	12	301.194	1.7e-05	Neutral nitrogen compounds
4467	21	23	1	1	0	11	305.194	0.0	Neutral nitrogen compounds
4468	23	23	0	1	0	13	313.194	1.9e-05	Neutral nitrogen compounds
4469	22	23	1	1	0	12	317.194	0.0	Neutral nitrogen compounds
4470	21	23	2	1	0	11	321.194	0.0	Neutral nitrogen compounds
4471	24	23	0	1	0	14	325.194	1.7e-05	Neutral nitrogen compounds
4472	23	23	1	1	0	13	329.194	0.0	Neutral nitrogen compounds
4473	22	23	2	1	0	12	333.194	0.0	Neutral nitrogen compounds
4474	25	23	0	1	0	15	337.194	1e-05	Neutral nitrogen compounds
4475	24	23	1	1	0	14	341.194	0.0	Neutral nitrogen compounds
4476	23	23	2	1	0	13	345.194	0.0	Neutral nitrogen compounds
4477	26	23	0	1	0	16	349.194	1e-05	Neutral nitrogen compounds
4478	25	23	1	1	0	15	353.194	0.0	Neutral nitrogen compounds
4479	27	23	0	1	0	17	361.194	5e-06	Neutral nitrogen compounds
4480	26	23	1	1	0	16	365.194	0.0	Neutral nitrogen compounds
4481	28	23	0	1	0	18	373.194	3e-06	Neutral nitrogen compounds
4482	27	23	1	1	0	17	377.194	0.0	Neutral nitrogen compounds
4483	29	23	0	1	0	19	385.194	2e-06	Neutral nitrogen compounds
4484	28	23	1	1	0	18	389.194	0.0	Neutral nitrogen compounds
4485	30	23	0	1	0	20	397.194	1e-06	Neutral nitrogen compounds
4486	31	23	0	1	0	21	409.194	1e-06	Neutral nitrogen compounds
4487	32	23	0	1	0	22	421.194	0.0	Neutral nitrogen compounds
4488	33	23	0	1	0	23	433.194	0.0	Neutral nitrogen compounds
4489	34	23	0	1	0	24	445.194	0.0	Neutral nitrogen compounds
4490	17	25	0	1	0	6	243.21	0.0	Neutral nitrogen compounds
4491	18	25	0	1	0	7	255.21	1e-06	Neutral nitrogen compounds
4492	19	25	0	1	0	8	267.21	1e-06	Neutral nitrogen compounds
4493	20	25	0	1	0	9	279.21	9e-06	Neutral nitrogen compounds
4494	21	25	0	1	0	10	291.21	1.4e-05	Neutral nitrogen compounds
4495	20	25	1	1	0	9	295.21	0.0	Neutral nitrogen compounds
4496	22	25	0	1	0	11	303.21	2.3e-05	Neutral nitrogen compounds
4497	21	25	1	1	0	10	307.21	0.0	Neutral nitrogen compounds
4498	23	25	0	1	0	12	315.21	1.7e-05	Neutral nitrogen compounds
4499	22	25	1	1	0	11	319.21	0.0	Neutral nitrogen compounds
4500	24	25	0	1	0	13	327.21	1.5e-05	Neutral nitrogen compounds
4501	23	25	1	1	0	12	331.21	0.0	Neutral nitrogen compounds
4502	22	25	2	1	0	11	335.21	0.0	Neutral nitrogen compounds
4503	25	25	0	1	0	14	339.21	1.8e-05	Neutral nitrogen compounds
4504	24	25	1	1	0	13	343.21	0.0	Neutral nitrogen compounds
4505	23	25	2	1	0	12	347.21	0.0	Neutral nitrogen compounds
4506	26	25	0	1	0	15	351.21	9e-06	Neutral nitrogen compounds
4507	25	25	1	1	0	14	355.21	0.0	Neutral nitrogen compounds
4508	24	25	2	1	0	13	359.21	0.0	Neutral nitrogen compounds
4509	27	25	0	1	0	16	363.21	7e-06	Neutral nitrogen compounds
4510	26	25	1	1	0	15	367.21	0.0	Neutral nitrogen compounds
4511	25	25	2	1	0	14	371.21	0.0	Neutral nitrogen compounds
4512	28	25	0	1	0	17	375.21	5e-06	Neutral nitrogen compounds
4513	27	25	1	1	0	16	379.21	0.0	Neutral nitrogen compounds
4514	29	25	0	1	0	18	387.21	3e-06	Neutral nitrogen compounds
4515	28	25	1	1	0	17	391.21	0.0	Neutral nitrogen compounds
4516	30	25	0	1	0	19	399.21	2e-06	Neutral nitrogen compounds
4517	29	25	1	1	0	18	403.21	0.0	Neutral nitrogen compounds
4518	31	25	0	1	0	20	411.21	1e-06	Neutral nitrogen compounds
4519	30	25	1	1	0	19	415.21	0.0	Neutral nitrogen compounds
4520	32	25	0	1	0	21	423.21	1e-06	Neutral nitrogen compounds
4521	33	25	0	1	0	22	435.21	0.0	Neutral nitrogen compounds
4522	34	25	0	1	0	23	447.21	0.0	Neutral nitrogen compounds
4523	35	25	0	1	0	24	459.21	0.0	Neutral nitrogen compounds
4524	36	25	0	1	0	25	471.21	0.0	Neutral nitrogen compounds
4525	18	27	0	1	0	6	257.226	0.0	Neutral nitrogen compounds
4526	19	27	0	1	0	7	269.226	1e-06	Neutral nitrogen compounds
4527	20	27	0	1	0	8	281.226	1e-06	Neutral nitrogen compounds
4528	21	27	0	1	0	9	293.226	9e-06	Neutral nitrogen compounds
4529	20	27	1	1	0	8	297.226	0.0	Neutral nitrogen compounds
4530	22	27	0	1	0	10	305.226	1.2e-05	Neutral nitrogen compounds
4531	21	27	1	1	0	9	309.226	0.0	Neutral nitrogen compounds
4532	23	27	0	1	0	11	317.226	2e-05	Neutral nitrogen compounds
4533	22	27	1	1	0	10	321.226	0.0	Neutral nitrogen compounds
4534	21	27	2	1	0	9	325.226	0.0	Neutral nitrogen compounds
4535	24	27	0	1	0	12	329.226	1.7e-05	Neutral nitrogen compounds
4536	23	27	1	1	0	11	333.226	0.0	Neutral nitrogen compounds
4537	22	27	2	1	0	10	337.226	0.0	Neutral nitrogen compounds
4538	25	27	0	1	0	13	341.226	1.2e-05	Neutral nitrogen compounds
4539	24	27	1	1	0	12	345.226	0.0	Neutral nitrogen compounds
4540	23	27	2	1	0	11	349.226	0.0	Neutral nitrogen compounds
4541	26	27	0	1	0	14	353.226	1.6e-05	Neutral nitrogen compounds
4542	25	27	1	1	0	13	357.226	0.0	Neutral nitrogen compounds
4543	24	27	2	1	0	12	361.226	0.0	Neutral nitrogen compounds
4544	27	27	0	1	0	15	365.226	9e-06	Neutral nitrogen compounds
4545	26	27	1	1	0	14	369.226	0.0	Neutral nitrogen compounds
4546	25	27	2	1	0	13	373.226	0.0	Neutral nitrogen compounds
4547	28	27	0	1	0	16	377.226	6e-06	Neutral nitrogen compounds
4548	27	27	1	1	0	15	381.226	0.0	Neutral nitrogen compounds
4549	26	27	2	1	0	14	385.226	0.0	Neutral nitrogen compounds
4550	29	27	0	1	0	17	389.226	5e-06	Neutral nitrogen compounds
4551	28	27	1	1	0	16	393.226	0.0	Neutral nitrogen compounds
4552	30	27	0	1	0	18	401.226	2e-06	Neutral nitrogen compounds
4553	29	27	1	1	0	17	405.226	0.0	Neutral nitrogen compounds
4554	31	27	0	1	0	19	413.226	2e-06	Neutral nitrogen compounds
4555	30	27	1	1	0	18	417.226	0.0	Neutral nitrogen compounds
4556	32	27	0	1	0	20	425.226	1e-06	Neutral nitrogen compounds
4557	33	27	0	1	0	21	437.226	1e-06	Neutral nitrogen compounds
4558	34	27	0	1	0	22	449.226	0.0	Neutral nitrogen compounds
4559	35	27	0	1	0	23	461.226	0.0	Neutral nitrogen compounds
4560	36	27	0	1	0	24	473.226	0.0	Neutral nitrogen compounds
4561	37	27	0	1	0	25	485.226	0.0	Neutral nitrogen compounds
4562	19	29	0	1	0	6	271.242	0.0	Neutral nitrogen compounds
4563	20	29	0	1	0	7	283.242	0.0	Neutral nitrogen compounds
4564	21	29	0	1	0	8	295.242	1e-06	Neutral nitrogen compounds
4565	22	29	0	1	0	9	307.242	8e-06	Neutral nitrogen compounds
4566	21	29	1	1	0	8	311.242	0.0	Neutral nitrogen compounds
4567	23	29	0	1	0	10	319.242	1e-05	Neutral nitrogen compounds
4568	22	29	1	1	0	9	323.242	0.0	Neutral nitrogen compounds
4569	24	29	0	1	0	11	331.242	1.6e-05	Neutral nitrogen compounds
4570	23	29	1	1	0	10	335.242	0.0	Neutral nitrogen compounds
4571	22	29	2	1	0	9	339.242	0.0	Neutral nitrogen compounds
4572	25	29	0	1	0	12	343.242	1.6e-05	Neutral nitrogen compounds
4573	24	29	1	1	0	11	347.242	0.0	Neutral nitrogen compounds
4574	23	29	2	1	0	10	351.242	0.0	Neutral nitrogen compounds
4575	26	29	0	1	0	13	355.242	1.1e-05	Neutral nitrogen compounds
4576	25	29	1	1	0	12	359.242	0.0	Neutral nitrogen compounds
4577	24	29	2	1	0	11	363.242	0.0	Neutral nitrogen compounds
4578	27	29	0	1	0	14	367.242	1.3e-05	Neutral nitrogen compounds
4579	26	29	1	1	0	13	371.242	0.0	Neutral nitrogen compounds
4580	25	29	2	1	0	12	375.242	0.0	Neutral nitrogen compounds
4581	28	29	0	1	0	15	379.242	9e-06	Neutral nitrogen compounds
4582	27	29	1	1	0	14	383.242	0.0	Neutral nitrogen compounds
4583	26	29	2	1	0	13	387.242	0.0	Neutral nitrogen compounds
4584	29	29	0	1	0	16	391.242	5e-06	Neutral nitrogen compounds
4585	28	29	1	1	0	15	395.242	0.0	Neutral nitrogen compounds
4586	27	29	2	1	0	14	399.242	0.0	Neutral nitrogen compounds
4587	30	29	0	1	0	17	403.242	4e-06	Neutral nitrogen compounds
4588	29	29	1	1	0	16	407.242	0.0	Neutral nitrogen compounds
4589	28	29	2	1	0	15	411.242	0.0	Neutral nitrogen compounds
4590	31	29	0	1	0	18	415.242	2e-06	Neutral nitrogen compounds
4591	30	29	1	1	0	17	419.242	0.0	Neutral nitrogen compounds
4592	32	29	0	1	0	19	427.242	1e-06	Neutral nitrogen compounds
4593	31	29	1	1	0	18	431.242	0.0	Neutral nitrogen compounds
4594	33	29	0	1	0	20	439.242	1e-06	Neutral nitrogen compounds
4595	34	29	0	1	0	21	451.242	1e-06	Neutral nitrogen compounds
4596	35	29	0	1	0	22	463.242	0.0	Neutral nitrogen compounds
4597	36	29	0	1	0	23	475.242	0.0	Neutral nitrogen compounds
4598	37	29	0	1	0	24	487.242	0.0	Neutral nitrogen compounds
4599	38	29	0	1	0	25	499.242	0.0	Neutral nitrogen compounds
4600	20	31	0	1	0	6	285.258	0.0	Neutral nitrogen compounds
4601	21	31	0	1	0	7	297.258	0.0	Neutral nitrogen compounds
4602	22	31	0	1	0	8	309.258	1e-06	Neutral nitrogen compounds
4603	23	31	0	1	0	9	321.258	8e-06	Neutral nitrogen compounds
4604	22	31	1	1	0	8	325.258	0.0	Neutral nitrogen compounds
4605	24	31	0	1	0	10	333.258	9e-06	Neutral nitrogen compounds
4606	23	31	1	1	0	9	337.258	0.0	Neutral nitrogen compounds
4607	25	31	0	1	0	11	345.258	1.2e-05	Neutral nitrogen compounds
4608	24	31	1	1	0	10	349.258	0.0	Neutral nitrogen compounds
4609	23	31	2	1	0	9	353.258	0.0	Neutral nitrogen compounds
4610	26	31	0	1	0	12	357.258	1.4e-05	Neutral nitrogen compounds
4611	25	31	1	1	0	11	361.258	0.0	Neutral nitrogen compounds
4612	24	31	2	1	0	10	365.258	0.0	Neutral nitrogen compounds
4613	27	31	0	1	0	13	369.258	1.1e-05	Neutral nitrogen compounds
4614	26	31	1	1	0	12	373.258	0.0	Neutral nitrogen compounds
4615	25	31	2	1	0	11	377.258	0.0	Neutral nitrogen compounds
4616	28	31	0	1	0	14	381.258	1.1e-05	Neutral nitrogen compounds
4617	27	31	1	1	0	13	385.258	0.0	Neutral nitrogen compounds
4618	26	31	2	1	0	12	389.258	0.0	Neutral nitrogen compounds
4619	29	31	0	1	0	15	393.258	7e-06	Neutral nitrogen compounds
4620	28	31	1	1	0	14	397.258	0.0	Neutral nitrogen compounds
4621	27	31	2	1	0	13	401.258	0.0	Neutral nitrogen compounds
4622	30	31	0	1	0	16	405.258	4e-06	Neutral nitrogen compounds
4623	29	31	1	1	0	15	409.258	0.0	Neutral nitrogen compounds
4624	28	31	2	1	0	14	413.258	0.0	Neutral nitrogen compounds
4625	31	31	0	1	0	17	417.258	3e-06	Neutral nitrogen compounds
4626	30	31	1	1	0	16	421.258	0.0	Neutral nitrogen compounds
4627	32	31	0	1	0	18	429.258	2e-06	Neutral nitrogen compounds
4628	31	31	1	1	0	17	433.258	0.0	Neutral nitrogen compounds
4629	33	31	0	1	0	19	441.258	1e-06	Neutral nitrogen compounds
4630	32	31	1	1	0	18	445.258	0.0	Neutral nitrogen compounds
4631	34	31	0	1	0	20	453.258	1e-06	Neutral nitrogen compounds
4632	35	31	0	1	0	21	465.258	0.0	Neutral nitrogen compounds
4633	36	31	0	1	0	22	477.258	0.0	Neutral nitrogen compounds
4634	37	31	0	1	0	23	489.258	0.0	Neutral nitrogen compounds
4635	38	31	0	1	0	24	501.258	0.0	Neutral nitrogen compounds
4636	21	33	0	1	0	6	299.274	0.0	Neutral nitrogen compounds
4637	22	33	0	1	0	7	311.274	0.0	Neutral nitrogen compounds
4638	23	33	0	1	0	8	323.274	1e-06	Neutral nitrogen compounds
4639	24	33	0	1	0	9	335.274	7e-06	Neutral nitrogen compounds
4640	23	33	1	1	0	8	339.274	0.0	Neutral nitrogen compounds
4641	25	33	0	1	0	10	347.274	7e-06	Neutral nitrogen compounds
4642	24	33	1	1	0	9	351.274	0.0	Neutral nitrogen compounds
4643	26	33	0	1	0	11	359.274	1e-05	Neutral nitrogen compounds
4644	25	33	1	1	0	10	363.274	0.0	Neutral nitrogen compounds
4645	24	33	2	1	0	9	367.274	0.0	Neutral nitrogen compounds
4646	27	33	0	1	0	12	371.274	1.2e-05	Neutral nitrogen compounds
4647	26	33	1	1	0	11	375.274	0.0	Neutral nitrogen compounds
4648	25	33	2	1	0	10	379.274	0.0	Neutral nitrogen compounds
4649	28	33	0	1	0	13	383.274	9e-06	Neutral nitrogen compounds
4650	27	33	1	1	0	12	387.274	0.0	Neutral nitrogen compounds
4651	26	33	2	1	0	11	391.274	0.0	Neutral nitrogen compounds
4652	29	33	0	1	0	14	395.274	8e-06	Neutral nitrogen compounds
4653	28	33	1	1	0	13	399.274	0.0	Neutral nitrogen compounds
4654	27	33	2	1	0	12	403.274	0.0	Neutral nitrogen compounds
4655	30	33	0	1	0	15	407.274	6e-06	Neutral nitrogen compounds
4656	29	33	1	1	0	14	411.274	0.0	Neutral nitrogen compounds
4657	28	33	2	1	0	13	415.274	0.0	Neutral nitrogen compounds
4658	31	33	0	1	0	16	419.274	4e-06	Neutral nitrogen compounds
4659	30	33	1	1	0	15	423.274	0.0	Neutral nitrogen compounds
4660	29	33	2	1	0	14	427.274	0.0	Neutral nitrogen compounds
4661	32	33	0	1	0	17	431.274	3e-06	Neutral nitrogen compounds
4662	31	33	1	1	0	16	435.274	0.0	Neutral nitrogen compounds
4663	30	33	2	1	0	15	439.274	0.0	Neutral nitrogen compounds
4664	33	33	0	1	0	18	443.274	2e-06	Neutral nitrogen compounds
4665	32	33	1	1	0	17	447.274	0.0	Neutral nitrogen compounds
4666	34	33	0	1	0	19	455.274	1e-06	Neutral nitrogen compounds
4667	33	33	1	1	0	18	459.274	0.0	Neutral nitrogen compounds
4668	35	33	0	1	0	20	467.274	1e-06	Neutral nitrogen compounds
4669	36	33	0	1	0	21	479.274	0.0	Neutral nitrogen compounds
4670	37	33	0	1	0	22	491.274	0.0	Neutral nitrogen compounds
4671	38	33	0	1	0	23	503.274	0.0	Neutral nitrogen compounds
4672	39	33	0	1	0	24	515.274	0.0	Neutral nitrogen compounds
4673	40	33	0	1	0	25	527.274	0.0	Neutral nitrogen compounds
4674	22	35	0	1	0	6	313.29	0.0	Neutral nitrogen compounds
4675	23	35	0	1	0	7	325.29	0.0	Neutral nitrogen compounds
4676	24	35	0	1	0	8	337.29	1e-06	Neutral nitrogen compounds
4677	25	35	0	1	0	9	349.29	6e-06	Neutral nitrogen compounds
4678	24	35	1	1	0	8	353.29	0.0	Neutral nitrogen compounds
4679	26	35	0	1	0	10	361.29	6e-06	Neutral nitrogen compounds
4680	25	35	1	1	0	9	365.29	0.0	Neutral nitrogen compounds
4681	27	35	0	1	0	11	373.29	9e-06	Neutral nitrogen compounds
4682	26	35	1	1	0	10	377.29	0.0	Neutral nitrogen compounds
4683	25	35	2	1	0	9	381.29	0.0	Neutral nitrogen compounds
4684	28	35	0	1	0	12	385.29	1e-05	Neutral nitrogen compounds
4685	27	35	1	1	0	11	389.29	0.0	Neutral nitrogen compounds
4686	26	35	2	1	0	10	393.29	0.0	Neutral nitrogen compounds
4687	29	35	0	1	0	13	397.29	8e-06	Neutral nitrogen compounds
4688	28	35	1	1	0	12	401.29	0.0	Neutral nitrogen compounds
4689	27	35	2	1	0	11	405.29	0.0	Neutral nitrogen compounds
4690	30	35	0	1	0	14	409.29	6e-06	Neutral nitrogen compounds
4691	29	35	1	1	0	13	413.29	0.0	Neutral nitrogen compounds
4692	28	35	2	1	0	12	417.29	0.0	Neutral nitrogen compounds
4693	31	35	0	1	0	15	421.29	5e-06	Neutral nitrogen compounds
4694	30	35	1	1	0	14	425.29	0.0	Neutral nitrogen compounds
4695	29	35	2	1	0	13	429.29	0.0	Neutral nitrogen compounds
4696	32	35	0	1	0	16	433.29	3e-06	Neutral nitrogen compounds
4697	31	35	1	1	0	15	437.29	0.0	Neutral nitrogen compounds
4698	30	35	2	1	0	14	441.29	0.0	Neutral nitrogen compounds
4699	33	35	0	1	0	17	445.29	2e-06	Neutral nitrogen compounds
4700	32	35	1	1	0	16	449.29	0.0	Neutral nitrogen compounds
4701	31	35	2	1	0	15	453.29	0.0	Neutral nitrogen compounds
4702	34	35	0	1	0	18	457.29	1e-06	Neutral nitrogen compounds
4703	33	35	1	1	0	17	461.29	0.0	Neutral nitrogen compounds
4704	35	35	0	1	0	19	469.29	1e-06	Neutral nitrogen compounds
4705	34	35	1	1	0	18	473.29	0.0	Neutral nitrogen compounds
4706	36	35	0	1	0	20	481.29	1e-06	Neutral nitrogen compounds
4707	37	35	0	1	0	21	493.29	0.0	Neutral nitrogen compounds
4708	38	35	0	1	0	22	505.29	0.0	Neutral nitrogen compounds
4709	39	35	0	1	0	23	517.29	0.0	Neutral nitrogen compounds
4710	40	35	0	1	0	24	529.29	0.0	Neutral nitrogen compounds
4711	23	37	0	1	0	6	327.306	0.0	Neutral nitrogen compounds
4712	24	37	0	1	0	7	339.306	0.0	Neutral nitrogen compounds
4713	25	37	0	1	0	8	351.306	1e-06	Neutral nitrogen compounds
4714	26	37	0	1	0	9	363.306	5e-06	Neutral nitrogen compounds
4715	25	37	1	1	0	8	367.306	0.0	Neutral nitrogen compounds
4716	27	37	0	1	0	10	375.306	5e-06	Neutral nitrogen compounds
4717	26	37	1	1	0	9	379.306	0.0	Neutral nitrogen compounds
4718	28	37	0	1	0	11	387.306	7e-06	Neutral nitrogen compounds
4719	27	37	1	1	0	10	391.306	0.0	Neutral nitrogen compounds
4720	26	37	2	1	0	9	395.306	0.0	Neutral nitrogen compounds
4721	29	37	0	1	0	12	399.306	8e-06	Neutral nitrogen compounds
4722	28	37	1	1	0	11	403.306	0.0	Neutral nitrogen compounds
4723	27	37	2	1	0	10	407.306	0.0	Neutral nitrogen compounds
4724	30	37	0	1	0	13	411.306	6e-06	Neutral nitrogen compounds
4725	29	37	1	1	0	12	415.306	0.0	Neutral nitrogen compounds
4726	28	37	2	1	0	11	419.306	0.0	Neutral nitrogen compounds
4727	31	37	0	1	0	14	423.306	5e-06	Neutral nitrogen compounds
4728	30	37	1	1	0	13	427.306	0.0	Neutral nitrogen compounds
4729	29	37	2	1	0	12	431.306	0.0	Neutral nitrogen compounds
4730	32	37	0	1	0	15	435.306	4e-06	Neutral nitrogen compounds
4731	31	37	1	1	0	14	439.306	0.0	Neutral nitrogen compounds
4732	30	37	2	1	0	13	443.306	0.0	Neutral nitrogen compounds
4733	33	37	0	1	0	16	447.306	3e-06	Neutral nitrogen compounds
4734	32	37	1	1	0	15	451.306	0.0	Neutral nitrogen compounds
4735	31	37	2	1	0	14	455.306	0.0	Neutral nitrogen compounds
4736	34	37	0	1	0	17	459.306	2e-06	Neutral nitrogen compounds
4737	33	37	1	1	0	16	463.306	0.0	Neutral nitrogen compounds
4738	32	37	2	1	0	15	467.306	0.0	Neutral nitrogen compounds
4739	35	37	0	1	0	18	471.306	1e-06	Neutral nitrogen compounds
4740	36	37	0	1	0	19	483.306	1e-06	Neutral nitrogen compounds
4741	37	37	0	1	0	20	495.306	0.0	Neutral nitrogen compounds
4742	38	37	0	1	0	21	507.306	0.0	Neutral nitrogen compounds
4743	39	37	0	1	0	22	519.306	0.0	Neutral nitrogen compounds
4744	40	37	0	1	0	23	531.306	0.0	Neutral nitrogen compounds
4745	41	37	0	1	0	24	543.306	0.0	Neutral nitrogen compounds
4746	24	39	0	1	0	6	341.322	0.0	Neutral nitrogen compounds
4747	25	39	0	1	0	7	353.322	0.0	Neutral nitrogen compounds
4748	26	39	0	1	0	8	365.322	0.0	Neutral nitrogen compounds
4749	27	39	0	1	0	9	377.322	5e-06	Neutral nitrogen compounds
4750	26	39	1	1	0	8	381.322	0.0	Neutral nitrogen compounds
4751	28	39	0	1	0	10	389.322	5e-06	Neutral nitrogen compounds
4752	27	39	1	1	0	9	393.322	0.0	Neutral nitrogen compounds
4753	29	39	0	1	0	11	401.322	5e-06	Neutral nitrogen compounds
4754	28	39	1	1	0	10	405.322	0.0	Neutral nitrogen compounds
4755	27	39	2	1	0	9	409.322	0.0	Neutral nitrogen compounds
4756	30	39	0	1	0	12	413.322	6e-06	Neutral nitrogen compounds
4757	29	39	1	1	0	11	417.322	0.0	Neutral nitrogen compounds
4758	28	39	2	1	0	10	421.322	0.0	Neutral nitrogen compounds
4759	31	39	0	1	0	13	425.322	5e-06	Neutral nitrogen compounds
4760	30	39	1	1	0	12	429.322	0.0	Neutral nitrogen compounds
4761	29	39	2	1	0	11	433.322	0.0	Neutral nitrogen compounds
4762	32	39	0	1	0	14	437.322	4e-06	Neutral nitrogen compounds
4763	31	39	1	1	0	13	441.322	0.0	Neutral nitrogen compounds
4764	30	39	2	1	0	12	445.322	0.0	Neutral nitrogen compounds
4765	33	39	0	1	0	15	449.322	3e-06	Neutral nitrogen compounds
4766	32	39	1	1	0	14	453.322	0.0	Neutral nitrogen compounds
4767	31	39	2	1	0	13	457.322	0.0	Neutral nitrogen compounds
4768	34	39	0	1	0	16	461.322	2e-06	Neutral nitrogen compounds
4769	33	39	1	1	0	15	465.322	0.0	Neutral nitrogen compounds
4770	32	39	2	1	0	14	469.322	0.0	Neutral nitrogen compounds
4771	35	39	0	1	0	17	473.322	1e-06	Neutral nitrogen compounds
4772	34	39	1	1	0	16	477.322	0.0	Neutral nitrogen compounds
4773	36	39	0	1	0	18	485.322	1e-06	Neutral nitrogen compounds
4774	37	39	0	1	0	19	497.322	1e-06	Neutral nitrogen compounds
4775	38	39	0	1	0	20	509.322	0.0	Neutral nitrogen compounds
4776	39	39	0	1	0	21	521.322	0.0	Neutral nitrogen compounds
4777	40	39	0	1	0	22	533.322	0.0	Neutral nitrogen compounds
4778	41	39	0	1	0	23	545.322	0.0	Neutral nitrogen compounds
4779	43	39	0	1	0	25	569.322	0.0	Neutral nitrogen compounds
4780	25	41	0	1	0	6	355.338	0.0	Neutral nitrogen compounds
4781	26	41	0	1	0	7	367.338	0.0	Neutral nitrogen compounds
4782	27	41	0	1	0	8	379.338	0.0	Neutral nitrogen compounds
4783	28	41	0	1	0	9	391.338	4e-06	Neutral nitrogen compounds
4784	29	41	0	1	0	10	403.338	3e-06	Neutral nitrogen compounds
4785	28	41	1	1	0	9	407.338	0.0	Neutral nitrogen compounds
4786	30	41	0	1	0	11	415.338	5e-06	Neutral nitrogen compounds
4787	29	41	1	1	0	10	419.338	0.0	Neutral nitrogen compounds
4788	28	41	2	1	0	9	423.338	0.0	Neutral nitrogen compounds
4789	31	41	0	1	0	12	427.338	6e-06	Neutral nitrogen compounds
4790	30	41	1	1	0	11	431.338	0.0	Neutral nitrogen compounds
4791	29	41	2	1	0	10	435.338	0.0	Neutral nitrogen compounds
4792	32	41	0	1	0	13	439.338	5e-06	Neutral nitrogen compounds
4793	31	41	1	1	0	12	443.338	0.0	Neutral nitrogen compounds
4794	30	41	2	1	0	11	447.338	0.0	Neutral nitrogen compounds
4795	33	41	0	1	0	14	451.338	3e-06	Neutral nitrogen compounds
4796	32	41	1	1	0	13	455.338	0.0	Neutral nitrogen compounds
4797	31	41	2	1	0	12	459.338	0.0	Neutral nitrogen compounds
4798	34	41	0	1	0	15	463.338	3e-06	Neutral nitrogen compounds
4799	33	41	1	1	0	14	467.338	0.0	Neutral nitrogen compounds
4800	32	41	2	1	0	13	471.338	0.0	Neutral nitrogen compounds
4801	35	41	0	1	0	16	475.338	2e-06	Neutral nitrogen compounds
4802	34	41	1	1	0	15	479.338	0.0	Neutral nitrogen compounds
4803	33	41	2	1	0	14	483.338	0.0	Neutral nitrogen compounds
4804	36	41	0	1	0	17	487.338	1e-06	Neutral nitrogen compounds
4805	35	41	1	1	0	16	491.338	0.0	Neutral nitrogen compounds
4806	34	41	2	1	0	15	495.338	0.0	Neutral nitrogen compounds
4807	37	41	0	1	0	18	499.338	1e-06	Neutral nitrogen compounds
4808	38	41	0	1	0	19	511.338	1e-06	Neutral nitrogen compounds
4809	39	41	0	1	0	20	523.338	0.0	Neutral nitrogen compounds
4810	40	41	0	1	0	21	535.338	0.0	Neutral nitrogen compounds
4811	41	41	0	1	0	22	547.338	0.0	Neutral nitrogen compounds
4812	42	41	0	1	0	23	559.338	0.0	Neutral nitrogen compounds
4813	26	43	0	1	0	6	369.354	0.0	Neutral nitrogen compounds
4814	27	43	0	1	0	7	381.354	0.0	Neutral nitrogen compounds
4815	28	43	0	1	0	8	393.354	0.0	Neutral nitrogen compounds
4816	29	43	0	1	0	9	405.354	3e-06	Neutral nitrogen compounds
4817	28	43	1	1	0	8	409.354	0.0	Neutral nitrogen compounds
4818	30	43	0	1	0	10	417.354	3e-06	Neutral nitrogen compounds
4819	29	43	1	1	0	9	421.354	0.0	Neutral nitrogen compounds
4820	31	43	0	1	0	11	429.354	4e-06	Neutral nitrogen compounds
4821	30	43	1	1	0	10	433.354	0.0	Neutral nitrogen compounds
4822	29	43	2	1	0	9	437.354	0.0	Neutral nitrogen compounds
4823	32	43	0	1	0	12	441.354	5e-06	Neutral nitrogen compounds
4824	31	43	1	1	0	11	445.354	0.0	Neutral nitrogen compounds
4825	30	43	2	1	0	10	449.354	0.0	Neutral nitrogen compounds
4826	33	43	0	1	0	13	453.354	4e-06	Neutral nitrogen compounds
4827	32	43	1	1	0	12	457.354	0.0	Neutral nitrogen compounds
4828	31	43	2	1	0	11	461.354	0.0	Neutral nitrogen compounds
4829	34	43	0	1	0	14	465.354	3e-06	Neutral nitrogen compounds
4830	33	43	1	1	0	13	469.354	0.0	Neutral nitrogen compounds
4831	32	43	2	1	0	12	473.354	0.0	Neutral nitrogen compounds
4832	35	43	0	1	0	15	477.354	2e-06	Neutral nitrogen compounds
4833	34	43	1	1	0	14	481.354	0.0	Neutral nitrogen compounds
4834	33	43	2	1	0	13	485.354	0.0	Neutral nitrogen compounds
4835	36	43	0	1	0	16	489.354	2e-06	Neutral nitrogen compounds
4836	35	43	1	1	0	15	493.354	0.0	Neutral nitrogen compounds
4837	34	43	2	1	0	14	497.354	0.0	Neutral nitrogen compounds
4838	37	43	0	1	0	17	501.354	1e-06	Neutral nitrogen compounds
4839	38	43	0	1	0	18	513.354	1e-06	Neutral nitrogen compounds
4840	39	43	0	1	0	19	525.354	1e-06	Neutral nitrogen compounds
4841	40	43	0	1	0	20	537.354	0.0	Neutral nitrogen compounds
4842	41	43	0	1	0	21	549.354	0.0	Neutral nitrogen compounds
4843	42	43	0	1	0	22	561.354	0.0	Neutral nitrogen compounds
4844	27	45	0	1	0	6	383.37	0.0	Neutral nitrogen compounds
4845	28	45	0	1	0	7	395.37	0.0	Neutral nitrogen compounds
4846	29	45	0	1	0	8	407.37	0.0	Neutral nitrogen compounds
4847	30	45	0	1	0	9	419.37	3e-06	Neutral nitrogen compounds
4848	29	45	1	1	0	8	423.37	0.0	Neutral nitrogen compounds
4849	31	45	0	1	0	10	431.37	3e-06	Neutral nitrogen compounds
4850	30	45	1	1	0	9	435.37	0.0	Neutral nitrogen compounds
4851	32	45	0	1	0	11	443.37	4e-06	Neutral nitrogen compounds
4852	31	45	1	1	0	10	447.37	0.0	Neutral nitrogen compounds
4853	30	45	2	1	0	9	451.37	0.0	Neutral nitrogen compounds
4854	33	45	0	1	0	12	455.37	4e-06	Neutral nitrogen compounds
4855	32	45	1	1	0	11	459.37	0.0	Neutral nitrogen compounds
4856	31	45	2	1	0	10	463.37	0.0	Neutral nitrogen compounds
4857	34	45	0	1	0	13	467.37	3e-06	Neutral nitrogen compounds
4858	33	45	1	1	0	12	471.37	0.0	Neutral nitrogen compounds
4859	32	45	2	1	0	11	475.37	0.0	Neutral nitrogen compounds
4860	35	45	0	1	0	14	479.37	3e-06	Neutral nitrogen compounds
4861	33	45	2	1	0	12	487.37	0.0	Neutral nitrogen compounds
4862	36	45	0	1	0	15	491.37	2e-06	Neutral nitrogen compounds
4863	35	45	1	1	0	14	495.37	0.0	Neutral nitrogen compounds
4864	34	45	2	1	0	13	499.37	0.0	Neutral nitrogen compounds
4865	37	45	0	1	0	16	503.37	1e-06	Neutral nitrogen compounds
4866	35	45	2	1	0	14	511.37	0.0	Neutral nitrogen compounds
4867	38	45	0	1	0	17	515.37	1e-06	Neutral nitrogen compounds
4868	37	45	1	1	0	16	519.37	0.0	Neutral nitrogen compounds
4869	39	45	0	1	0	18	527.37	1e-06	Neutral nitrogen compounds
4870	40	45	0	1	0	19	539.37	0.0	Neutral nitrogen compounds
4871	41	45	0	1	0	20	551.37	0.0	Neutral nitrogen compounds
4872	42	45	0	1	0	21	563.37	0.0	Neutral nitrogen compounds
4873	43	45	0	1	0	22	575.37	0.0	Neutral nitrogen compounds
4874	45	45	0	1	0	24	599.37	0.0	Neutral nitrogen compounds
4875	62	45	2	1	0	41	835.37	0.0	Neutral nitrogen compounds
4876	28	47	0	1	0	6	397.386	0.0	Neutral nitrogen compounds
4877	29	47	0	1	0	7	409.386	0.0	Neutral nitrogen compounds
4878	30	47	0	1	0	8	421.386	0.0	Neutral nitrogen compounds
4879	31	47	0	1	0	9	433.386	3e-06	Neutral nitrogen compounds
4880	30	47	1	1	0	8	437.386	0.0	Neutral nitrogen compounds
4881	32	47	0	1	0	10	445.386	2e-06	Neutral nitrogen compounds
4882	31	47	1	1	0	9	449.386	0.0	Neutral nitrogen compounds
4883	33	47	0	1	0	11	457.386	3e-06	Neutral nitrogen compounds
4884	32	47	1	1	0	10	461.386	0.0	Neutral nitrogen compounds
4885	31	47	2	1	0	9	465.386	0.0	Neutral nitrogen compounds
4886	34	47	0	1	0	12	469.386	3e-06	Neutral nitrogen compounds
4887	33	47	1	1	0	11	473.386	0.0	Neutral nitrogen compounds
4888	32	47	2	1	0	10	477.386	0.0	Neutral nitrogen compounds
4889	35	47	0	1	0	13	481.386	2e-06	Neutral nitrogen compounds
4890	34	47	1	1	0	12	485.386	0.0	Neutral nitrogen compounds
4891	33	47	2	1	0	11	489.386	0.0	Neutral nitrogen compounds
4892	36	47	0	1	0	14	493.386	2e-06	Neutral nitrogen compounds
4893	35	47	1	1	0	13	497.386	0.0	Neutral nitrogen compounds
4894	34	47	2	1	0	12	501.386	0.0	Neutral nitrogen compounds
4895	37	47	0	1	0	15	505.386	2e-06	Neutral nitrogen compounds
4896	36	47	1	1	0	14	509.386	0.0	Neutral nitrogen compounds
4897	35	47	2	1	0	13	513.386	0.0	Neutral nitrogen compounds
4898	38	47	0	1	0	16	517.386	1e-06	Neutral nitrogen compounds
4899	36	47	2	1	0	14	525.386	0.0	Neutral nitrogen compounds
4900	39	47	0	1	0	17	529.386	1e-06	Neutral nitrogen compounds
4901	37	47	2	1	0	15	537.386	0.0	Neutral nitrogen compounds
4902	40	47	0	1	0	18	541.386	0.0	Neutral nitrogen compounds
4903	41	47	0	1	0	19	553.386	0.0	Neutral nitrogen compounds
4904	42	47	0	1	0	20	565.386	0.0	Neutral nitrogen compounds
4905	43	47	0	1	0	21	577.386	0.0	Neutral nitrogen compounds
4906	44	47	0	1	0	22	589.386	0.0	Neutral nitrogen compounds
4907	29	49	0	1	0	6	411.402	0.0	Neutral nitrogen compounds
4908	30	49	0	1	0	7	423.402	0.0	Neutral nitrogen compounds
4909	31	49	0	1	0	8	435.402	0.0	Neutral nitrogen compounds
4910	32	49	0	1	0	9	447.402	2e-06	Neutral nitrogen compounds
4911	33	49	0	1	0	10	459.402	2e-06	Neutral nitrogen compounds
4912	34	49	0	1	0	11	471.402	3e-06	Neutral nitrogen compounds
4913	32	49	2	1	0	9	479.402	0.0	Neutral nitrogen compounds
4914	35	49	0	1	0	12	483.402	3e-06	Neutral nitrogen compounds
4915	33	49	2	1	0	10	491.402	0.0	Neutral nitrogen compounds
4916	36	49	0	1	0	13	495.402	2e-06	Neutral nitrogen compounds
4917	34	49	2	1	0	11	503.402	0.0	Neutral nitrogen compounds
4918	37	49	0	1	0	14	507.402	2e-06	Neutral nitrogen compounds
4919	36	49	1	1	0	13	511.402	0.0	Neutral nitrogen compounds
4920	35	49	2	1	0	12	515.402	0.0	Neutral nitrogen compounds
4921	38	49	0	1	0	15	519.402	1e-06	Neutral nitrogen compounds
4922	37	49	1	1	0	14	523.402	0.0	Neutral nitrogen compounds
4923	36	49	2	1	0	13	527.402	0.0	Neutral nitrogen compounds
4924	39	49	0	1	0	16	531.402	1e-06	Neutral nitrogen compounds
4925	37	49	2	1	0	14	539.402	0.0	Neutral nitrogen compounds
4926	40	49	0	1	0	17	543.402	1e-06	Neutral nitrogen compounds
4927	38	49	2	1	0	15	551.402	0.0	Neutral nitrogen compounds
4928	41	49	0	1	0	18	555.402	0.0	Neutral nitrogen compounds
4929	42	49	0	1	0	19	567.402	0.0	Neutral nitrogen compounds
4930	43	49	0	1	0	20	579.402	0.0	Neutral nitrogen compounds
4931	44	49	0	1	0	21	591.402	0.0	Neutral nitrogen compounds
4932	30	51	0	1	0	6	425.418	0.0	Neutral nitrogen compounds
4933	31	51	0	1	0	7	437.418	0.0	Neutral nitrogen compounds
4934	32	51	0	1	0	8	449.418	0.0	Neutral nitrogen compounds
4935	33	51	0	1	0	9	461.418	2e-06	Neutral nitrogen compounds
4936	34	51	0	1	0	10	473.418	2e-06	Neutral nitrogen compounds
4937	35	51	0	1	0	11	485.418	2e-06	Neutral nitrogen compounds
4938	33	51	2	1	0	9	493.418	0.0	Neutral nitrogen compounds
4939	36	51	0	1	0	12	497.418	2e-06	Neutral nitrogen compounds
4940	34	51	2	1	0	10	505.418	0.0	Neutral nitrogen compounds
4941	37	51	0	1	0	13	509.418	2e-06	Neutral nitrogen compounds
4942	35	51	2	1	0	11	517.418	0.0	Neutral nitrogen compounds
4943	38	51	0	1	0	14	521.418	2e-06	Neutral nitrogen compounds
4944	37	51	1	1	0	13	525.418	0.0	Neutral nitrogen compounds
4945	36	51	2	1	0	12	529.418	0.0	Neutral nitrogen compounds
4946	39	51	0	1	0	15	533.418	1e-06	Neutral nitrogen compounds
4947	38	51	1	1	0	14	537.418	0.0	Neutral nitrogen compounds
4948	37	51	2	1	0	13	541.418	0.0	Neutral nitrogen compounds
4949	40	51	0	1	0	16	545.418	1e-06	Neutral nitrogen compounds
4950	38	51	2	1	0	14	553.418	0.0	Neutral nitrogen compounds
4951	41	51	0	1	0	17	557.418	1e-06	Neutral nitrogen compounds
4952	39	51	2	1	0	15	565.418	0.0	Neutral nitrogen compounds
4953	42	51	0	1	0	18	569.418	0.0	Neutral nitrogen compounds
4954	43	51	0	1	0	19	581.418	0.0	Neutral nitrogen compounds
4955	44	51	0	1	0	20	593.418	0.0	Neutral nitrogen compounds
4956	45	51	0	1	0	21	605.418	0.0	Neutral nitrogen compounds
4957	31	53	0	1	0	6	439.434	0.0	Neutral nitrogen compounds
4958	33	53	0	1	0	8	463.434	0.0	Neutral nitrogen compounds
4959	34	53	0	1	0	9	475.434	2e-06	Neutral nitrogen compounds
4960	35	53	0	1	0	10	487.434	2e-06	Neutral nitrogen compounds
4961	36	53	0	1	0	11	499.434	2e-06	Neutral nitrogen compounds
4962	34	53	2	1	0	9	507.434	0.0	Neutral nitrogen compounds
4963	37	53	0	1	0	12	511.434	2e-06	Neutral nitrogen compounds
4964	35	53	2	1	0	10	519.434	0.0	Neutral nitrogen compounds
4965	38	53	0	1	0	13	523.434	2e-06	Neutral nitrogen compounds
4966	36	53	2	1	0	11	531.434	0.0	Neutral nitrogen compounds
4967	39	53	0	1	0	14	535.434	1e-06	Neutral nitrogen compounds
4968	37	53	2	1	0	12	543.434	0.0	Neutral nitrogen compounds
4969	40	53	0	1	0	15	547.434	1e-06	Neutral nitrogen compounds
4970	38	53	2	1	0	13	555.434	0.0	Neutral nitrogen compounds
4971	41	53	0	1	0	16	559.434	1e-06	Neutral nitrogen compounds
4972	39	53	2	1	0	14	567.434	0.0	Neutral nitrogen compounds
4973	42	53	0	1	0	17	571.434	1e-06	Neutral nitrogen compounds
4974	40	53	2	1	0	15	579.434	0.0	Neutral nitrogen compounds
4975	43	53	0	1	0	18	583.434	0.0	Neutral nitrogen compounds
4976	44	53	0	1	0	19	595.434	0.0	Neutral nitrogen compounds
4977	45	53	0	1	0	20	607.434	0.0	Neutral nitrogen compounds
4978	46	53	0	1	0	21	619.434	0.0	Neutral nitrogen compounds
4979	49	53	0	1	0	24	655.434	0.0	Neutral nitrogen compounds
4980	32	55	0	1	0	6	453.45	0.0	Neutral nitrogen compounds
4981	33	55	0	1	0	7	465.45	0.0	Neutral nitrogen compounds
4982	34	55	0	1	0	8	477.45	0.0	Neutral nitrogen compounds
4983	35	55	0	1	0	9	489.45	1e-06	Neutral nitrogen compounds
4984	36	55	0	1	0	10	501.45	2e-06	Neutral nitrogen compounds
4985	37	55	0	1	0	11	513.45	2e-06	Neutral nitrogen compounds
4986	35	55	2	1	0	9	521.45	0.0	Neutral nitrogen compounds
4987	38	55	0	1	0	12	525.45	2e-06	Neutral nitrogen compounds
4988	36	55	2	1	0	10	533.45	0.0	Neutral nitrogen compounds
4989	39	55	0	1	0	13	537.45	2e-06	Neutral nitrogen compounds
4990	37	55	2	1	0	11	545.45	0.0	Neutral nitrogen compounds
4991	40	55	0	1	0	14	549.45	1e-06	Neutral nitrogen compounds
4992	38	55	2	1	0	12	557.45	0.0	Neutral nitrogen compounds
4993	41	55	0	1	0	15	561.45	1e-06	Neutral nitrogen compounds
4994	39	55	2	1	0	13	569.45	0.0	Neutral nitrogen compounds
4995	42	55	0	1	0	16	573.45	1e-06	Neutral nitrogen compounds
4996	40	55	2	1	0	14	581.45	0.0	Neutral nitrogen compounds
4997	43	55	0	1	0	17	585.45	0.0	Neutral nitrogen compounds
4998	44	55	0	1	0	18	597.45	0.0	Neutral nitrogen compounds
4999	45	55	0	1	0	19	609.45	0.0	Neutral nitrogen compounds
5000	46	55	0	1	0	20	621.45	0.0	Neutral nitrogen compounds
5001	49	55	0	1	0	23	657.45	0.0	Neutral nitrogen compounds
5002	35	57	0	1	0	8	491.466	0.0	Neutral nitrogen compounds
5003	36	57	0	1	0	9	503.466	2e-06	Neutral nitrogen compounds
5004	37	57	0	1	0	10	515.466	1e-06	Neutral nitrogen compounds
5005	38	57	0	1	0	11	527.466	2e-06	Neutral nitrogen compounds
5006	39	57	0	1	0	12	539.466	2e-06	Neutral nitrogen compounds
5007	37	57	2	1	0	10	547.466	0.0	Neutral nitrogen compounds
5008	40	57	0	1	0	13	551.466	1e-06	Neutral nitrogen compounds
5009	38	57	2	1	0	11	559.466	0.0	Neutral nitrogen compounds
5010	41	57	0	1	0	14	563.466	1e-06	Neutral nitrogen compounds
5011	39	57	2	1	0	12	571.466	0.0	Neutral nitrogen compounds
5012	42	57	0	1	0	15	575.466	1e-06	Neutral nitrogen compounds
5013	40	57	2	1	0	13	583.466	0.0	Neutral nitrogen compounds
5014	43	57	0	1	0	16	587.466	1e-06	Neutral nitrogen compounds
5015	41	57	2	1	0	14	595.466	0.0	Neutral nitrogen compounds
5016	44	57	0	1	0	17	599.466	0.0	Neutral nitrogen compounds
5017	45	57	0	1	0	18	611.466	0.0	Neutral nitrogen compounds
5018	46	57	0	1	0	19	623.466	0.0	Neutral nitrogen compounds
5019	47	57	0	1	0	20	635.466	0.0	Neutral nitrogen compounds
5020	48	57	0	1	0	21	647.466	0.0	Neutral nitrogen compounds
5021	35	59	0	1	0	7	493.482	0.0	Neutral nitrogen compounds
5022	36	59	0	1	0	8	505.482	0.0	Neutral nitrogen compounds
5023	37	59	0	1	0	9	517.482	1e-06	Neutral nitrogen compounds
5024	38	59	0	1	0	10	529.482	1e-06	Neutral nitrogen compounds
5025	39	59	0	1	0	11	541.482	1e-06	Neutral nitrogen compounds
5026	40	59	0	1	0	12	553.482	1e-06	Neutral nitrogen compounds
5027	38	59	2	1	0	10	561.482	0.0	Neutral nitrogen compounds
5028	41	59	0	1	0	13	565.482	1e-06	Neutral nitrogen compounds
5029	39	59	2	1	0	11	573.482	0.0	Neutral nitrogen compounds
5030	42	59	0	1	0	14	577.482	1e-06	Neutral nitrogen compounds
5031	40	59	2	1	0	12	585.482	0.0	Neutral nitrogen compounds
5032	43	59	0	1	0	15	589.482	1e-06	Neutral nitrogen compounds
5033	41	59	2	1	0	13	597.482	0.0	Neutral nitrogen compounds
5034	44	59	0	1	0	16	601.482	0.0	Neutral nitrogen compounds
5035	42	59	2	1	0	14	609.482	0.0	Neutral nitrogen compounds
5036	45	59	0	1	0	17	613.482	0.0	Neutral nitrogen compounds
5037	46	59	0	1	0	18	625.482	0.0	Neutral nitrogen compounds
5038	47	59	0	1	0	19	637.482	0.0	Neutral nitrogen compounds
5039	48	59	0	1	0	20	649.482	0.0	Neutral nitrogen compounds
5040	37	61	0	1	0	8	519.498	0.0	Neutral nitrogen compounds
5041	38	61	0	1	0	9	531.498	1e-06	Neutral nitrogen compounds
5042	39	61	0	1	0	10	543.498	1e-06	Neutral nitrogen compounds
5043	40	61	0	1	0	11	555.498	1e-06	Neutral nitrogen compounds
5044	41	61	0	1	0	12	567.498	1e-06	Neutral nitrogen compounds
5045	39	61	2	1	0	10	575.498	0.0	Neutral nitrogen compounds
5046	42	61	0	1	0	13	579.498	1e-06	Neutral nitrogen compounds
5047	40	61	2	1	0	11	587.498	0.0	Neutral nitrogen compounds
5048	43	61	0	1	0	14	591.498	1e-06	Neutral nitrogen compounds
5049	41	61	2	1	0	12	599.498	0.0	Neutral nitrogen compounds
5050	44	61	0	1	0	15	603.498	1e-06	Neutral nitrogen compounds
5051	42	61	2	1	0	13	611.498	0.0	Neutral nitrogen compounds
5052	45	61	0	1	0	16	615.498	0.0	Neutral nitrogen compounds
5053	43	61	2	1	0	14	623.498	0.0	Neutral nitrogen compounds
5054	46	61	0	1	0	17	627.498	0.0	Neutral nitrogen compounds
5055	47	61	0	1	0	18	639.498	0.0	Neutral nitrogen compounds
5056	48	61	0	1	0	19	651.498	0.0	Neutral nitrogen compounds
5057	49	61	0	1	0	20	663.498	0.0	Neutral nitrogen compounds
5058	38	63	0	1	0	8	533.514	0.0	Neutral nitrogen compounds
5059	39	63	0	1	0	9	545.514	1e-06	Neutral nitrogen compounds
5060	40	63	0	1	0	10	557.514	1e-06	Neutral nitrogen compounds
5061	41	63	0	1	0	11	569.514	1e-06	Neutral nitrogen compounds
5062	39	63	2	1	0	9	577.514	0.0	Neutral nitrogen compounds
5063	42	63	0	1	0	12	581.514	1e-06	Neutral nitrogen compounds
5064	40	63	2	1	0	10	589.514	0.0	Neutral nitrogen compounds
5065	43	63	0	1	0	13	593.514	1e-06	Neutral nitrogen compounds
5066	41	63	2	1	0	11	601.514	0.0	Neutral nitrogen compounds
5067	44	63	0	1	0	14	605.514	1e-06	Neutral nitrogen compounds
5068	42	63	2	1	0	12	613.514	0.0	Neutral nitrogen compounds
5069	45	63	0	1	0	15	617.514	1e-06	Neutral nitrogen compounds
5070	43	63	2	1	0	13	625.514	0.0	Neutral nitrogen compounds
5071	46	63	0	1	0	16	629.514	0.0	Neutral nitrogen compounds
5072	47	63	0	1	0	17	641.514	0.0	Neutral nitrogen compounds
5073	48	63	0	1	0	18	653.514	0.0	Neutral nitrogen compounds
5074	49	63	0	1	0	19	665.514	0.0	Neutral nitrogen compounds
5075	50	63	0	1	0	20	677.514	0.0	Neutral nitrogen compounds
5076	39	65	0	1	0	8	547.53	0.0	Neutral nitrogen compounds
5077	40	65	0	1	0	9	559.53	1e-06	Neutral nitrogen compounds
5078	41	65	0	1	0	10	571.53	1e-06	Neutral nitrogen compounds
5079	42	65	0	1	0	11	583.53	1e-06	Neutral nitrogen compounds
5080	40	65	2	1	0	9	591.53	0.0	Neutral nitrogen compounds
5081	43	65	0	1	0	12	595.53	1e-06	Neutral nitrogen compounds
5082	44	65	0	1	0	13	607.53	1e-06	Neutral nitrogen compounds
5083	42	65	2	1	0	11	615.53	0.0	Neutral nitrogen compounds
5084	45	65	0	1	0	14	619.53	1e-06	Neutral nitrogen compounds
5085	43	65	2	1	0	12	627.53	0.0	Neutral nitrogen compounds
5086	46	65	0	1	0	15	631.53	1e-06	Neutral nitrogen compounds
5087	44	65	2	1	0	13	639.53	0.0	Neutral nitrogen compounds
5088	47	65	0	1	0	16	643.53	0.0	Neutral nitrogen compounds
5089	45	65	2	1	0	14	651.53	0.0	Neutral nitrogen compounds
5090	48	65	0	1	0	17	655.53	0.0	Neutral nitrogen compounds
5091	46	65	2	1	0	15	663.53	0.0	Neutral nitrogen compounds
5092	49	65	0	1	0	18	667.53	0.0	Neutral nitrogen compounds
5093	50	65	0	1	0	19	679.53	0.0	Neutral nitrogen compounds
5094	40	67	0	1	0	8	561.546	0.0	Neutral nitrogen compounds
5095	41	67	0	1	0	9	573.546	1e-06	Neutral nitrogen compounds
5096	42	67	0	1	0	10	585.546	1e-06	Neutral nitrogen compounds
5097	43	67	0	1	0	11	597.546	0.0	Neutral nitrogen compounds
5098	44	67	0	1	0	12	609.546	1e-06	Neutral nitrogen compounds
5099	45	67	0	1	0	13	621.546	0.0	Neutral nitrogen compounds
5100	43	67	2	1	0	11	629.546	0.0	Neutral nitrogen compounds
5101	46	67	0	1	0	14	633.546	1e-06	Neutral nitrogen compounds
5102	44	67	2	1	0	12	641.546	0.0	Neutral nitrogen compounds
5103	47	67	0	1	0	15	645.546	0.0	Neutral nitrogen compounds
5104	45	67	2	1	0	13	653.546	0.0	Neutral nitrogen compounds
5105	48	67	0	1	0	16	657.546	0.0	Neutral nitrogen compounds
5106	49	67	0	1	0	17	669.546	0.0	Neutral nitrogen compounds
5107	50	67	0	1	0	18	681.546	0.0	Neutral nitrogen compounds
5108	42	69	0	1	0	9	587.562	1e-06	Neutral nitrogen compounds
5109	43	69	0	1	0	10	599.562	0.0	Neutral nitrogen compounds
5110	44	69	0	1	0	11	611.562	1e-06	Neutral nitrogen compounds
5111	45	69	0	1	0	12	623.562	1e-06	Neutral nitrogen compounds
5112	46	69	0	1	0	13	635.562	1e-06	Neutral nitrogen compounds
5113	44	69	2	1	0	11	643.562	0.0	Neutral nitrogen compounds
5114	47	69	0	1	0	14	647.562	0.0	Neutral nitrogen compounds
5115	45	69	2	1	0	12	655.562	0.0	Neutral nitrogen compounds
5116	48	69	0	1	0	15	659.562	0.0	Neutral nitrogen compounds
5117	49	69	0	1	0	16	671.562	0.0	Neutral nitrogen compounds
5118	50	69	0	1	0	17	683.562	0.0	Neutral nitrogen compounds
5119	51	69	0	1	0	18	695.562	0.0	Neutral nitrogen compounds
5120	42	71	0	1	0	8	589.578	0.0	Neutral nitrogen compounds
5121	43	71	0	1	0	9	601.578	0.0	Neutral nitrogen compounds
5122	44	71	0	1	0	10	613.578	0.0	Neutral nitrogen compounds
5123	45	71	0	1	0	11	625.578	0.0	Neutral nitrogen compounds
5124	46	71	0	1	0	12	637.578	0.0	Neutral nitrogen compounds
5125	47	71	0	1	0	13	649.578	0.0	Neutral nitrogen compounds
5126	48	71	0	1	0	14	661.578	0.0	Neutral nitrogen compounds
5127	46	71	2	1	0	12	669.578	0.0	Neutral nitrogen compounds
5128	49	71	0	1	0	15	673.578	0.0	Neutral nitrogen compounds
5129	50	71	0	1	0	16	685.578	0.0	Neutral nitrogen compounds
5130	51	71	0	1	0	17	697.578	0.0	Neutral nitrogen compounds
5131	52	71	0	1	0	18	709.578	0.0	Neutral nitrogen compounds
5132	44	73	0	1	0	9	615.594	0.0	Neutral nitrogen compounds
5133	45	73	0	1	0	10	627.594	0.0	Neutral nitrogen compounds
5134	46	73	0	1	0	11	639.594	0.0	Neutral nitrogen compounds
5135	47	73	0	1	0	12	651.594	0.0	Neutral nitrogen compounds
5136	48	73	0	1	0	13	663.594	0.0	Neutral nitrogen compounds
5137	49	73	0	1	0	14	675.594	0.0	Neutral nitrogen compounds
5138	50	73	0	1	0	15	687.594	0.0	Neutral nitrogen compounds
5139	51	73	0	1	0	16	699.594	0.0	Neutral nitrogen compounds
5140	52	73	0	1	0	17	711.594	0.0	Neutral nitrogen compounds
5141	53	73	0	1	0	18	723.594	0.0	Neutral nitrogen compounds
5142	45	75	0	1	0	9	629.61	0.0	Neutral nitrogen compounds
5143	46	75	0	1	0	10	641.61	0.0	Neutral nitrogen compounds
5144	47	75	0	1	0	11	653.61	0.0	Neutral nitrogen compounds
5145	48	75	0	1	0	12	665.61	0.0	Neutral nitrogen compounds
5146	49	75	0	1	0	13	677.61	0.0	Neutral nitrogen compounds
5147	50	75	0	1	0	14	689.61	0.0	Neutral nitrogen compounds
5148	51	75	0	1	0	15	701.61	0.0	Neutral nitrogen compounds
5149	52	75	0	1	0	16	713.61	0.0	Neutral nitrogen compounds
5150	53	75	0	1	0	17	725.61	0.0	Neutral nitrogen compounds
5151	46	77	0	1	0	9	643.626	0.0	Neutral nitrogen compounds
5152	47	77	0	1	0	10	655.626	0.0	Neutral nitrogen compounds
5153	48	77	0	1	0	11	667.626	0.0	Neutral nitrogen compounds
5154	49	77	0	1	0	12	679.626	0.0	Neutral nitrogen compounds
5155	50	77	0	1	0	13	691.626	0.0	Neutral nitrogen compounds
5156	51	77	0	1	0	14	703.626	0.0	Neutral nitrogen compounds
5157	52	77	0	1	0	15	715.626	0.0	Neutral nitrogen compounds
5158	54	77	0	1	0	17	739.626	0.0	Neutral nitrogen compounds
5159	47	79	0	1	0	9	657.642	0.0	Neutral nitrogen compounds
5160	48	79	0	1	0	10	669.642	0.0	Neutral nitrogen compounds
5161	49	79	0	1	0	11	681.642	0.0	Neutral nitrogen compounds
5162	50	79	0	1	0	12	693.642	0.0	Neutral nitrogen compounds
5163	51	79	0	1	0	13	705.642	0.0	Neutral nitrogen compounds
5164	52	79	0	1	0	14	717.642	0.0	Neutral nitrogen compounds
5165	53	79	0	1	0	15	729.642	0.0	Neutral nitrogen compounds
5166	48	81	0	1	0	9	671.658	0.0	Neutral nitrogen compounds
5167	49	81	0	1	0	10	683.658	0.0	Neutral nitrogen compounds
5168	50	81	0	1	0	11	695.658	0.0	Neutral nitrogen compounds
5169	51	81	0	1	0	12	707.658	0.0	Neutral nitrogen compounds
5170	52	81	0	1	0	13	719.658	0.0	Neutral nitrogen compounds
5171	53	81	0	1	0	14	731.658	0.0	Neutral nitrogen compounds
5172	54	81	0	1	0	15	743.658	0.0	Neutral nitrogen compounds
5173	49	83	0	1	0	9	685.674	0.0	Neutral nitrogen compounds
5174	50	83	0	1	0	10	697.674	0.0	Neutral nitrogen compounds
5175	51	83	0	1	0	11	709.674	0.0	Neutral nitrogen compounds
5176	52	83	0	1	0	12	721.674	0.0	Neutral nitrogen compounds
5177	53	83	0	1	0	13	733.674	0.0	Neutral nitrogen compounds
5178	54	83	0	1	0	14	745.674	0.0	Neutral nitrogen compounds
5179	55	83	0	1	0	15	757.674	0.0	Neutral nitrogen compounds
5180	51	85	0	1	0	10	711.69	0.0	Neutral nitrogen compounds
5181	52	85	0	1	0	11	723.69	0.0	Neutral nitrogen compounds
5182	53	85	0	1	0	12	735.69	0.0	Neutral nitrogen compounds
5183	54	85	0	1	0	13	747.69	0.0	Neutral nitrogen compounds
5184	51	87	0	1	0	9	713.706	0.0	Neutral nitrogen compounds
5185	52	87	0	1	0	10	725.706	0.0	Neutral nitrogen compounds
5186	53	87	0	1	0	11	737.706	0.0	Neutral nitrogen compounds
5187	54	87	0	1	0	12	749.706	0.0	Neutral nitrogen compounds
5188	57	91	0	1	0	13	789.738	0.0	Neutral nitrogen compounds
5189	69	123	0	1	0	9	965.994	0.0	Neutral nitrogen compounds
5190	68	127	0	1	0	6	958.026	1e-06	Neutral nitrogen compounds
5191	12	13	0	1	0	7	171.114	0.0	Basic nitrogen compounds
5192	13	13	0	1	0	8	183.114	0.0	Basic nitrogen compounds
5193	14	13	0	1	0	9	195.114	0.0	Basic nitrogen compounds
5194	15	13	0	1	0	10	207.114	2e-06	Basic nitrogen compounds
5195	16	13	0	1	0	11	219.114	0.0	Basic nitrogen compounds
5196	17	13	0	1	0	12	231.114	0.0	Basic nitrogen compounds
5197	18	13	0	1	0	13	243.114	0.0	Basic nitrogen compounds
5198	19	13	0	1	0	14	255.114	0.0	Basic nitrogen compounds
5199	20	13	0	1	0	15	267.114	0.0	Basic nitrogen compounds
5200	50	13	0	1	0	45	627.114	0.0	Basic nitrogen compounds
5201	13	15	0	1	0	7	185.13	1e-06	Basic nitrogen compounds
5202	14	15	0	1	0	8	197.13	0.0	Basic nitrogen compounds
5203	15	15	0	1	0	9	209.13	0.0	Basic nitrogen compounds
5204	16	15	0	1	0	10	221.13	3e-06	Basic nitrogen compounds
5205	17	15	0	1	0	11	233.13	0.0	Basic nitrogen compounds
5206	18	15	0	1	0	12	245.13	1e-06	Basic nitrogen compounds
5207	19	15	0	1	0	13	257.13	1e-06	Basic nitrogen compounds
5208	20	15	0	1	0	14	269.13	0.0	Basic nitrogen compounds
5209	21	15	0	1	0	15	281.13	0.0	Basic nitrogen compounds
5210	22	15	0	1	0	16	293.13	0.0	Basic nitrogen compounds
5211	23	15	0	1	0	17	305.13	0.0	Basic nitrogen compounds
5212	24	15	0	1	0	18	317.13	0.0	Basic nitrogen compounds
5213	52	15	0	1	0	46	653.13	0.0	Basic nitrogen compounds
5214	12	17	0	1	0	5	175.146	0.0	Basic nitrogen compounds
5215	13	17	0	1	0	6	187.146	0.0	Basic nitrogen compounds
5216	14	17	0	1	0	7	199.146	0.0	Basic nitrogen compounds
5217	15	17	0	1	0	8	211.146	0.0	Basic nitrogen compounds
5218	16	17	0	1	0	9	223.146	0.0	Basic nitrogen compounds
5219	17	17	0	1	0	10	235.146	2e-06	Basic nitrogen compounds
5220	18	17	0	1	0	11	247.146	2e-06	Basic nitrogen compounds
5221	19	17	0	1	0	12	259.146	2e-06	Basic nitrogen compounds
5222	20	17	0	1	0	13	271.146	1e-06	Basic nitrogen compounds
5223	21	17	0	1	0	14	283.146	1e-06	Basic nitrogen compounds
5224	22	17	0	1	0	15	295.146	1e-06	Basic nitrogen compounds
5225	23	17	0	1	0	16	307.146	0.0	Basic nitrogen compounds
5226	24	17	0	1	0	17	319.146	0.0	Basic nitrogen compounds
5227	25	17	0	1	0	18	331.146	0.0	Basic nitrogen compounds
5228	26	17	0	1	0	19	343.146	0.0	Basic nitrogen compounds
5229	27	17	0	1	0	20	355.146	0.0	Basic nitrogen compounds
5230	52	17	0	1	0	45	655.146	0.0	Basic nitrogen compounds
5231	12	19	0	1	0	4	177.162	0.0	Basic nitrogen compounds
5232	13	19	0	1	0	5	189.162	0.0	Basic nitrogen compounds
5233	14	19	0	1	0	6	201.162	0.0	Basic nitrogen compounds
5234	15	19	0	1	0	7	213.162	0.0	Basic nitrogen compounds
5235	16	19	0	1	0	8	225.162	1e-06	Basic nitrogen compounds
5236	17	19	0	1	0	9	237.162	1e-06	Basic nitrogen compounds
5237	18	19	0	1	0	10	249.162	1e-06	Basic nitrogen compounds
5238	19	19	0	1	0	11	261.162	2e-06	Basic nitrogen compounds
5239	20	19	0	1	0	12	273.162	3e-06	Basic nitrogen compounds
5240	21	19	0	1	0	13	285.162	1e-06	Basic nitrogen compounds
5241	22	19	0	1	0	14	297.162	1e-06	Basic nitrogen compounds
5242	23	19	0	1	0	15	309.162	1e-06	Basic nitrogen compounds
5243	24	19	0	1	0	16	321.162	1e-06	Basic nitrogen compounds
5244	25	19	0	1	0	17	333.162	0.0	Basic nitrogen compounds
5245	26	19	0	1	0	18	345.162	0.0	Basic nitrogen compounds
5246	27	19	0	1	0	19	357.162	0.0	Basic nitrogen compounds
5247	28	19	0	1	0	20	369.162	0.0	Basic nitrogen compounds
5248	29	19	0	1	0	21	381.162	0.0	Basic nitrogen compounds
5249	31	19	0	1	0	23	405.162	0.0	Basic nitrogen compounds
5250	13	21	0	1	0	4	191.178	0.0	Basic nitrogen compounds
5251	14	21	0	1	0	5	203.178	0.0	Basic nitrogen compounds
5252	15	21	0	1	0	6	215.178	0.0	Basic nitrogen compounds
5253	16	21	0	1	0	7	227.178	0.0	Basic nitrogen compounds
5254	17	21	0	1	0	8	239.178	1e-06	Basic nitrogen compounds
5255	18	21	0	1	0	9	251.178	4e-06	Basic nitrogen compounds
5256	19	21	0	1	0	10	263.178	2e-06	Basic nitrogen compounds
5257	20	21	0	1	0	11	275.178	2e-06	Basic nitrogen compounds
5258	21	21	0	1	0	12	287.178	4e-06	Basic nitrogen compounds
5259	22	21	0	1	0	13	299.178	1e-06	Basic nitrogen compounds
5260	23	21	0	1	0	14	311.178	1e-06	Basic nitrogen compounds
5261	24	21	0	1	0	15	323.178	1e-06	Basic nitrogen compounds
5262	25	21	0	1	0	16	335.178	1e-06	Basic nitrogen compounds
5263	26	21	0	1	0	17	347.178	0.0	Basic nitrogen compounds
5264	27	21	0	1	0	18	359.178	0.0	Basic nitrogen compounds
5265	28	21	0	1	0	19	371.178	0.0	Basic nitrogen compounds
5266	29	21	0	1	0	20	383.178	0.0	Basic nitrogen compounds
5267	30	21	0	1	0	21	395.178	0.0	Basic nitrogen compounds
5268	31	21	0	1	0	22	407.178	0.0	Basic nitrogen compounds
5269	32	21	0	1	0	23	419.178	0.0	Basic nitrogen compounds
5270	14	23	0	1	0	4	205.194	0.0	Basic nitrogen compounds
5271	15	23	0	1	0	5	217.194	0.0	Basic nitrogen compounds
5272	16	23	0	1	0	6	229.194	1e-06	Basic nitrogen compounds
5273	17	23	0	1	0	7	241.194	1e-06	Basic nitrogen compounds
5274	18	23	0	1	0	8	253.194	1e-06	Basic nitrogen compounds
5275	19	23	0	1	0	9	265.194	5e-06	Basic nitrogen compounds
5276	20	23	0	1	0	10	277.194	4e-06	Basic nitrogen compounds
5277	21	23	0	1	0	11	289.194	3e-06	Basic nitrogen compounds
5278	22	23	0	1	0	12	301.194	5e-06	Basic nitrogen compounds
5279	23	23	0	1	0	13	313.194	2e-06	Basic nitrogen compounds
5280	24	23	0	1	0	14	325.194	1e-06	Basic nitrogen compounds
5281	25	23	0	1	0	15	337.194	1e-06	Basic nitrogen compounds
5282	26	23	0	1	0	16	349.194	1e-06	Basic nitrogen compounds
5283	27	23	0	1	0	17	361.194	0.0	Basic nitrogen compounds
5284	28	23	0	1	0	18	373.194	0.0	Basic nitrogen compounds
5285	29	23	0	1	0	19	385.194	0.0	Basic nitrogen compounds
5286	30	23	0	1	0	20	397.194	0.0	Basic nitrogen compounds
5287	31	23	0	1	0	21	409.194	0.0	Basic nitrogen compounds
5288	32	23	0	1	0	22	421.194	0.0	Basic nitrogen compounds
5289	33	23	0	1	0	23	433.194	0.0	Basic nitrogen compounds
5290	15	25	0	1	0	4	219.21	0.0	Basic nitrogen compounds
5291	16	25	0	1	0	5	231.21	3e-06	Basic nitrogen compounds
5292	17	25	0	1	0	6	243.21	1e-06	Basic nitrogen compounds
5293	18	25	0	1	0	7	255.21	2e-06	Basic nitrogen compounds
5294	19	25	0	1	0	8	267.21	1e-06	Basic nitrogen compounds
5295	20	25	0	1	0	9	279.21	6e-06	Basic nitrogen compounds
5296	21	25	0	1	0	10	291.21	6e-06	Basic nitrogen compounds
5297	22	25	0	1	0	11	303.21	3e-06	Basic nitrogen compounds
5298	23	25	0	1	0	12	315.21	5e-06	Basic nitrogen compounds
5299	24	25	0	1	0	13	327.21	3e-06	Basic nitrogen compounds
5300	25	25	0	1	0	14	339.21	2e-06	Basic nitrogen compounds
5301	26	25	0	1	0	15	351.21	1e-06	Basic nitrogen compounds
5302	27	25	0	1	0	16	363.21	1e-06	Basic nitrogen compounds
5303	28	25	0	1	0	17	375.21	1e-06	Basic nitrogen compounds
5304	29	25	0	1	0	18	387.21	0.0	Basic nitrogen compounds
5305	30	25	0	1	0	19	399.21	0.0	Basic nitrogen compounds
5306	31	25	0	1	0	20	411.21	0.0	Basic nitrogen compounds
5307	32	25	0	1	0	21	423.21	0.0	Basic nitrogen compounds
5308	33	25	0	1	0	22	435.21	0.0	Basic nitrogen compounds
5309	16	27	0	1	0	4	233.226	0.0	Basic nitrogen compounds
5310	17	27	0	1	0	5	245.226	2e-06	Basic nitrogen compounds
5311	18	27	0	1	0	6	257.226	2e-06	Basic nitrogen compounds
5312	19	27	0	1	0	7	269.226	3e-06	Basic nitrogen compounds
5313	20	27	0	1	0	8	281.226	2e-06	Basic nitrogen compounds
5314	21	27	0	1	0	9	293.226	5e-06	Basic nitrogen compounds
5315	22	27	0	1	0	10	305.226	7e-06	Basic nitrogen compounds
5316	23	27	0	1	0	11	317.226	5e-06	Basic nitrogen compounds
5317	24	27	0	1	0	12	329.226	5e-06	Basic nitrogen compounds
5318	25	27	0	1	0	13	341.226	4e-06	Basic nitrogen compounds
5319	26	27	0	1	0	14	353.226	2e-06	Basic nitrogen compounds
5320	27	27	0	1	0	15	365.226	1e-06	Basic nitrogen compounds
5321	28	27	0	1	0	16	377.226	1e-06	Basic nitrogen compounds
5322	29	27	0	1	0	17	389.226	1e-06	Basic nitrogen compounds
5323	30	27	0	1	0	18	401.226	0.0	Basic nitrogen compounds
5324	31	27	0	1	0	19	413.226	0.0	Basic nitrogen compounds
5325	32	27	0	1	0	20	425.226	0.0	Basic nitrogen compounds
5326	33	27	0	1	0	21	437.226	0.0	Basic nitrogen compounds
5327	34	27	0	1	0	22	449.226	0.0	Basic nitrogen compounds
5328	35	27	0	1	0	23	461.226	0.0	Basic nitrogen compounds
5329	17	29	0	1	0	4	247.242	0.0	Basic nitrogen compounds
5330	18	29	0	1	0	5	259.242	1e-06	Basic nitrogen compounds
5331	19	29	0	1	0	6	271.242	2e-06	Basic nitrogen compounds
5332	20	29	0	1	0	7	283.242	4e-06	Basic nitrogen compounds
5333	21	29	0	1	0	8	295.242	4e-06	Basic nitrogen compounds
5334	22	29	0	1	0	9	307.242	4e-06	Basic nitrogen compounds
5335	23	29	0	1	0	10	319.242	7e-06	Basic nitrogen compounds
5336	24	29	0	1	0	11	331.242	6e-06	Basic nitrogen compounds
5337	25	29	0	1	0	12	343.242	6e-06	Basic nitrogen compounds
5338	26	29	0	1	0	13	355.242	4e-06	Basic nitrogen compounds
5339	27	29	0	1	0	14	367.242	2e-06	Basic nitrogen compounds
5340	28	29	0	1	0	15	379.242	2e-06	Basic nitrogen compounds
5341	29	29	0	1	0	16	391.242	1e-06	Basic nitrogen compounds
5342	30	29	0	1	0	17	403.242	1e-06	Basic nitrogen compounds
5343	31	29	0	1	0	18	415.242	1e-06	Basic nitrogen compounds
5344	32	29	0	1	0	19	427.242	0.0	Basic nitrogen compounds
5345	33	29	0	1	0	20	439.242	0.0	Basic nitrogen compounds
5346	34	29	0	1	0	21	451.242	0.0	Basic nitrogen compounds
5347	35	29	0	1	0	22	463.242	0.0	Basic nitrogen compounds
5348	18	31	0	1	0	4	261.258	0.0	Basic nitrogen compounds
5349	19	31	0	1	0	5	273.258	1e-06	Basic nitrogen compounds
5350	20	31	0	1	0	6	285.258	3e-06	Basic nitrogen compounds
5351	21	31	0	1	0	7	297.258	4e-06	Basic nitrogen compounds
5352	22	31	0	1	0	8	309.258	4e-06	Basic nitrogen compounds
5353	23	31	0	1	0	9	321.258	5e-06	Basic nitrogen compounds
5354	24	31	0	1	0	10	333.258	7e-06	Basic nitrogen compounds
5355	25	31	0	1	0	11	345.258	7e-06	Basic nitrogen compounds
5356	26	31	0	1	0	12	357.258	6e-06	Basic nitrogen compounds
5357	27	31	0	1	0	13	369.258	4e-06	Basic nitrogen compounds
5358	28	31	0	1	0	14	381.258	2e-06	Basic nitrogen compounds
5359	29	31	0	1	0	15	393.258	2e-06	Basic nitrogen compounds
5360	30	31	0	1	0	16	405.258	1e-06	Basic nitrogen compounds
5361	31	31	0	1	0	17	417.258	1e-06	Basic nitrogen compounds
5362	32	31	0	1	0	18	429.258	1e-06	Basic nitrogen compounds
5363	33	31	0	1	0	19	441.258	0.0	Basic nitrogen compounds
5364	34	31	0	1	0	20	453.258	0.0	Basic nitrogen compounds
5365	35	31	0	1	0	21	465.258	0.0	Basic nitrogen compounds
5366	36	31	0	1	0	22	477.258	0.0	Basic nitrogen compounds
5367	37	31	0	1	0	23	489.258	0.0	Basic nitrogen compounds
5368	19	33	0	1	0	4	275.274	0.0	Basic nitrogen compounds
5369	20	33	0	1	0	5	287.274	1e-06	Basic nitrogen compounds
5370	21	33	0	1	0	6	299.274	3e-06	Basic nitrogen compounds
5371	22	33	0	1	0	7	311.274	4e-06	Basic nitrogen compounds
5372	23	33	0	1	0	8	323.274	5e-06	Basic nitrogen compounds
5373	24	33	0	1	0	9	335.274	6e-06	Basic nitrogen compounds
5374	25	33	0	1	0	10	347.274	7e-06	Basic nitrogen compounds
5375	26	33	0	1	0	11	359.274	6e-06	Basic nitrogen compounds
5376	27	33	0	1	0	12	371.274	5e-06	Basic nitrogen compounds
5377	28	33	0	1	0	13	383.274	3e-06	Basic nitrogen compounds
5378	29	33	0	1	0	14	395.274	3e-06	Basic nitrogen compounds
5379	30	33	0	1	0	15	407.274	2e-06	Basic nitrogen compounds
5380	31	33	0	1	0	16	419.274	1e-06	Basic nitrogen compounds
5381	32	33	0	1	0	17	431.274	1e-06	Basic nitrogen compounds
5382	33	33	0	1	0	18	443.274	1e-06	Basic nitrogen compounds
5383	34	33	0	1	0	19	455.274	0.0	Basic nitrogen compounds
5384	35	33	0	1	0	20	467.274	0.0	Basic nitrogen compounds
5385	36	33	0	1	0	21	479.274	0.0	Basic nitrogen compounds
5386	37	33	0	1	0	22	491.274	0.0	Basic nitrogen compounds
5387	38	33	0	1	0	23	503.274	0.0	Basic nitrogen compounds
5388	20	35	0	1	0	4	289.29	0.0	Basic nitrogen compounds
5389	21	35	0	1	0	5	301.29	1e-06	Basic nitrogen compounds
5390	22	35	0	1	0	6	313.29	3e-06	Basic nitrogen compounds
5391	23	35	0	1	0	7	325.29	4e-06	Basic nitrogen compounds
5392	24	35	0	1	0	8	337.29	5e-06	Basic nitrogen compounds
5393	25	35	0	1	0	9	349.29	6e-06	Basic nitrogen compounds
5394	26	35	0	1	0	10	361.29	5e-06	Basic nitrogen compounds
5395	27	35	0	1	0	11	373.29	5e-06	Basic nitrogen compounds
5396	28	35	0	1	0	12	385.29	5e-06	Basic nitrogen compounds
5397	29	35	0	1	0	13	397.29	4e-06	Basic nitrogen compounds
5398	30	35	0	1	0	14	409.29	3e-06	Basic nitrogen compounds
5399	31	35	0	1	0	15	421.29	2e-06	Basic nitrogen compounds
5400	32	35	0	1	0	16	433.29	1e-06	Basic nitrogen compounds
5401	33	35	0	1	0	17	445.29	1e-06	Basic nitrogen compounds
5402	34	35	0	1	0	18	457.29	1e-06	Basic nitrogen compounds
5403	35	35	0	1	0	19	469.29	0.0	Basic nitrogen compounds
5404	36	35	0	1	0	20	481.29	0.0	Basic nitrogen compounds
5405	37	35	0	1	0	21	493.29	0.0	Basic nitrogen compounds
5406	38	35	0	1	0	22	505.29	0.0	Basic nitrogen compounds
5407	39	35	0	1	0	23	517.29	0.0	Basic nitrogen compounds
5408	21	37	0	1	0	4	303.306	0.0	Basic nitrogen compounds
5409	22	37	0	1	0	5	315.306	1e-06	Basic nitrogen compounds
5410	23	37	0	1	0	6	327.306	3e-06	Basic nitrogen compounds
5411	24	37	0	1	0	7	339.306	5e-06	Basic nitrogen compounds
5412	25	37	0	1	0	8	351.306	5e-06	Basic nitrogen compounds
5413	26	37	0	1	0	9	363.306	5e-06	Basic nitrogen compounds
5414	27	37	0	1	0	10	375.306	5e-06	Basic nitrogen compounds
5415	28	37	0	1	0	11	387.306	5e-06	Basic nitrogen compounds
5416	29	37	0	1	0	12	399.306	5e-06	Basic nitrogen compounds
5417	30	37	0	1	0	13	411.306	4e-06	Basic nitrogen compounds
5418	31	37	0	1	0	14	423.306	3e-06	Basic nitrogen compounds
5419	32	37	0	1	0	15	435.306	2e-06	Basic nitrogen compounds
5420	33	37	0	1	0	16	447.306	1e-06	Basic nitrogen compounds
5421	34	37	0	1	0	17	459.306	1e-06	Basic nitrogen compounds
5422	35	37	0	1	0	18	471.306	1e-06	Basic nitrogen compounds
5423	36	37	0	1	0	19	483.306	0.0	Basic nitrogen compounds
5424	37	37	0	1	0	20	495.306	0.0	Basic nitrogen compounds
5425	38	37	0	1	0	21	507.306	0.0	Basic nitrogen compounds
5426	39	37	0	1	0	22	519.306	0.0	Basic nitrogen compounds
5427	40	37	0	1	0	23	531.306	0.0	Basic nitrogen compounds
5428	64	37	0	1	0	47	819.306	0.0	Basic nitrogen compounds
5429	66	37	0	1	0	49	843.306	0.0	Basic nitrogen compounds
5430	22	39	0	1	0	4	317.322	0.0	Basic nitrogen compounds
5431	23	39	0	1	0	5	329.322	1e-06	Basic nitrogen compounds
5432	24	39	0	1	0	6	341.322	3e-06	Basic nitrogen compounds
5433	25	39	0	1	0	7	353.322	4e-06	Basic nitrogen compounds
5434	26	39	0	1	0	8	365.322	4e-06	Basic nitrogen compounds
5435	27	39	0	1	0	9	377.322	5e-06	Basic nitrogen compounds
5436	28	39	0	1	0	10	389.322	5e-06	Basic nitrogen compounds
5437	29	39	0	1	0	11	401.322	4e-06	Basic nitrogen compounds
5438	30	39	0	1	0	12	413.322	5e-06	Basic nitrogen compounds
5439	31	39	0	1	0	13	425.322	3e-06	Basic nitrogen compounds
5440	32	39	0	1	0	14	437.322	2e-06	Basic nitrogen compounds
5441	33	39	0	1	0	15	449.322	2e-06	Basic nitrogen compounds
5442	34	39	0	1	0	16	461.322	1e-06	Basic nitrogen compounds
5443	35	39	0	1	0	17	473.322	1e-06	Basic nitrogen compounds
5444	36	39	0	1	0	18	485.322	0.0	Basic nitrogen compounds
5445	37	39	0	1	0	19	497.322	0.0	Basic nitrogen compounds
5446	38	39	0	1	0	20	509.322	0.0	Basic nitrogen compounds
5447	39	39	0	1	0	21	521.322	0.0	Basic nitrogen compounds
5448	40	39	0	1	0	22	533.322	0.0	Basic nitrogen compounds
5449	63	39	0	1	0	45	809.322	0.0	Basic nitrogen compounds
5450	23	41	0	1	0	4	331.338	0.0	Basic nitrogen compounds
5451	24	41	0	1	0	5	343.338	1e-06	Basic nitrogen compounds
5452	25	41	0	1	0	6	355.338	2e-06	Basic nitrogen compounds
5453	26	41	0	1	0	7	367.338	4e-06	Basic nitrogen compounds
5454	27	41	0	1	0	8	379.338	4e-06	Basic nitrogen compounds
5455	28	41	0	1	0	9	391.338	5e-06	Basic nitrogen compounds
5456	29	41	0	1	0	10	403.338	5e-06	Basic nitrogen compounds
5457	30	41	0	1	0	11	415.338	5e-06	Basic nitrogen compounds
5458	31	41	0	1	0	12	427.338	4e-06	Basic nitrogen compounds
5459	32	41	0	1	0	13	439.338	3e-06	Basic nitrogen compounds
5460	33	41	0	1	0	14	451.338	2e-06	Basic nitrogen compounds
5461	34	41	0	1	0	15	463.338	1e-06	Basic nitrogen compounds
5462	35	41	0	1	0	16	475.338	1e-06	Basic nitrogen compounds
5463	36	41	0	1	0	17	487.338	1e-06	Basic nitrogen compounds
5464	37	41	0	1	0	18	499.338	1e-06	Basic nitrogen compounds
5465	38	41	0	1	0	19	511.338	0.0	Basic nitrogen compounds
5466	39	41	0	1	0	20	523.338	0.0	Basic nitrogen compounds
5467	40	41	0	1	0	21	535.338	0.0	Basic nitrogen compounds
5468	41	41	0	1	0	22	547.338	0.0	Basic nitrogen compounds
5469	42	41	0	1	0	23	559.338	0.0	Basic nitrogen compounds
5470	24	43	0	1	0	4	345.354	0.0	Basic nitrogen compounds
5471	25	43	0	1	0	5	357.354	1e-06	Basic nitrogen compounds
5472	26	43	0	1	0	6	369.354	2e-06	Basic nitrogen compounds
5473	27	43	0	1	0	7	381.354	3e-06	Basic nitrogen compounds
5474	28	43	0	1	0	8	393.354	4e-06	Basic nitrogen compounds
5475	29	43	0	1	0	9	405.354	5e-06	Basic nitrogen compounds
5476	30	43	0	1	0	10	417.354	4e-06	Basic nitrogen compounds
5477	31	43	0	1	0	11	429.354	4e-06	Basic nitrogen compounds
5478	32	43	0	1	0	12	441.354	3e-06	Basic nitrogen compounds
5479	33	43	0	1	0	13	453.354	2e-06	Basic nitrogen compounds
5480	34	43	0	1	0	14	465.354	2e-06	Basic nitrogen compounds
5481	35	43	0	1	0	15	477.354	1e-06	Basic nitrogen compounds
5482	36	43	0	1	0	16	489.354	1e-06	Basic nitrogen compounds
5483	37	43	0	1	0	17	501.354	1e-06	Basic nitrogen compounds
5484	38	43	0	1	0	18	513.354	1e-06	Basic nitrogen compounds
5485	39	43	0	1	0	19	525.354	0.0	Basic nitrogen compounds
5486	40	43	0	1	0	20	537.354	0.0	Basic nitrogen compounds
5487	41	43	0	1	0	21	549.354	0.0	Basic nitrogen compounds
5488	42	43	0	1	0	22	561.354	0.0	Basic nitrogen compounds
5489	43	43	0	1	0	23	573.354	0.0	Basic nitrogen compounds
5490	66	43	0	1	0	46	849.354	0.0	Basic nitrogen compounds
5491	25	45	0	1	0	4	359.37	0.0	Basic nitrogen compounds
5492	26	45	0	1	0	5	371.37	1e-06	Basic nitrogen compounds
5493	27	45	0	1	0	6	383.37	2e-06	Basic nitrogen compounds
5494	28	45	0	1	0	7	395.37	3e-06	Basic nitrogen compounds
5495	29	45	0	1	0	8	407.37	4e-06	Basic nitrogen compounds
5496	30	45	0	1	0	9	419.37	4e-06	Basic nitrogen compounds
5497	31	45	0	1	0	10	431.37	4e-06	Basic nitrogen compounds
5498	32	45	0	1	0	11	443.37	4e-06	Basic nitrogen compounds
5499	33	45	0	1	0	12	455.37	3e-06	Basic nitrogen compounds
5500	34	45	0	1	0	13	467.37	2e-06	Basic nitrogen compounds
5501	35	45	0	1	0	14	479.37	2e-06	Basic nitrogen compounds
5502	36	45	0	1	0	15	491.37	1e-06	Basic nitrogen compounds
5503	37	45	0	1	0	16	503.37	1e-06	Basic nitrogen compounds
5504	38	45	0	1	0	17	515.37	1e-06	Basic nitrogen compounds
5505	39	45	0	1	0	18	527.37	1e-06	Basic nitrogen compounds
5506	40	45	0	1	0	19	539.37	0.0	Basic nitrogen compounds
5507	41	45	0	1	0	20	551.37	0.0	Basic nitrogen compounds
5508	42	45	0	1	0	21	563.37	0.0	Basic nitrogen compounds
5509	43	45	0	1	0	22	575.37	0.0	Basic nitrogen compounds
5510	26	47	0	1	0	4	373.386	0.0	Basic nitrogen compounds
5511	27	47	0	1	0	5	385.386	1e-06	Basic nitrogen compounds
5512	28	47	0	1	0	6	397.386	2e-06	Basic nitrogen compounds
5513	29	47	0	1	0	7	409.386	3e-06	Basic nitrogen compounds
5514	30	47	0	1	0	8	421.386	4e-06	Basic nitrogen compounds
5515	31	47	0	1	0	9	433.386	4e-06	Basic nitrogen compounds
5516	32	47	0	1	0	10	445.386	3e-06	Basic nitrogen compounds
5517	33	47	0	1	0	11	457.386	3e-06	Basic nitrogen compounds
5518	34	47	0	1	0	12	469.386	3e-06	Basic nitrogen compounds
5519	35	47	0	1	0	13	481.386	2e-06	Basic nitrogen compounds
5520	36	47	0	1	0	14	493.386	1e-06	Basic nitrogen compounds
5521	37	47	0	1	0	15	505.386	1e-06	Basic nitrogen compounds
5522	38	47	0	1	0	16	517.386	1e-06	Basic nitrogen compounds
5523	39	47	0	1	0	17	529.386	1e-06	Basic nitrogen compounds
5524	40	47	0	1	0	18	541.386	0.0	Basic nitrogen compounds
5525	41	47	0	1	0	19	553.386	0.0	Basic nitrogen compounds
5526	42	47	0	1	0	20	565.386	0.0	Basic nitrogen compounds
5527	43	47	0	1	0	21	577.386	0.0	Basic nitrogen compounds
5528	27	49	0	1	0	4	387.402	0.0	Basic nitrogen compounds
5529	28	49	0	1	0	5	399.402	1e-06	Basic nitrogen compounds
5530	29	49	0	1	0	6	411.402	2e-06	Basic nitrogen compounds
5531	30	49	0	1	0	7	423.402	3e-06	Basic nitrogen compounds
5532	31	49	0	1	0	8	435.402	4e-06	Basic nitrogen compounds
5533	32	49	0	1	0	9	447.402	4e-06	Basic nitrogen compounds
5534	33	49	0	1	0	10	459.402	3e-06	Basic nitrogen compounds
5535	34	49	0	1	0	11	471.402	2e-06	Basic nitrogen compounds
5536	35	49	0	1	0	12	483.402	2e-06	Basic nitrogen compounds
5537	36	49	0	1	0	13	495.402	2e-06	Basic nitrogen compounds
5538	37	49	0	1	0	14	507.402	1e-06	Basic nitrogen compounds
5539	38	49	0	1	0	15	519.402	1e-06	Basic nitrogen compounds
5540	39	49	0	1	0	16	531.402	1e-06	Basic nitrogen compounds
5541	40	49	0	1	0	17	543.402	1e-06	Basic nitrogen compounds
5542	41	49	0	1	0	18	555.402	0.0	Basic nitrogen compounds
5543	42	49	0	1	0	19	567.402	0.0	Basic nitrogen compounds
5544	43	49	0	1	0	20	579.402	0.0	Basic nitrogen compounds
5545	44	49	0	1	0	21	591.402	0.0	Basic nitrogen compounds
5546	45	49	0	1	0	22	603.402	0.0	Basic nitrogen compounds
5547	28	51	0	1	0	4	401.418	0.0	Basic nitrogen compounds
5548	29	51	0	1	0	5	413.418	1e-06	Basic nitrogen compounds
5549	30	51	0	1	0	6	425.418	2e-06	Basic nitrogen compounds
5550	31	51	0	1	0	7	437.418	3e-06	Basic nitrogen compounds
5551	32	51	0	1	0	8	449.418	3e-06	Basic nitrogen compounds
5552	33	51	0	1	0	9	461.418	3e-06	Basic nitrogen compounds
5553	34	51	0	1	0	10	473.418	3e-06	Basic nitrogen compounds
5554	35	51	0	1	0	11	485.418	2e-06	Basic nitrogen compounds
5555	36	51	0	1	0	12	497.418	2e-06	Basic nitrogen compounds
5556	37	51	0	1	0	13	509.418	2e-06	Basic nitrogen compounds
5557	38	51	0	1	0	14	521.418	1e-06	Basic nitrogen compounds
5558	39	51	0	1	0	15	533.418	1e-06	Basic nitrogen compounds
5559	40	51	0	1	0	16	545.418	1e-06	Basic nitrogen compounds
5560	41	51	0	1	0	17	557.418	0.0	Basic nitrogen compounds
5561	42	51	0	1	0	18	569.418	0.0	Basic nitrogen compounds
5562	43	51	0	1	0	19	581.418	0.0	Basic nitrogen compounds
5563	44	51	0	1	0	20	593.418	0.0	Basic nitrogen compounds
5564	45	51	0	1	0	21	605.418	0.0	Basic nitrogen compounds
5565	47	51	0	1	0	23	629.418	0.0	Basic nitrogen compounds
5566	29	53	0	1	0	4	415.434	0.0	Basic nitrogen compounds
5567	30	53	0	1	0	5	427.434	1e-06	Basic nitrogen compounds
5568	31	53	0	1	0	6	439.434	2e-06	Basic nitrogen compounds
5569	32	53	0	1	0	7	451.434	2e-06	Basic nitrogen compounds
5570	33	53	0	1	0	8	463.434	3e-06	Basic nitrogen compounds
5571	34	53	0	1	0	9	475.434	3e-06	Basic nitrogen compounds
5572	35	53	0	1	0	10	487.434	3e-06	Basic nitrogen compounds
5573	36	53	0	1	0	11	499.434	2e-06	Basic nitrogen compounds
5574	37	53	0	1	0	12	511.434	2e-06	Basic nitrogen compounds
5575	38	53	0	1	0	13	523.434	2e-06	Basic nitrogen compounds
5576	39	53	0	1	0	14	535.434	1e-06	Basic nitrogen compounds
5577	40	53	0	1	0	15	547.434	1e-06	Basic nitrogen compounds
5578	41	53	0	1	0	16	559.434	1e-06	Basic nitrogen compounds
5579	42	53	0	1	0	17	571.434	0.0	Basic nitrogen compounds
5580	43	53	0	1	0	18	583.434	0.0	Basic nitrogen compounds
5581	44	53	0	1	0	19	595.434	0.0	Basic nitrogen compounds
5582	45	53	0	1	0	20	607.434	0.0	Basic nitrogen compounds
5583	46	53	0	1	0	21	619.434	0.0	Basic nitrogen compounds
5584	30	55	0	1	0	4	429.45	0.0	Basic nitrogen compounds
5585	31	55	0	1	0	5	441.45	1e-06	Basic nitrogen compounds
5586	32	55	0	1	0	6	453.45	2e-06	Basic nitrogen compounds
5587	33	55	0	1	0	7	465.45	2e-06	Basic nitrogen compounds
5588	34	55	0	1	0	8	477.45	3e-06	Basic nitrogen compounds
5589	35	55	0	1	0	9	489.45	3e-06	Basic nitrogen compounds
5590	36	55	0	1	0	10	501.45	2e-06	Basic nitrogen compounds
5591	37	55	0	1	0	11	513.45	2e-06	Basic nitrogen compounds
5592	38	55	0	1	0	12	525.45	2e-06	Basic nitrogen compounds
5593	39	55	0	1	0	13	537.45	1e-06	Basic nitrogen compounds
5594	40	55	0	1	0	14	549.45	1e-06	Basic nitrogen compounds
5595	41	55	0	1	0	15	561.45	1e-06	Basic nitrogen compounds
5596	42	55	0	1	0	16	573.45	1e-06	Basic nitrogen compounds
5597	43	55	0	1	0	17	585.45	0.0	Basic nitrogen compounds
5598	44	55	0	1	0	18	597.45	0.0	Basic nitrogen compounds
5599	45	55	0	1	0	19	609.45	0.0	Basic nitrogen compounds
5600	46	55	0	1	0	20	621.45	0.0	Basic nitrogen compounds
5601	47	55	0	1	0	21	633.45	0.0	Basic nitrogen compounds
5602	31	57	0	1	0	4	443.466	0.0	Basic nitrogen compounds
5603	32	57	0	1	0	5	455.466	1e-06	Basic nitrogen compounds
5604	33	57	0	1	0	6	467.466	1e-06	Basic nitrogen compounds
5605	34	57	0	1	0	7	479.466	2e-06	Basic nitrogen compounds
5606	35	57	0	1	0	8	491.466	3e-06	Basic nitrogen compounds
5607	36	57	0	1	0	9	503.466	3e-06	Basic nitrogen compounds
5608	37	57	0	1	0	10	515.466	2e-06	Basic nitrogen compounds
5609	38	57	0	1	0	11	527.466	2e-06	Basic nitrogen compounds
5610	39	57	0	1	0	12	539.466	2e-06	Basic nitrogen compounds
5611	40	57	0	1	0	13	551.466	1e-06	Basic nitrogen compounds
5612	41	57	0	1	0	14	563.466	1e-06	Basic nitrogen compounds
5613	42	57	0	1	0	15	575.466	1e-06	Basic nitrogen compounds
5614	43	57	0	1	0	16	587.466	0.0	Basic nitrogen compounds
5615	44	57	0	1	0	17	599.466	0.0	Basic nitrogen compounds
5616	45	57	0	1	0	18	611.466	0.0	Basic nitrogen compounds
5617	46	57	0	1	0	19	623.466	0.0	Basic nitrogen compounds
5618	48	57	0	1	0	21	647.466	0.0	Basic nitrogen compounds
5619	32	59	0	1	0	4	457.482	0.0	Basic nitrogen compounds
5620	33	59	0	1	0	5	469.482	1e-06	Basic nitrogen compounds
5621	34	59	0	1	0	6	481.482	1e-06	Basic nitrogen compounds
5622	35	59	0	1	0	7	493.482	2e-06	Basic nitrogen compounds
5623	36	59	0	1	0	8	505.482	2e-06	Basic nitrogen compounds
5624	37	59	0	1	0	9	517.482	2e-06	Basic nitrogen compounds
5625	38	59	0	1	0	10	529.482	2e-06	Basic nitrogen compounds
5626	39	59	0	1	0	11	541.482	2e-06	Basic nitrogen compounds
5627	40	59	0	1	0	12	553.482	1e-06	Basic nitrogen compounds
5628	41	59	0	1	0	13	565.482	1e-06	Basic nitrogen compounds
5629	42	59	0	1	0	14	577.482	1e-06	Basic nitrogen compounds
5630	43	59	0	1	0	15	589.482	1e-06	Basic nitrogen compounds
5631	44	59	0	1	0	16	601.482	0.0	Basic nitrogen compounds
5632	45	59	0	1	0	17	613.482	0.0	Basic nitrogen compounds
5633	46	59	0	1	0	18	625.482	0.0	Basic nitrogen compounds
5634	47	59	0	1	0	19	637.482	0.0	Basic nitrogen compounds
5635	48	59	0	1	0	20	649.482	0.0	Basic nitrogen compounds
5636	49	59	0	1	0	21	661.482	0.0	Basic nitrogen compounds
5637	33	61	0	1	0	4	471.498	0.0	Basic nitrogen compounds
5638	34	61	0	1	0	5	483.498	1e-06	Basic nitrogen compounds
5639	35	61	0	1	0	6	495.498	1e-06	Basic nitrogen compounds
5640	36	61	0	1	0	7	507.498	2e-06	Basic nitrogen compounds
5641	37	61	0	1	0	8	519.498	2e-06	Basic nitrogen compounds
5642	38	61	0	1	0	9	531.498	2e-06	Basic nitrogen compounds
5643	39	61	0	1	0	10	543.498	2e-06	Basic nitrogen compounds
5644	40	61	0	1	0	11	555.498	2e-06	Basic nitrogen compounds
5645	41	61	0	1	0	12	567.498	1e-06	Basic nitrogen compounds
5646	42	61	0	1	0	13	579.498	1e-06	Basic nitrogen compounds
5647	43	61	0	1	0	14	591.498	1e-06	Basic nitrogen compounds
5648	44	61	0	1	0	15	603.498	1e-06	Basic nitrogen compounds
5649	45	61	0	1	0	16	615.498	0.0	Basic nitrogen compounds
5650	46	61	0	1	0	17	627.498	0.0	Basic nitrogen compounds
5651	47	61	0	1	0	18	639.498	0.0	Basic nitrogen compounds
5652	48	61	0	1	0	19	651.498	0.0	Basic nitrogen compounds
5653	49	61	0	1	0	20	663.498	0.0	Basic nitrogen compounds
5654	34	63	0	1	0	4	485.514	0.0	Basic nitrogen compounds
5655	35	63	0	1	0	5	497.514	1e-06	Basic nitrogen compounds
5656	36	63	0	1	0	6	509.514	1e-06	Basic nitrogen compounds
5657	37	63	0	1	0	7	521.514	2e-06	Basic nitrogen compounds
5658	38	63	0	1	0	8	533.514	2e-06	Basic nitrogen compounds
5659	39	63	0	1	0	9	545.514	2e-06	Basic nitrogen compounds
5660	40	63	0	1	0	10	557.514	2e-06	Basic nitrogen compounds
5661	41	63	0	1	0	11	569.514	1e-06	Basic nitrogen compounds
5662	42	63	0	1	0	12	581.514	1e-06	Basic nitrogen compounds
5663	43	63	0	1	0	13	593.514	1e-06	Basic nitrogen compounds
5664	44	63	0	1	0	14	605.514	1e-06	Basic nitrogen compounds
5665	45	63	0	1	0	15	617.514	1e-06	Basic nitrogen compounds
5666	46	63	0	1	0	16	629.514	0.0	Basic nitrogen compounds
5667	47	63	0	1	0	17	641.514	0.0	Basic nitrogen compounds
5668	48	63	0	1	0	18	653.514	0.0	Basic nitrogen compounds
5669	49	63	0	1	0	19	665.514	0.0	Basic nitrogen compounds
5670	50	63	0	1	0	20	677.514	0.0	Basic nitrogen compounds
5671	35	65	0	1	0	4	499.53	0.0	Basic nitrogen compounds
5672	36	65	0	1	0	5	511.53	1e-06	Basic nitrogen compounds
5673	37	65	0	1	0	6	523.53	1e-06	Basic nitrogen compounds
5674	38	65	0	1	0	7	535.53	1e-06	Basic nitrogen compounds
5675	39	65	0	1	0	8	547.53	2e-06	Basic nitrogen compounds
5676	40	65	0	1	0	9	559.53	2e-06	Basic nitrogen compounds
5677	41	65	0	1	0	10	571.53	1e-06	Basic nitrogen compounds
5678	42	65	0	1	0	11	583.53	1e-06	Basic nitrogen compounds
5679	43	65	0	1	0	12	595.53	1e-06	Basic nitrogen compounds
5680	44	65	0	1	0	13	607.53	1e-06	Basic nitrogen compounds
5681	45	65	0	1	0	14	619.53	1e-06	Basic nitrogen compounds
5682	46	65	0	1	0	15	631.53	0.0	Basic nitrogen compounds
5683	47	65	0	1	0	16	643.53	0.0	Basic nitrogen compounds
5684	48	65	0	1	0	17	655.53	0.0	Basic nitrogen compounds
5685	49	65	0	1	0	18	667.53	0.0	Basic nitrogen compounds
5686	50	65	0	1	0	19	679.53	0.0	Basic nitrogen compounds
5687	51	65	0	1	0	20	691.53	0.0	Basic nitrogen compounds
5688	36	67	0	1	0	4	513.546	0.0	Basic nitrogen compounds
5689	37	67	0	1	0	5	525.546	1e-06	Basic nitrogen compounds
5690	38	67	0	1	0	6	537.546	1e-06	Basic nitrogen compounds
5691	39	67	0	1	0	7	549.546	1e-06	Basic nitrogen compounds
5692	40	67	0	1	0	8	561.546	1e-06	Basic nitrogen compounds
5693	41	67	0	1	0	9	573.546	2e-06	Basic nitrogen compounds
5694	42	67	0	1	0	10	585.546	1e-06	Basic nitrogen compounds
5695	43	67	0	1	0	11	597.546	1e-06	Basic nitrogen compounds
5696	44	67	0	1	0	12	609.546	1e-06	Basic nitrogen compounds
5697	45	67	0	1	0	13	621.546	1e-06	Basic nitrogen compounds
5698	46	67	0	1	0	14	633.546	1e-06	Basic nitrogen compounds
5699	47	67	0	1	0	15	645.546	0.0	Basic nitrogen compounds
5700	48	67	0	1	0	16	657.546	0.0	Basic nitrogen compounds
5701	49	67	0	1	0	17	669.546	0.0	Basic nitrogen compounds
5702	50	67	0	1	0	18	681.546	0.0	Basic nitrogen compounds
5703	37	69	0	1	0	4	527.562	0.0	Basic nitrogen compounds
5704	38	69	0	1	0	5	539.562	1e-06	Basic nitrogen compounds
5705	39	69	0	1	0	6	551.562	1e-06	Basic nitrogen compounds
5706	40	69	0	1	0	7	563.562	1e-06	Basic nitrogen compounds
5707	41	69	0	1	0	8	575.562	1e-06	Basic nitrogen compounds
5708	42	69	0	1	0	9	587.562	1e-06	Basic nitrogen compounds
5709	43	69	0	1	0	10	599.562	1e-06	Basic nitrogen compounds
5710	44	69	0	1	0	11	611.562	1e-06	Basic nitrogen compounds
5711	45	69	0	1	0	12	623.562	1e-06	Basic nitrogen compounds
5712	46	69	0	1	0	13	635.562	1e-06	Basic nitrogen compounds
5713	47	69	0	1	0	14	647.562	0.0	Basic nitrogen compounds
5714	48	69	0	1	0	15	659.562	0.0	Basic nitrogen compounds
5715	49	69	0	1	0	16	671.562	0.0	Basic nitrogen compounds
5716	50	69	0	1	0	17	683.562	0.0	Basic nitrogen compounds
5717	51	69	0	1	0	18	695.562	0.0	Basic nitrogen compounds
5718	38	71	0	1	0	4	541.578	0.0	Basic nitrogen compounds
5719	39	71	0	1	0	5	553.578	1e-06	Basic nitrogen compounds
5720	40	71	0	1	0	6	565.578	1e-06	Basic nitrogen compounds
5721	41	71	0	1	0	7	577.578	1e-06	Basic nitrogen compounds
5722	42	71	0	1	0	8	589.578	1e-06	Basic nitrogen compounds
5723	43	71	0	1	0	9	601.578	1e-06	Basic nitrogen compounds
5724	44	71	0	1	0	10	613.578	1e-06	Basic nitrogen compounds
5725	45	71	0	1	0	11	625.578	1e-06	Basic nitrogen compounds
5726	46	71	0	1	0	12	637.578	1e-06	Basic nitrogen compounds
5727	47	71	0	1	0	13	649.578	1e-06	Basic nitrogen compounds
5728	48	71	0	1	0	14	661.578	0.0	Basic nitrogen compounds
5729	49	71	0	1	0	15	673.578	0.0	Basic nitrogen compounds
5730	50	71	0	1	0	16	685.578	0.0	Basic nitrogen compounds
5731	51	71	0	1	0	17	697.578	0.0	Basic nitrogen compounds
5732	52	71	0	1	0	18	709.578	0.0	Basic nitrogen compounds
5733	39	73	0	1	0	4	555.594	0.0	Basic nitrogen compounds
5734	40	73	0	1	0	5	567.594	0.0	Basic nitrogen compounds
5735	41	73	0	1	0	6	579.594	1e-06	Basic nitrogen compounds
5736	42	73	0	1	0	7	591.594	1e-06	Basic nitrogen compounds
5737	43	73	0	1	0	8	603.594	1e-06	Basic nitrogen compounds
5738	44	73	0	1	0	9	615.594	1e-06	Basic nitrogen compounds
5739	45	73	0	1	0	10	627.594	1e-06	Basic nitrogen compounds
5740	46	73	0	1	0	11	639.594	1e-06	Basic nitrogen compounds
5741	47	73	0	1	0	12	651.594	1e-06	Basic nitrogen compounds
5742	48	73	0	1	0	13	663.594	0.0	Basic nitrogen compounds
5743	49	73	0	1	0	14	675.594	0.0	Basic nitrogen compounds
5744	50	73	0	1	0	15	687.594	0.0	Basic nitrogen compounds
5745	51	73	0	1	0	16	699.594	0.0	Basic nitrogen compounds
5746	52	73	0	1	0	17	711.594	0.0	Basic nitrogen compounds
5747	40	75	0	1	0	4	569.61	0.0	Basic nitrogen compounds
5748	41	75	0	1	0	5	581.61	0.0	Basic nitrogen compounds
5749	42	75	0	1	0	6	593.61	1e-06	Basic nitrogen compounds
5750	43	75	0	1	0	7	605.61	1e-06	Basic nitrogen compounds
5751	44	75	0	1	0	8	617.61	1e-06	Basic nitrogen compounds
5752	45	75	0	1	0	9	629.61	1e-06	Basic nitrogen compounds
5753	46	75	0	1	0	10	641.61	1e-06	Basic nitrogen compounds
5754	47	75	0	1	0	11	653.61	1e-06	Basic nitrogen compounds
5755	48	75	0	1	0	12	665.61	1e-06	Basic nitrogen compounds
5756	49	75	0	1	0	13	677.61	0.0	Basic nitrogen compounds
5757	50	75	0	1	0	14	689.61	0.0	Basic nitrogen compounds
5758	51	75	0	1	0	15	701.61	0.0	Basic nitrogen compounds
5759	52	75	0	1	0	16	713.61	0.0	Basic nitrogen compounds
5760	53	75	0	1	0	17	725.61	0.0	Basic nitrogen compounds
5761	42	77	0	1	0	5	595.626	0.0	Basic nitrogen compounds
5762	43	77	0	1	0	6	607.626	1e-06	Basic nitrogen compounds
5763	44	77	0	1	0	7	619.626	1e-06	Basic nitrogen compounds
5764	45	77	0	1	0	8	631.626	1e-06	Basic nitrogen compounds
5765	46	77	0	1	0	9	643.626	1e-06	Basic nitrogen compounds
5766	47	77	0	1	0	10	655.626	1e-06	Basic nitrogen compounds
5767	48	77	0	1	0	11	667.626	1e-06	Basic nitrogen compounds
5768	49	77	0	1	0	12	679.626	1e-06	Basic nitrogen compounds
5769	50	77	0	1	0	13	691.626	0.0	Basic nitrogen compounds
5770	51	77	0	1	0	14	703.626	0.0	Basic nitrogen compounds
5771	52	77	0	1	0	15	715.626	0.0	Basic nitrogen compounds
5772	53	77	0	1	0	16	727.626	0.0	Basic nitrogen compounds
5773	54	77	0	1	0	17	739.626	0.0	Basic nitrogen compounds
5774	42	79	0	1	0	4	597.642	0.0	Basic nitrogen compounds
5775	43	79	0	1	0	5	609.642	0.0	Basic nitrogen compounds
5776	44	79	0	1	0	6	621.642	1e-06	Basic nitrogen compounds
5777	45	79	0	1	0	7	633.642	1e-06	Basic nitrogen compounds
5778	46	79	0	1	0	8	645.642	1e-06	Basic nitrogen compounds
5779	47	79	0	1	0	9	657.642	1e-06	Basic nitrogen compounds
5780	48	79	0	1	0	10	669.642	1e-06	Basic nitrogen compounds
5781	49	79	0	1	0	11	681.642	1e-06	Basic nitrogen compounds
5782	50	79	0	1	0	12	693.642	0.0	Basic nitrogen compounds
5783	51	79	0	1	0	13	705.642	0.0	Basic nitrogen compounds
5784	52	79	0	1	0	14	717.642	0.0	Basic nitrogen compounds
5785	53	79	0	1	0	15	729.642	0.0	Basic nitrogen compounds
5786	54	79	0	1	0	16	741.642	0.0	Basic nitrogen compounds
5787	43	81	0	1	0	4	611.658	0.0	Basic nitrogen compounds
5788	44	81	0	1	0	5	623.658	0.0	Basic nitrogen compounds
5789	45	81	0	1	0	6	635.658	1e-06	Basic nitrogen compounds
5790	46	81	0	1	0	7	647.658	1e-06	Basic nitrogen compounds
5791	47	81	0	1	0	8	659.658	1e-06	Basic nitrogen compounds
5792	48	81	0	1	0	9	671.658	1e-06	Basic nitrogen compounds
5793	49	81	0	1	0	10	683.658	1e-06	Basic nitrogen compounds
5794	50	81	0	1	0	11	695.658	0.0	Basic nitrogen compounds
5795	51	81	0	1	0	12	707.658	0.0	Basic nitrogen compounds
5796	52	81	0	1	0	13	719.658	0.0	Basic nitrogen compounds
5797	53	81	0	1	0	14	731.658	0.0	Basic nitrogen compounds
5798	54	81	0	1	0	15	743.658	0.0	Basic nitrogen compounds
5799	55	81	0	1	0	16	755.658	0.0	Basic nitrogen compounds
5800	45	83	0	1	0	5	637.674	0.0	Basic nitrogen compounds
5801	46	83	0	1	0	6	649.674	0.0	Basic nitrogen compounds
5802	47	83	0	1	0	7	661.674	1e-06	Basic nitrogen compounds
5803	48	83	0	1	0	8	673.674	1e-06	Basic nitrogen compounds
5804	49	83	0	1	0	9	685.674	1e-06	Basic nitrogen compounds
5805	50	83	0	1	0	10	697.674	0.0	Basic nitrogen compounds
5806	51	83	0	1	0	11	709.674	0.0	Basic nitrogen compounds
5807	52	83	0	1	0	12	721.674	0.0	Basic nitrogen compounds
5808	53	83	0	1	0	13	733.674	0.0	Basic nitrogen compounds
5809	54	83	0	1	0	14	745.674	0.0	Basic nitrogen compounds
5810	55	83	0	1	0	15	757.674	0.0	Basic nitrogen compounds
5811	56	83	0	1	0	16	769.674	0.0	Basic nitrogen compounds
5812	46	85	0	1	0	5	651.69	0.0	Basic nitrogen compounds
5813	47	85	0	1	0	6	663.69	0.0	Basic nitrogen compounds
5814	48	85	0	1	0	7	675.69	1e-06	Basic nitrogen compounds
5815	49	85	0	1	0	8	687.69	1e-06	Basic nitrogen compounds
5816	50	85	0	1	0	9	699.69	0.0	Basic nitrogen compounds
5817	51	85	0	1	0	10	711.69	0.0	Basic nitrogen compounds
5818	52	85	0	1	0	11	723.69	0.0	Basic nitrogen compounds
5819	53	85	0	1	0	12	735.69	0.0	Basic nitrogen compounds
5820	54	85	0	1	0	13	747.69	0.0	Basic nitrogen compounds
5821	55	85	0	1	0	14	759.69	0.0	Basic nitrogen compounds
5822	56	85	0	1	0	15	771.69	0.0	Basic nitrogen compounds
5823	89	85	0	1	0	48	1167.69	0.0	Basic nitrogen compounds
5824	47	87	0	1	0	5	665.706	0.0	Basic nitrogen compounds
5825	48	87	0	1	0	6	677.706	0.0	Basic nitrogen compounds
5826	49	87	0	1	0	7	689.706	0.0	Basic nitrogen compounds
5827	50	87	0	1	0	8	701.706	0.0	Basic nitrogen compounds
5828	51	87	0	1	0	9	713.706	0.0	Basic nitrogen compounds
5829	52	87	0	1	0	10	725.706	0.0	Basic nitrogen compounds
5830	53	87	0	1	0	11	737.706	0.0	Basic nitrogen compounds
5831	54	87	0	1	0	12	749.706	0.0	Basic nitrogen compounds
5832	55	87	0	1	0	13	761.706	0.0	Basic nitrogen compounds
5833	56	87	0	1	0	14	773.706	0.0	Basic nitrogen compounds
5834	84	87	0	1	0	42	1109.71	0.0	Basic nitrogen compounds
5835	48	89	0	1	0	5	679.722	0.0	Basic nitrogen compounds
5836	49	89	0	1	0	6	691.722	0.0	Basic nitrogen compounds
5837	50	89	0	1	0	7	703.722	0.0	Basic nitrogen compounds
5838	51	89	0	1	0	8	715.722	0.0	Basic nitrogen compounds
5839	52	89	0	1	0	9	727.722	0.0	Basic nitrogen compounds
5840	53	89	0	1	0	10	739.722	0.0	Basic nitrogen compounds
5841	54	89	0	1	0	11	751.722	0.0	Basic nitrogen compounds
5842	55	89	0	1	0	12	763.722	0.0	Basic nitrogen compounds
5843	56	89	0	1	0	13	775.722	0.0	Basic nitrogen compounds
5844	57	89	0	1	0	14	787.722	0.0	Basic nitrogen compounds
5845	91	89	0	1	0	48	1195.72	0.0	Basic nitrogen compounds
5846	49	91	0	1	0	5	693.738	0.0	Basic nitrogen compounds
5847	50	91	0	1	0	6	705.738	0.0	Basic nitrogen compounds
5848	51	91	0	1	0	7	717.738	0.0	Basic nitrogen compounds
5849	52	91	0	1	0	8	729.738	0.0	Basic nitrogen compounds
5850	53	91	0	1	0	9	741.738	0.0	Basic nitrogen compounds
5851	54	91	0	1	0	10	753.738	0.0	Basic nitrogen compounds
5852	55	91	0	1	0	11	765.738	0.0	Basic nitrogen compounds
5853	56	91	0	1	0	12	777.738	0.0	Basic nitrogen compounds
5854	57	91	0	1	0	13	789.738	0.0	Basic nitrogen compounds
5855	58	91	0	1	0	14	801.738	0.0	Basic nitrogen compounds
5856	88	91	0	1	0	44	1161.74	0.0	Basic nitrogen compounds
5857	51	93	0	1	0	6	719.754	0.0	Basic nitrogen compounds
5858	52	93	0	1	0	7	731.754	0.0	Basic nitrogen compounds
5859	53	93	0	1	0	8	743.754	0.0	Basic nitrogen compounds
5860	54	93	0	1	0	9	755.754	0.0	Basic nitrogen compounds
5861	55	93	0	1	0	10	767.754	0.0	Basic nitrogen compounds
5862	57	93	0	1	0	12	791.754	0.0	Basic nitrogen compounds
5863	58	93	0	1	0	13	803.754	0.0	Basic nitrogen compounds
5864	59	93	0	1	0	14	815.754	0.0	Basic nitrogen compounds
5865	60	93	0	1	0	15	827.754	0.0	Basic nitrogen compounds
5866	61	93	0	1	0	16	839.754	0.0	Basic nitrogen compounds
5867	52	95	0	1	0	6	733.77	0.0	Basic nitrogen compounds
5868	53	95	0	1	0	7	745.77	0.0	Basic nitrogen compounds
5869	54	95	0	1	0	8	757.77	0.0	Basic nitrogen compounds
5870	55	95	0	1	0	9	769.77	0.0	Basic nitrogen compounds
5871	56	95	0	1	0	10	781.77	0.0	Basic nitrogen compounds
5872	57	95	0	1	0	11	793.77	0.0	Basic nitrogen compounds
5873	58	95	0	1	0	12	805.77	0.0	Basic nitrogen compounds
5874	59	95	0	1	0	13	817.77	0.0	Basic nitrogen compounds
5875	60	95	0	1	0	14	829.77	0.0	Basic nitrogen compounds
5876	52	97	0	1	0	5	735.786	0.0	Basic nitrogen compounds
5877	53	97	0	1	0	6	747.786	0.0	Basic nitrogen compounds
5878	54	97	0	1	0	7	759.786	0.0	Basic nitrogen compounds
5879	55	97	0	1	0	8	771.786	0.0	Basic nitrogen compounds
5880	56	97	0	1	0	9	783.786	0.0	Basic nitrogen compounds
5881	57	97	0	1	0	10	795.786	0.0	Basic nitrogen compounds
5882	58	97	0	1	0	11	807.786	0.0	Basic nitrogen compounds
5883	59	97	0	1	0	12	819.786	0.0	Basic nitrogen compounds
5884	60	97	0	1	0	13	831.786	0.0	Basic nitrogen compounds
5885	61	97	0	1	0	14	843.786	0.0	Basic nitrogen compounds
5886	62	97	0	1	0	15	855.786	0.0	Basic nitrogen compounds
5887	53	99	0	1	0	5	749.802	0.0	Basic nitrogen compounds
5888	54	99	0	1	0	6	761.802	0.0	Basic nitrogen compounds
5889	56	99	0	1	0	8	785.802	0.0	Basic nitrogen compounds
5890	57	99	0	1	0	9	797.802	0.0	Basic nitrogen compounds
5891	58	99	0	1	0	10	809.802	0.0	Basic nitrogen compounds
5892	59	99	0	1	0	11	821.802	0.0	Basic nitrogen compounds
5893	60	99	0	1	0	12	833.802	0.0	Basic nitrogen compounds
5894	61	99	0	1	0	13	845.802	0.0	Basic nitrogen compounds
5895	62	99	0	1	0	14	857.802	0.0	Basic nitrogen compounds
5896	63	99	0	1	0	15	869.802	0.0	Basic nitrogen compounds
5897	88	99	0	1	0	40	1169.8	0.0	Basic nitrogen compounds
5898	54	101	0	1	0	5	763.818	0.0	Basic nitrogen compounds
5899	55	101	0	1	0	6	775.818	0.0	Basic nitrogen compounds
5900	56	101	0	1	0	7	787.818	0.0	Basic nitrogen compounds
5901	57	101	0	1	0	8	799.818	0.0	Basic nitrogen compounds
5902	58	101	0	1	0	9	811.818	0.0	Basic nitrogen compounds
5903	59	101	0	1	0	10	823.818	0.0	Basic nitrogen compounds
5904	62	101	0	1	0	13	859.818	0.0	Basic nitrogen compounds
5905	63	101	0	1	0	14	871.818	0.0	Basic nitrogen compounds
5906	55	103	0	1	0	5	777.834	0.0	Basic nitrogen compounds
5907	56	103	0	1	0	6	789.834	0.0	Basic nitrogen compounds
5908	57	103	0	1	0	7	801.834	0.0	Basic nitrogen compounds
5909	58	103	0	1	0	8	813.834	0.0	Basic nitrogen compounds
5910	59	103	0	1	0	9	825.834	0.0	Basic nitrogen compounds
5911	60	103	0	1	0	10	837.834	0.0	Basic nitrogen compounds
5912	61	103	0	1	0	11	849.834	0.0	Basic nitrogen compounds
5913	62	103	0	1	0	12	861.834	0.0	Basic nitrogen compounds
5914	64	103	0	1	0	14	885.834	0.0	Basic nitrogen compounds
5915	65	103	0	1	0	15	897.834	0.0	Basic nitrogen compounds
5916	56	105	0	1	0	5	791.85	0.0	Basic nitrogen compounds
5917	58	105	0	1	0	7	815.85	0.0	Basic nitrogen compounds
5918	59	105	0	1	0	8	827.85	0.0	Basic nitrogen compounds
5919	60	105	0	1	0	9	839.85	0.0	Basic nitrogen compounds
5920	60	107	0	1	0	8	841.866	0.0	Basic nitrogen compounds
5921	61	107	0	1	0	9	853.866	0.0	Basic nitrogen compounds
5922	63	107	0	1	0	11	877.866	0.0	Basic nitrogen compounds
5923	64	107	0	1	0	12	889.866	0.0	Basic nitrogen compounds
5924	65	107	0	1	0	13	901.866	0.0	Basic nitrogen compounds
5925	59	109	0	1	0	6	831.882	0.0	Basic nitrogen compounds
5926	61	109	0	1	0	8	855.882	0.0	Basic nitrogen compounds
5927	65	111	0	1	0	11	905.898	0.0	Basic nitrogen compounds
5928	61	113	0	1	0	6	859.914	0.0	Basic nitrogen compounds
5929	62	113	0	1	0	7	871.914	0.0	Basic nitrogen compounds
5930	63	113	0	1	0	8	883.914	0.0	Basic nitrogen compounds
5931	65	115	0	1	0	9	909.93	0.0	Basic nitrogen compounds
5932	88	123	0	1	0	28	1193.99	0.0	Basic nitrogen compounds
5933	83	125	0	1	0	22	1136.01	0.0	Basic nitrogen compounds
5934	80	161	0	1	0	1	1136.3	0.0	Basic nitrogen compounds
5935	10	10	0	0	1	6	162.14	1e-06	Thiophenic compounds
5936	13	10	0	0	1	9	198.14	0.003337	Thiophenic compounds
5937	14	10	0	0	1	10	210.14	2.7e-05	Thiophenic compounds
5938	15	10	0	0	1	11	222.14	5e-06	Thiophenic compounds
5939	16	10	0	0	1	12	234.14	5.9e-05	Thiophenic compounds
5940	17	10	0	0	1	13	246.14	3e-06	Thiophenic compounds
5941	18	10	0	0	1	14	258.14	2e-06	Thiophenic compounds
5942	20	10	0	0	1	16	282.14	2.2e-05	Thiophenic compounds
5943	11	12	0	0	1	6	176.156	4.1e-05	Thiophenic compounds
5944	14	12	0	0	1	9	212.156	0.008398	Thiophenic compounds
5945	15	12	0	0	1	10	224.156	8.7e-05	Thiophenic compounds
5946	16	12	0	0	1	11	236.156	4.5e-05	Thiophenic compounds
5947	17	12	0	0	1	12	248.156	0.000383	Thiophenic compounds
5948	18	12	0	0	1	13	260.156	8e-06	Thiophenic compounds
5949	19	12	0	0	1	14	272.156	1.3e-05	Thiophenic compounds
5950	21	12	0	0	1	16	296.156	3e-06	Thiophenic compounds
5951	10	14	0	0	1	4	166.172	7e-06	Thiophenic compounds
5952	11	14	0	0	1	5	178.172	0.0	Thiophenic compounds
5953	12	14	0	0	1	6	190.172	5.5e-05	Thiophenic compounds
5954	13	14	0	0	1	7	202.172	2.4e-05	Thiophenic compounds
5955	14	14	0	0	1	8	214.172	6e-06	Thiophenic compounds
5956	15	14	0	0	1	9	226.172	0.007617	Thiophenic compounds
5957	16	14	0	0	1	10	238.172	0.00024	Thiophenic compounds
5958	17	14	0	0	1	11	250.172	9.3e-05	Thiophenic compounds
5959	18	14	0	0	1	12	262.172	0.000912	Thiophenic compounds
5960	19	14	0	0	1	13	274.172	5.1e-05	Thiophenic compounds
5961	20	14	0	0	1	14	286.172	5.2e-05	Thiophenic compounds
5962	21	14	0	0	1	15	298.172	2.8e-05	Thiophenic compounds
5963	22	14	0	0	1	16	310.172	4e-06	Thiophenic compounds
5964	23	14	0	0	1	17	322.172	0.000124	Thiophenic compounds
5965	11	16	0	0	1	4	180.188	9.5e-05	Thiophenic compounds
5966	13	16	0	0	1	6	204.188	5.1e-05	Thiophenic compounds
5967	14	16	0	0	1	7	216.188	1.7e-05	Thiophenic compounds
5968	15	16	0	0	1	8	228.188	3.5e-05	Thiophenic compounds
5969	16	16	0	0	1	9	240.188	0.004639	Thiophenic compounds
5970	17	16	0	0	1	10	252.188	0.000664	Thiophenic compounds
5971	18	16	0	0	1	11	264.188	0.000182	Thiophenic compounds
5972	19	16	0	0	1	12	276.188	0.001231	Thiophenic compounds
5973	20	16	0	0	1	13	288.188	0.000153	Thiophenic compounds
5974	21	16	0	0	1	14	300.188	6.2e-05	Thiophenic compounds
5975	22	16	0	0	1	15	312.188	6e-05	Thiophenic compounds
5976	23	16	0	0	1	16	324.188	7e-06	Thiophenic compounds
5977	11	18	0	0	1	3	182.204	5e-06	Thiophenic compounds
5978	12	18	0	0	1	4	194.204	0.000592	Thiophenic compounds
5979	13	18	0	0	1	5	206.204	7e-06	Thiophenic compounds
5980	14	18	0	0	1	6	218.204	5.2e-05	Thiophenic compounds
5981	15	18	0	0	1	7	230.204	7.4e-05	Thiophenic compounds
5982	16	18	0	0	1	8	242.204	0.000103	Thiophenic compounds
5983	17	18	0	0	1	9	254.204	0.002475	Thiophenic compounds
5984	18	18	0	0	1	10	266.204	0.000903	Thiophenic compounds
5985	19	18	0	0	1	11	278.204	0.000362	Thiophenic compounds
5986	20	18	0	0	1	12	290.204	0.001139	Thiophenic compounds
5987	21	18	0	0	1	13	302.204	0.000273	Thiophenic compounds
5988	22	18	0	0	1	14	314.204	0.000136	Thiophenic compounds
5989	23	18	0	0	1	15	326.204	0.000102	Thiophenic compounds
5990	24	18	0	0	1	16	338.204	5e-06	Thiophenic compounds
5991	25	18	0	0	1	17	350.204	2.3e-05	Thiophenic compounds
5992	12	20	0	0	1	3	196.22	8e-06	Thiophenic compounds
5993	13	20	0	0	1	4	208.22	0.000132	Thiophenic compounds
5994	14	20	0	0	1	5	220.22	5.1e-05	Thiophenic compounds
5995	15	20	0	0	1	6	232.22	6.4e-05	Thiophenic compounds
5996	16	20	0	0	1	7	244.22	9.9e-05	Thiophenic compounds
5997	17	20	0	0	1	8	256.22	0.000212	Thiophenic compounds
5998	18	20	0	0	1	9	268.22	0.001103	Thiophenic compounds
5999	19	20	0	0	1	10	280.22	0.001067	Thiophenic compounds
6000	20	20	0	0	1	11	292.22	0.000583	Thiophenic compounds
6001	21	20	0	0	1	12	304.22	0.001024	Thiophenic compounds
6002	22	20	0	0	1	13	316.22	0.000402	Thiophenic compounds
6003	23	20	0	0	1	14	328.22	0.000213	Thiophenic compounds
6004	24	20	0	0	1	15	340.22	0.000114	Thiophenic compounds
6005	25	20	0	0	1	16	352.22	3e-05	Thiophenic compounds
6006	26	20	0	0	1	17	364.22	0.000154	Thiophenic compounds
6007	13	22	0	0	1	3	210.236	2.2e-05	Thiophenic compounds
6008	14	22	0	0	1	4	222.236	0.000107	Thiophenic compounds
6009	15	22	0	0	1	5	234.236	0.000188	Thiophenic compounds
6010	16	22	0	0	1	6	246.236	0.000134	Thiophenic compounds
6011	17	22	0	0	1	7	258.236	0.000163	Thiophenic compounds
6012	18	22	0	0	1	8	270.236	0.00035	Thiophenic compounds
6013	19	22	0	0	1	9	282.236	0.000602	Thiophenic compounds
6014	20	22	0	0	1	10	294.236	0.000935	Thiophenic compounds
6015	21	22	0	0	1	11	306.236	0.000688	Thiophenic compounds
6016	22	22	0	0	1	12	318.236	0.000778	Thiophenic compounds
6017	23	22	0	0	1	13	330.236	0.000496	Thiophenic compounds
6018	24	22	0	0	1	14	342.236	0.000296	Thiophenic compounds
6019	25	22	0	0	1	15	354.236	0.000148	Thiophenic compounds
6020	26	22	0	0	1	16	366.236	3.4e-05	Thiophenic compounds
6021	27	22	0	0	1	17	378.236	8.3e-05	Thiophenic compounds
6022	28	22	0	0	1	18	390.236	2e-06	Thiophenic compounds
6023	14	24	0	0	1	3	224.252	5.2e-05	Thiophenic compounds
6024	15	24	0	0	1	4	236.252	0.000125	Thiophenic compounds
6025	16	24	0	0	1	5	248.252	0.000396	Thiophenic compounds
6026	17	24	0	0	1	6	260.252	0.000218	Thiophenic compounds
6027	18	24	0	0	1	7	272.252	0.00023	Thiophenic compounds
6028	19	24	0	0	1	8	284.252	0.000416	Thiophenic compounds
6029	20	24	0	0	1	9	296.252	0.000513	Thiophenic compounds
6030	21	24	0	0	1	10	308.252	0.000685	Thiophenic compounds
6031	22	24	0	0	1	11	320.252	0.000641	Thiophenic compounds
6032	23	24	0	0	1	12	332.252	0.000527	Thiophenic compounds
6033	24	24	0	0	1	13	344.252	0.000425	Thiophenic compounds
6034	25	24	0	0	1	14	356.252	0.000296	Thiophenic compounds
6035	26	24	0	0	1	15	368.252	0.000162	Thiophenic compounds
6036	27	24	0	0	1	16	380.252	5.1e-05	Thiophenic compounds
6037	28	24	0	0	1	17	392.252	4.2e-05	Thiophenic compounds
6038	15	26	0	0	1	3	238.268	7.7e-05	Thiophenic compounds
6039	16	26	0	0	1	4	250.268	0.000147	Thiophenic compounds
6040	17	26	0	0	1	5	262.268	0.000362	Thiophenic compounds
6041	18	26	0	0	1	6	274.268	0.000298	Thiophenic compounds
6042	19	26	0	0	1	7	286.268	0.000223	Thiophenic compounds
6043	20	26	0	0	1	8	298.268	0.000425	Thiophenic compounds
6044	21	26	0	0	1	9	310.268	0.000589	Thiophenic compounds
6045	22	26	0	0	1	10	322.268	0.000548	Thiophenic compounds
6046	23	26	0	0	1	11	334.268	0.000554	Thiophenic compounds
6047	24	26	0	0	1	12	346.268	0.000394	Thiophenic compounds
6048	25	26	0	0	1	13	358.268	0.000336	Thiophenic compounds
6049	26	26	0	0	1	14	370.268	0.000232	Thiophenic compounds
6050	27	26	0	0	1	15	382.268	0.000148	Thiophenic compounds
6051	28	26	0	0	1	16	394.268	6.9e-05	Thiophenic compounds
6052	29	26	0	0	1	17	406.268	6.4e-05	Thiophenic compounds
6053	30	26	0	0	1	18	418.268	8e-06	Thiophenic compounds
6054	16	28	0	0	1	3	252.284	8.9e-05	Thiophenic compounds
6055	17	28	0	0	1	4	264.284	0.000152	Thiophenic compounds
6056	18	28	0	0	1	5	276.284	0.00035	Thiophenic compounds
6057	19	28	0	0	1	6	288.284	0.000349	Thiophenic compounds
6058	20	28	0	0	1	7	300.284	0.000298	Thiophenic compounds
6059	21	28	0	0	1	8	312.284	0.000551	Thiophenic compounds
6060	22	28	0	0	1	9	324.284	0.000689	Thiophenic compounds
6061	23	28	0	0	1	10	336.284	0.000505	Thiophenic compounds
6062	24	28	0	0	1	11	348.284	0.000479	Thiophenic compounds
6063	25	28	0	0	1	12	360.284	0.000386	Thiophenic compounds
6064	26	28	0	0	1	13	372.284	0.000277	Thiophenic compounds
6065	27	28	0	0	1	14	384.284	0.000234	Thiophenic compounds
6066	28	28	0	0	1	15	396.284	0.000152	Thiophenic compounds
6067	29	28	0	0	1	16	408.284	8.1e-05	Thiophenic compounds
6068	30	28	0	0	1	17	420.284	0.000109	Thiophenic compounds
6069	31	28	0	0	1	18	432.284	3.4e-05	Thiophenic compounds
6070	32	28	0	0	1	19	444.284	1.1e-05	Thiophenic compounds
6071	17	30	0	0	1	3	266.3	8.8e-05	Thiophenic compounds
6072	18	30	0	0	1	4	278.3	0.000164	Thiophenic compounds
6073	19	30	0	0	1	5	290.3	0.000275	Thiophenic compounds
6074	20	30	0	0	1	6	302.3	0.000368	Thiophenic compounds
6075	21	30	0	0	1	7	314.3	0.000385	Thiophenic compounds
6076	22	30	0	0	1	8	326.3	0.000469	Thiophenic compounds
6077	23	30	0	0	1	9	338.3	0.000822	Thiophenic compounds
6078	24	30	0	0	1	10	350.3	0.000473	Thiophenic compounds
6079	25	30	0	0	1	11	362.3	0.000367	Thiophenic compounds
6080	26	30	0	0	1	12	374.3	0.00034	Thiophenic compounds
6081	27	30	0	0	1	13	386.3	0.000225	Thiophenic compounds
6082	28	30	0	0	1	14	398.3	0.000197	Thiophenic compounds
6083	29	30	0	0	1	15	410.3	0.000152	Thiophenic compounds
6084	30	30	0	0	1	16	422.3	0.000106	Thiophenic compounds
6085	31	30	0	0	1	17	434.3	9e-05	Thiophenic compounds
6086	32	30	0	0	1	18	446.3	4.2e-05	Thiophenic compounds
6087	33	30	0	0	1	19	458.3	6e-06	Thiophenic compounds
6088	18	32	0	0	1	3	280.316	8.8e-05	Thiophenic compounds
6089	19	32	0	0	1	4	292.316	0.000161	Thiophenic compounds
6090	20	32	0	0	1	5	304.316	0.000264	Thiophenic compounds
6091	21	32	0	0	1	6	316.316	0.000334	Thiophenic compounds
6092	22	32	0	0	1	7	328.316	0.00039	Thiophenic compounds
6093	23	32	0	0	1	8	340.316	0.000378	Thiophenic compounds
6094	24	32	0	0	1	9	352.316	0.001195	Thiophenic compounds
6095	25	32	0	0	1	10	364.316	0.000403	Thiophenic compounds
6096	26	32	0	0	1	11	376.316	0.000313	Thiophenic compounds
6097	27	32	0	0	1	12	388.316	0.000303	Thiophenic compounds
6098	28	32	0	0	1	13	400.316	0.000231	Thiophenic compounds
6099	29	32	0	0	1	14	412.316	0.000164	Thiophenic compounds
6100	30	32	0	0	1	15	424.316	0.00016	Thiophenic compounds
6101	31	32	0	0	1	16	436.316	0.000134	Thiophenic compounds
6102	32	32	0	0	1	17	448.316	0.000331	Thiophenic compounds
6103	33	32	0	0	1	18	460.316	7.9e-05	Thiophenic compounds
6104	34	32	0	0	1	19	472.316	3e-05	Thiophenic compounds
6105	19	34	0	0	1	3	294.332	0.000107	Thiophenic compounds
6106	20	34	0	0	1	4	306.332	0.000171	Thiophenic compounds
6107	21	34	0	0	1	5	318.332	0.000239	Thiophenic compounds
6108	22	34	0	0	1	6	330.332	0.000293	Thiophenic compounds
6109	23	34	0	0	1	7	342.332	0.000297	Thiophenic compounds
6110	24	34	0	0	1	8	354.332	0.000351	Thiophenic compounds
6111	25	34	0	0	1	9	366.332	0.000941	Thiophenic compounds
6112	26	34	0	0	1	10	378.332	0.000411	Thiophenic compounds
6113	27	34	0	0	1	11	390.332	0.000327	Thiophenic compounds
6114	28	34	0	0	1	12	402.332	0.000266	Thiophenic compounds
6115	29	34	0	0	1	13	414.332	0.00019	Thiophenic compounds
6116	30	34	0	0	1	14	426.332	0.000153	Thiophenic compounds
6117	31	34	0	0	1	15	438.332	0.000154	Thiophenic compounds
6118	32	34	0	0	1	16	450.332	0.000122	Thiophenic compounds
6119	33	34	0	0	1	17	462.332	0.000301	Thiophenic compounds
6120	34	34	0	0	1	18	474.332	8.3e-05	Thiophenic compounds
6121	35	34	0	0	1	19	486.332	4.4e-05	Thiophenic compounds
6122	20	36	0	0	1	3	308.348	0.000101	Thiophenic compounds
6123	21	36	0	0	1	4	320.348	0.000146	Thiophenic compounds
6124	22	36	0	0	1	5	332.348	0.000252	Thiophenic compounds
6125	23	36	0	0	1	6	344.348	0.000259	Thiophenic compounds
6126	24	36	0	0	1	7	356.348	0.000247	Thiophenic compounds
6127	25	36	0	0	1	8	368.348	0.000301	Thiophenic compounds
6128	26	36	0	0	1	9	380.348	0.000591	Thiophenic compounds
6129	27	36	0	0	1	10	392.348	0.000401	Thiophenic compounds
6130	28	36	0	0	1	11	404.348	0.0003	Thiophenic compounds
6131	29	36	0	0	1	12	416.348	0.000259	Thiophenic compounds
6132	30	36	0	0	1	13	428.348	0.000207	Thiophenic compounds
6133	31	36	0	0	1	14	440.348	0.000161	Thiophenic compounds
6134	32	36	0	0	1	15	452.348	0.000121	Thiophenic compounds
6135	33	36	0	0	1	16	464.348	0.000102	Thiophenic compounds
6136	34	36	0	0	1	17	476.348	0.000288	Thiophenic compounds
6137	35	36	0	0	1	18	488.348	0.000106	Thiophenic compounds
6138	36	36	0	0	1	19	500.348	3.7e-05	Thiophenic compounds
6139	21	38	0	0	1	3	322.364	0.000101	Thiophenic compounds
6140	22	38	0	0	1	4	334.364	0.000173	Thiophenic compounds
6141	23	38	0	0	1	5	346.364	0.000234	Thiophenic compounds
6142	24	38	0	0	1	6	358.364	0.000222	Thiophenic compounds
6143	25	38	0	0	1	7	370.364	0.000257	Thiophenic compounds
6144	26	38	0	0	1	8	382.364	0.000218	Thiophenic compounds
6145	27	38	0	0	1	9	394.364	0.000465	Thiophenic compounds
6146	28	38	0	0	1	10	406.364	0.000435	Thiophenic compounds
6147	29	38	0	0	1	11	418.364	0.00025	Thiophenic compounds
6148	30	38	0	0	1	12	430.364	0.000212	Thiophenic compounds
6149	31	38	0	0	1	13	442.364	0.00019	Thiophenic compounds
6150	32	38	0	0	1	14	454.364	0.000148	Thiophenic compounds
6151	33	38	0	0	1	15	466.364	0.000154	Thiophenic compounds
6152	34	38	0	0	1	16	478.364	7.2e-05	Thiophenic compounds
6153	35	38	0	0	1	17	490.364	0.000122	Thiophenic compounds
6154	36	38	0	0	1	18	502.364	8.6e-05	Thiophenic compounds
6155	37	38	0	0	1	19	514.364	3.6e-05	Thiophenic compounds
6156	22	40	0	0	1	3	336.38	0.000113	Thiophenic compounds
6157	23	40	0	0	1	4	348.38	0.000165	Thiophenic compounds
6158	24	40	0	0	1	5	360.38	0.000214	Thiophenic compounds
6159	25	40	0	0	1	6	372.38	0.000237	Thiophenic compounds
6160	26	40	0	0	1	7	384.38	0.000217	Thiophenic compounds
6161	27	40	0	0	1	8	396.38	0.000216	Thiophenic compounds
6162	28	40	0	0	1	9	408.38	0.000362	Thiophenic compounds
6163	29	40	0	0	1	10	420.38	0.000357	Thiophenic compounds
6164	30	40	0	0	1	11	432.38	0.00025	Thiophenic compounds
6165	31	40	0	0	1	12	444.38	0.000225	Thiophenic compounds
6166	32	40	0	0	1	13	456.38	0.000172	Thiophenic compounds
6167	33	40	0	0	1	14	468.38	0.000161	Thiophenic compounds
6168	34	40	0	0	1	15	480.38	0.000131	Thiophenic compounds
6169	35	40	0	0	1	16	492.38	8.4e-05	Thiophenic compounds
6170	36	40	0	0	1	17	504.38	6.6e-05	Thiophenic compounds
6171	37	40	0	0	1	18	516.38	5.6e-05	Thiophenic compounds
6172	38	40	0	0	1	19	528.38	5.7e-05	Thiophenic compounds
6173	23	42	0	0	1	3	350.396	0.000132	Thiophenic compounds
6174	24	42	0	0	1	4	362.396	0.000171	Thiophenic compounds
6175	25	42	0	0	1	5	374.396	0.000185	Thiophenic compounds
6176	26	42	0	0	1	6	386.396	0.000203	Thiophenic compounds
6177	27	42	0	0	1	7	398.396	0.000181	Thiophenic compounds
6178	28	42	0	0	1	8	410.396	0.000194	Thiophenic compounds
6179	29	42	0	0	1	9	422.396	0.00032	Thiophenic compounds
6180	30	42	0	0	1	10	434.396	0.00036	Thiophenic compounds
6181	31	42	0	0	1	11	446.396	0.000214	Thiophenic compounds
6182	32	42	0	0	1	12	458.396	0.000196	Thiophenic compounds
6183	33	42	0	0	1	13	470.396	0.000187	Thiophenic compounds
6184	34	42	0	0	1	14	482.396	0.000153	Thiophenic compounds
6185	35	42	0	0	1	15	494.396	9.2e-05	Thiophenic compounds
6186	36	42	0	0	1	16	506.396	8.3e-05	Thiophenic compounds
6187	37	42	0	0	1	17	518.396	5.3e-05	Thiophenic compounds
6188	38	42	0	0	1	18	530.396	5e-05	Thiophenic compounds
6189	39	42	0	0	1	19	542.396	3.4e-05	Thiophenic compounds
6190	24	44	0	0	1	3	364.412	0.000162	Thiophenic compounds
6191	25	44	0	0	1	4	376.412	0.000162	Thiophenic compounds
6192	26	44	0	0	1	5	388.412	0.000227	Thiophenic compounds
6193	27	44	0	0	1	6	400.412	0.000239	Thiophenic compounds
6194	28	44	0	0	1	7	412.412	0.000188	Thiophenic compounds
6195	29	44	0	0	1	8	424.412	0.000192	Thiophenic compounds
6196	30	44	0	0	1	9	436.412	0.000285	Thiophenic compounds
6197	31	44	0	0	1	10	448.412	0.000285	Thiophenic compounds
6198	32	44	0	0	1	11	460.412	0.000214	Thiophenic compounds
6199	33	44	0	0	1	12	472.412	0.000199	Thiophenic compounds
6200	34	44	0	0	1	13	484.412	0.000173	Thiophenic compounds
6201	35	44	0	0	1	14	496.412	0.000117	Thiophenic compounds
6202	36	44	0	0	1	15	508.412	0.000114	Thiophenic compounds
6203	37	44	0	0	1	16	520.412	6.9e-05	Thiophenic compounds
6204	38	44	0	0	1	17	532.412	6.8e-05	Thiophenic compounds
6205	39	44	0	0	1	18	544.412	5.4e-05	Thiophenic compounds
6206	40	44	0	0	1	19	556.412	2.3e-05	Thiophenic compounds
6207	25	46	0	0	1	3	378.428	0.000142	Thiophenic compounds
6208	26	46	0	0	1	4	390.428	0.000139	Thiophenic compounds
6209	27	46	0	0	1	5	402.428	0.000186	Thiophenic compounds
6210	28	46	0	0	1	6	414.428	0.000176	Thiophenic compounds
6211	29	46	0	0	1	7	426.428	0.000176	Thiophenic compounds
6212	30	46	0	0	1	8	438.428	0.000202	Thiophenic compounds
6213	31	46	0	0	1	9	450.428	0.000232	Thiophenic compounds
6214	32	46	0	0	1	10	462.428	0.000283	Thiophenic compounds
6215	33	46	0	0	1	11	474.428	0.000195	Thiophenic compounds
6216	34	46	0	0	1	12	486.428	0.000156	Thiophenic compounds
6217	35	46	0	0	1	13	498.428	0.000165	Thiophenic compounds
6218	36	46	0	0	1	14	510.428	0.000125	Thiophenic compounds
6219	37	46	0	0	1	15	522.428	8.8e-05	Thiophenic compounds
6220	38	46	0	0	1	16	534.428	7.7e-05	Thiophenic compounds
6221	39	46	0	0	1	17	546.428	7.4e-05	Thiophenic compounds
6222	40	46	0	0	1	18	558.428	5.6e-05	Thiophenic compounds
6223	41	46	0	0	1	19	570.428	2.2e-05	Thiophenic compounds
6224	26	48	0	0	1	3	392.444	0.000144	Thiophenic compounds
6225	27	48	0	0	1	4	404.444	0.000157	Thiophenic compounds
6226	28	48	0	0	1	5	416.444	0.000183	Thiophenic compounds
6227	29	48	0	0	1	6	428.444	0.000188	Thiophenic compounds
6228	30	48	0	0	1	7	440.444	0.000143	Thiophenic compounds
6229	31	48	0	0	1	8	452.444	0.000159	Thiophenic compounds
6230	32	48	0	0	1	9	464.444	0.000252	Thiophenic compounds
6231	33	48	0	0	1	10	476.444	0.000255	Thiophenic compounds
6232	34	48	0	0	1	11	488.444	0.000158	Thiophenic compounds
6233	35	48	0	0	1	12	500.444	0.000146	Thiophenic compounds
6234	36	48	0	0	1	13	512.444	0.000133	Thiophenic compounds
6235	37	48	0	0	1	14	524.444	0.000123	Thiophenic compounds
6236	38	48	0	0	1	15	536.444	7.6e-05	Thiophenic compounds
6237	39	48	0	0	1	16	548.444	9.7e-05	Thiophenic compounds
6238	40	48	0	0	1	17	560.444	5.5e-05	Thiophenic compounds
6239	41	48	0	0	1	18	572.444	4.8e-05	Thiophenic compounds
6240	42	48	0	0	1	19	584.444	2e-05	Thiophenic compounds
6241	27	50	0	0	1	3	406.46	0.000145	Thiophenic compounds
6242	28	50	0	0	1	4	418.46	0.000168	Thiophenic compounds
6243	29	50	0	0	1	5	430.46	0.000185	Thiophenic compounds
6244	30	50	0	0	1	6	442.46	0.000197	Thiophenic compounds
6245	31	50	0	0	1	7	454.46	0.000163	Thiophenic compounds
6246	32	50	0	0	1	8	466.46	0.000167	Thiophenic compounds
6247	33	50	0	0	1	9	478.46	0.000218	Thiophenic compounds
6248	34	50	0	0	1	10	490.46	0.000229	Thiophenic compounds
6249	35	50	0	0	1	11	502.46	0.000164	Thiophenic compounds
6250	36	50	0	0	1	12	514.46	0.000118	Thiophenic compounds
6251	37	50	0	0	1	13	526.46	0.000116	Thiophenic compounds
6252	38	50	0	0	1	14	538.46	0.000125	Thiophenic compounds
6253	39	50	0	0	1	15	550.46	7.4e-05	Thiophenic compounds
6254	40	50	0	0	1	16	562.46	8.7e-05	Thiophenic compounds
6255	41	50	0	0	1	17	574.46	7e-05	Thiophenic compounds
6256	42	50	0	0	1	18	586.46	3.9e-05	Thiophenic compounds
6257	43	50	0	0	1	19	598.46	3.1e-05	Thiophenic compounds
6258	28	52	0	0	1	3	420.476	0.000149	Thiophenic compounds
6259	29	52	0	0	1	4	432.476	0.00015	Thiophenic compounds
6260	30	52	0	0	1	5	444.476	0.000194	Thiophenic compounds
6261	31	52	0	0	1	6	456.476	0.000168	Thiophenic compounds
6262	32	52	0	0	1	7	468.476	0.000173	Thiophenic compounds
6263	33	52	0	0	1	8	480.476	0.000137	Thiophenic compounds
6264	34	52	0	0	1	9	492.476	0.000216	Thiophenic compounds
6265	35	52	0	0	1	10	504.476	0.000197	Thiophenic compounds
6266	36	52	0	0	1	11	516.476	0.000136	Thiophenic compounds
6267	37	52	0	0	1	12	528.476	0.000122	Thiophenic compounds
6268	38	52	0	0	1	13	540.476	9.4e-05	Thiophenic compounds
6269	39	52	0	0	1	14	552.476	8.3e-05	Thiophenic compounds
6270	40	52	0	0	1	15	564.476	8.6e-05	Thiophenic compounds
6271	41	52	0	0	1	16	576.476	8.4e-05	Thiophenic compounds
6272	42	52	0	0	1	17	588.476	4.6e-05	Thiophenic compounds
6273	43	52	0	0	1	18	600.476	5.4e-05	Thiophenic compounds
6274	44	52	0	0	1	19	612.476	3.3e-05	Thiophenic compounds
6275	29	54	0	0	1	3	434.492	0.000155	Thiophenic compounds
6276	30	54	0	0	1	4	446.492	0.000142	Thiophenic compounds
6277	31	54	0	0	1	5	458.492	0.000156	Thiophenic compounds
6278	32	54	0	0	1	6	470.492	0.000191	Thiophenic compounds
6279	33	54	0	0	1	7	482.492	0.000129	Thiophenic compounds
6280	34	54	0	0	1	8	494.492	0.000124	Thiophenic compounds
6281	35	54	0	0	1	9	506.492	0.000212	Thiophenic compounds
6282	36	54	0	0	1	10	518.492	0.000198	Thiophenic compounds
6283	37	54	0	0	1	11	530.492	0.000159	Thiophenic compounds
6284	38	54	0	0	1	12	542.492	0.000106	Thiophenic compounds
6285	39	54	0	0	1	13	554.492	0.000106	Thiophenic compounds
6286	40	54	0	0	1	14	566.492	8.7e-05	Thiophenic compounds
6287	41	54	0	0	1	15	578.492	6.7e-05	Thiophenic compounds
6288	42	54	0	0	1	16	590.492	6.8e-05	Thiophenic compounds
6289	43	54	0	0	1	17	602.492	4.7e-05	Thiophenic compounds
6290	44	54	0	0	1	18	614.492	3.2e-05	Thiophenic compounds
6291	45	54	0	0	1	19	626.492	4e-06	Thiophenic compounds
6292	30	56	0	0	1	3	448.508	0.000137	Thiophenic compounds
6293	31	56	0	0	1	4	460.508	0.000143	Thiophenic compounds
6294	32	56	0	0	1	5	472.508	0.000156	Thiophenic compounds
6295	33	56	0	0	1	6	484.508	0.000163	Thiophenic compounds
6296	34	56	0	0	1	7	496.508	0.000145	Thiophenic compounds
6297	35	56	0	0	1	8	508.508	0.000122	Thiophenic compounds
6298	36	56	0	0	1	9	520.508	0.000183	Thiophenic compounds
6299	37	56	0	0	1	10	532.508	0.000138	Thiophenic compounds
6300	38	56	0	0	1	11	544.508	0.00012	Thiophenic compounds
6301	39	56	0	0	1	12	556.508	9.2e-05	Thiophenic compounds
6302	40	56	0	0	1	13	568.508	8e-05	Thiophenic compounds
6303	41	56	0	0	1	14	580.508	8.3e-05	Thiophenic compounds
6304	42	56	0	0	1	15	592.508	4.3e-05	Thiophenic compounds
6305	43	56	0	0	1	16	604.508	3.9e-05	Thiophenic compounds
6306	44	56	0	0	1	17	616.508	3.9e-05	Thiophenic compounds
6307	45	56	0	0	1	18	628.508	1.2e-05	Thiophenic compounds
6308	46	56	0	0	1	19	640.508	1.8e-05	Thiophenic compounds
6309	31	58	0	0	1	3	462.524	0.000119	Thiophenic compounds
6310	32	58	0	0	1	4	474.524	0.000107	Thiophenic compounds
6311	33	58	0	0	1	5	486.524	0.000119	Thiophenic compounds
6312	34	58	0	0	1	6	498.524	0.000152	Thiophenic compounds
6313	35	58	0	0	1	7	510.524	0.000126	Thiophenic compounds
6314	36	58	0	0	1	8	522.524	0.000119	Thiophenic compounds
6315	37	58	0	0	1	9	534.524	0.000173	Thiophenic compounds
6316	38	58	0	0	1	10	546.524	0.000147	Thiophenic compounds
6317	39	58	0	0	1	11	558.524	0.000114	Thiophenic compounds
6318	40	58	0	0	1	12	570.524	8.8e-05	Thiophenic compounds
6319	41	58	0	0	1	13	582.524	6.2e-05	Thiophenic compounds
6320	42	58	0	0	1	14	594.524	6.6e-05	Thiophenic compounds
6321	43	58	0	0	1	15	606.524	5.2e-05	Thiophenic compounds
6322	44	58	0	0	1	16	618.524	4.5e-05	Thiophenic compounds
6323	45	58	0	0	1	17	630.524	2.9e-05	Thiophenic compounds
6324	46	58	0	0	1	18	642.524	1.1e-05	Thiophenic compounds
6325	47	58	0	0	1	19	654.524	7e-06	Thiophenic compounds
6326	32	60	0	0	1	3	476.54	7.7e-05	Thiophenic compounds
6327	33	60	0	0	1	4	488.54	0.000113	Thiophenic compounds
6328	34	60	0	0	1	5	500.54	0.000113	Thiophenic compounds
6329	35	60	0	0	1	6	512.54	0.00011	Thiophenic compounds
6330	36	60	0	0	1	7	524.54	9.1e-05	Thiophenic compounds
6331	37	60	0	0	1	8	536.54	9.5e-05	Thiophenic compounds
6332	38	60	0	0	1	9	548.54	0.00012	Thiophenic compounds
6333	39	60	0	0	1	10	560.54	0.000145	Thiophenic compounds
6334	40	60	0	0	1	11	572.54	0.00011	Thiophenic compounds
6335	41	60	0	0	1	12	584.54	6.6e-05	Thiophenic compounds
6336	42	60	0	0	1	13	596.54	6.3e-05	Thiophenic compounds
6337	43	60	0	0	1	14	608.54	4.4e-05	Thiophenic compounds
6338	44	60	0	0	1	15	620.54	3.1e-05	Thiophenic compounds
6339	45	60	0	0	1	16	632.54	2.3e-05	Thiophenic compounds
6340	46	60	0	0	1	17	644.54	6e-05	Thiophenic compounds
6341	47	60	0	0	1	18	656.54	1.2e-05	Thiophenic compounds
6342	48	60	0	0	1	19	668.54	2.1e-05	Thiophenic compounds
6343	33	62	0	0	1	3	490.556	7.9e-05	Thiophenic compounds
6344	34	62	0	0	1	4	502.556	9.3e-05	Thiophenic compounds
6345	35	62	0	0	1	5	514.556	0.00011	Thiophenic compounds
6346	36	62	0	0	1	6	526.556	9.7e-05	Thiophenic compounds
6347	37	62	0	0	1	7	538.556	8.7e-05	Thiophenic compounds
6348	38	62	0	0	1	8	550.556	0.000108	Thiophenic compounds
6349	39	62	0	0	1	9	562.556	0.000133	Thiophenic compounds
6350	40	62	0	0	1	10	574.556	0.000135	Thiophenic compounds
6351	41	62	0	0	1	11	586.556	9e-05	Thiophenic compounds
6352	42	62	0	0	1	12	598.556	6.3e-05	Thiophenic compounds
6353	43	62	0	0	1	13	610.556	4.9e-05	Thiophenic compounds
6354	44	62	0	0	1	14	622.556	5.1e-05	Thiophenic compounds
6355	45	62	0	0	1	15	634.556	4.8e-05	Thiophenic compounds
6356	46	62	0	0	1	16	646.556	4.4e-05	Thiophenic compounds
6357	47	62	0	0	1	17	658.556	4.4e-05	Thiophenic compounds
6358	48	62	0	0	1	18	670.556	2.3e-05	Thiophenic compounds
6359	49	62	0	0	1	19	682.556	6e-06	Thiophenic compounds
6360	34	64	0	0	1	3	504.572	4.3e-05	Thiophenic compounds
6361	35	64	0	0	1	4	516.572	7.8e-05	Thiophenic compounds
6362	36	64	0	0	1	5	528.572	9.5e-05	Thiophenic compounds
6363	37	64	0	0	1	6	540.572	8e-05	Thiophenic compounds
6364	38	64	0	0	1	7	552.572	7.9e-05	Thiophenic compounds
6365	39	64	0	0	1	8	564.572	9.9e-05	Thiophenic compounds
6366	40	64	0	0	1	9	576.572	0.000153	Thiophenic compounds
6367	41	64	0	0	1	10	588.572	9.9e-05	Thiophenic compounds
6368	42	64	0	0	1	11	600.572	9.5e-05	Thiophenic compounds
6369	43	64	0	0	1	12	612.572	0.000104	Thiophenic compounds
6370	44	64	0	0	1	13	624.572	8.9e-05	Thiophenic compounds
6371	45	64	0	0	1	14	636.572	7.9e-05	Thiophenic compounds
6372	46	64	0	0	1	15	648.572	5.1e-05	Thiophenic compounds
6373	47	64	0	0	1	16	660.572	5e-05	Thiophenic compounds
6374	48	64	0	0	1	17	672.572	8e-06	Thiophenic compounds
6375	49	64	0	0	1	18	684.572	1.8e-05	Thiophenic compounds
6376	50	64	0	0	1	19	696.572	4e-06	Thiophenic compounds
6377	35	66	0	0	1	3	518.588	2.2e-05	Thiophenic compounds
6378	36	66	0	0	1	4	530.588	5.3e-05	Thiophenic compounds
6379	37	66	0	0	1	5	542.588	7.7e-05	Thiophenic compounds
6380	38	66	0	0	1	6	554.588	6.2e-05	Thiophenic compounds
6381	39	66	0	0	1	7	566.588	7.9e-05	Thiophenic compounds
6382	40	66	0	0	1	8	578.588	7.2e-05	Thiophenic compounds
6383	41	66	0	0	1	9	590.588	9.4e-05	Thiophenic compounds
6384	42	66	0	0	1	10	602.588	7.1e-05	Thiophenic compounds
6385	43	66	0	0	1	11	614.588	6.6e-05	Thiophenic compounds
6386	44	66	0	0	1	12	626.588	6.6e-05	Thiophenic compounds
6387	45	66	0	0	1	13	638.588	3.5e-05	Thiophenic compounds
6388	46	66	0	0	1	14	650.588	3.2e-05	Thiophenic compounds
6389	47	66	0	0	1	15	662.588	6e-06	Thiophenic compounds
6390	48	66	0	0	1	16	674.588	2.4e-05	Thiophenic compounds
6391	49	66	0	0	1	17	686.588	1.3e-05	Thiophenic compounds
6392	50	66	0	0	1	18	698.588	1.7e-05	Thiophenic compounds
6393	51	66	0	0	1	19	710.588	4e-06	Thiophenic compounds
6394	37	68	0	0	1	4	544.604	4.7e-05	Thiophenic compounds
6395	38	68	0	0	1	5	556.604	5.1e-05	Thiophenic compounds
6396	39	68	0	0	1	6	568.604	5.7e-05	Thiophenic compounds
6397	40	68	0	0	1	7	580.604	7.3e-05	Thiophenic compounds
6398	41	68	0	0	1	8	592.604	0.00011	Thiophenic compounds
6399	42	68	0	0	1	9	604.604	7.3e-05	Thiophenic compounds
6400	43	68	0	0	1	10	616.604	0.0001	Thiophenic compounds
6401	44	68	0	0	1	11	628.604	5.8e-05	Thiophenic compounds
6402	45	68	0	0	1	12	640.604	6.9e-05	Thiophenic compounds
6403	46	68	0	0	1	13	652.604	2.5e-05	Thiophenic compounds
6404	47	68	0	0	1	14	664.604	3.3e-05	Thiophenic compounds
6405	48	68	0	0	1	15	676.604	2.8e-05	Thiophenic compounds
6406	49	68	0	0	1	16	688.604	1.6e-05	Thiophenic compounds
6407	50	68	0	0	1	17	700.604	3.2e-05	Thiophenic compounds
6408	51	68	0	0	1	18	712.604	1.3e-05	Thiophenic compounds
6409	37	70	0	0	1	3	546.62	1.5e-05	Thiophenic compounds
6410	38	70	0	0	1	4	558.62	3.1e-05	Thiophenic compounds
6411	39	70	0	0	1	5	570.62	4.3e-05	Thiophenic compounds
6412	40	70	0	0	1	6	582.62	5.4e-05	Thiophenic compounds
6413	41	70	0	0	1	7	594.62	3.9e-05	Thiophenic compounds
6414	42	70	0	0	1	8	606.62	0.000117	Thiophenic compounds
6415	43	70	0	0	1	9	618.62	8.9e-05	Thiophenic compounds
6416	44	70	0	0	1	10	630.62	7.4e-05	Thiophenic compounds
6417	45	70	0	0	1	11	642.62	6.8e-05	Thiophenic compounds
6418	46	70	0	0	1	12	654.62	5.1e-05	Thiophenic compounds
6419	47	70	0	0	1	13	666.62	3.1e-05	Thiophenic compounds
6420	48	70	0	0	1	14	678.62	3.7e-05	Thiophenic compounds
6421	49	70	0	0	1	15	690.62	1.4e-05	Thiophenic compounds
6422	50	70	0	0	1	16	702.62	4.4e-05	Thiophenic compounds
6423	51	70	0	0	1	17	714.62	4e-06	Thiophenic compounds
6424	52	70	0	0	1	18	726.62	2e-05	Thiophenic compounds
6425	53	70	0	0	1	19	738.62	1.2e-05	Thiophenic compounds
6426	38	72	0	0	1	3	560.636	4e-06	Thiophenic compounds
6427	39	72	0	0	1	4	572.636	0.000275	Thiophenic compounds
6428	40	72	0	0	1	5	584.636	4.2e-05	Thiophenic compounds
6429	41	72	0	0	1	6	596.636	0.000187	Thiophenic compounds
6430	42	72	0	0	1	7	608.636	0.000135	Thiophenic compounds
6431	43	72	0	0	1	8	620.636	9.4e-05	Thiophenic compounds
6432	44	72	0	0	1	9	632.636	7.6e-05	Thiophenic compounds
6433	45	72	0	0	1	10	644.636	5.6e-05	Thiophenic compounds
6434	46	72	0	0	1	11	656.636	3.1e-05	Thiophenic compounds
6435	47	72	0	0	1	12	668.636	4.8e-05	Thiophenic compounds
6436	48	72	0	0	1	13	680.636	1.4e-05	Thiophenic compounds
6437	49	72	0	0	1	14	692.636	1e-05	Thiophenic compounds
6438	50	72	0	0	1	15	704.636	2.6e-05	Thiophenic compounds
6439	51	72	0	0	1	16	716.636	1.3e-05	Thiophenic compounds
6440	52	72	0	0	1	17	728.636	8e-06	Thiophenic compounds
6441	53	72	0	0	1	18	740.636	1.9e-05	Thiophenic compounds
6442	54	72	0	0	1	19	752.636	4e-06	Thiophenic compounds
6443	39	74	0	0	1	3	574.652	6e-06	Thiophenic compounds
6444	40	74	0	0	1	4	586.652	0.000243	Thiophenic compounds
6445	41	74	0	0	1	5	598.652	0.000211	Thiophenic compounds
6446	42	74	0	0	1	6	610.652	3.6e-05	Thiophenic compounds
6447	43	74	0	0	1	7	622.652	0.000117	Thiophenic compounds
6448	44	74	0	0	1	8	634.652	8.4e-05	Thiophenic compounds
6449	45	74	0	0	1	9	646.652	4.3e-05	Thiophenic compounds
6450	46	74	0	0	1	10	658.652	4.9e-05	Thiophenic compounds
6451	47	74	0	0	1	11	670.652	5.1e-05	Thiophenic compounds
6452	48	74	0	0	1	12	682.652	5.2e-05	Thiophenic compounds
6453	49	74	0	0	1	13	694.652	3e-05	Thiophenic compounds
6454	50	74	0	0	1	14	706.652	1.9e-05	Thiophenic compounds
6455	51	74	0	0	1	15	718.652	1.1e-05	Thiophenic compounds
6456	52	74	0	0	1	16	730.652	9e-06	Thiophenic compounds
6457	54	74	0	0	1	18	754.652	1.2e-05	Thiophenic compounds
6458	55	74	0	0	1	19	766.652	4e-06	Thiophenic compounds
6459	41	76	0	0	1	4	600.668	7e-06	Thiophenic compounds
6460	42	76	0	0	1	5	612.668	2.1e-05	Thiophenic compounds
6461	43	76	0	0	1	6	624.668	0.00015	Thiophenic compounds
6462	44	76	0	0	1	7	636.668	0.000105	Thiophenic compounds
6463	45	76	0	0	1	8	648.668	8.1e-05	Thiophenic compounds
6464	46	76	0	0	1	9	660.668	5.3e-05	Thiophenic compounds
6465	47	76	0	0	1	10	672.668	6.8e-05	Thiophenic compounds
6466	48	76	0	0	1	11	684.668	1.9e-05	Thiophenic compounds
6467	49	76	0	0	1	12	696.668	1.8e-05	Thiophenic compounds
6468	50	76	0	0	1	13	708.668	2.3e-05	Thiophenic compounds
6469	51	76	0	0	1	14	720.668	9e-06	Thiophenic compounds
6470	52	76	0	0	1	15	732.668	5e-06	Thiophenic compounds
6471	53	76	0	0	1	16	744.668	4e-06	Thiophenic compounds
6472	54	76	0	0	1	17	756.668	4e-06	Thiophenic compounds
6473	55	76	0	0	1	18	768.668	5e-06	Thiophenic compounds
6474	44	78	0	0	1	6	638.684	0.000131	Thiophenic compounds
6475	45	78	0	0	1	7	650.684	9.5e-05	Thiophenic compounds
6476	46	78	0	0	1	8	662.684	7.4e-05	Thiophenic compounds
6477	47	78	0	0	1	9	674.684	5.1e-05	Thiophenic compounds
6478	48	78	0	0	1	10	686.684	1.1e-05	Thiophenic compounds
6479	49	78	0	0	1	11	698.684	4e-06	Thiophenic compounds
6480	50	78	0	0	1	12	710.684	2.5e-05	Thiophenic compounds
6481	51	78	0	0	1	13	722.684	5e-06	Thiophenic compounds
6482	52	78	0	0	1	14	734.684	1.4e-05	Thiophenic compounds
6483	53	78	0	0	1	15	746.684	1.7e-05	Thiophenic compounds
6484	54	78	0	0	1	16	758.684	1.7e-05	Thiophenic compounds
6485	55	78	0	0	1	17	770.684	4.1e-05	Thiophenic compounds
6486	56	78	0	0	1	18	782.684	9e-06	Thiophenic compounds
6487	57	78	0	0	1	19	794.684	4e-06	Thiophenic compounds
6488	43	80	0	0	1	4	628.7	0.00018	Thiophenic compounds
6489	45	80	0	0	1	6	652.7	0.000101	Thiophenic compounds
6490	46	80	0	0	1	7	664.7	9.3e-05	Thiophenic compounds
6491	47	80	0	0	1	8	676.7	5.6e-05	Thiophenic compounds
6492	48	80	0	0	1	9	688.7	2.6e-05	Thiophenic compounds
6493	49	80	0	0	1	10	700.7	2e-05	Thiophenic compounds
6494	50	80	0	0	1	11	712.7	1e-05	Thiophenic compounds
6495	51	80	0	0	1	12	724.7	3e-05	Thiophenic compounds
6496	52	80	0	0	1	13	736.7	1.2e-05	Thiophenic compounds
6497	53	80	0	0	1	14	748.7	5e-06	Thiophenic compounds
6498	55	80	0	0	1	16	772.7	9e-06	Thiophenic compounds
6499	57	80	0	0	1	18	796.7	3.2e-05	Thiophenic compounds
6500	58	80	0	0	1	19	808.7	4e-06	Thiophenic compounds
6501	44	82	0	0	1	4	642.716	0.000148	Thiophenic compounds
6502	45	82	0	0	1	5	654.716	0.000135	Thiophenic compounds
6503	46	82	0	0	1	6	666.716	0.000104	Thiophenic compounds
6504	47	82	0	0	1	7	678.716	6.1e-05	Thiophenic compounds
6505	48	82	0	0	1	8	690.716	4.6e-05	Thiophenic compounds
6506	49	82	0	0	1	9	702.716	2.6e-05	Thiophenic compounds
6507	50	82	0	0	1	10	714.716	4e-06	Thiophenic compounds
6508	51	82	0	0	1	11	726.716	4.6e-05	Thiophenic compounds
6509	52	82	0	0	1	12	738.716	4e-06	Thiophenic compounds
6510	53	82	0	0	1	13	750.716	9e-06	Thiophenic compounds
6511	54	82	0	0	1	14	762.716	4e-06	Thiophenic compounds
6512	55	82	0	0	1	15	774.716	5e-06	Thiophenic compounds
6513	57	82	0	0	1	17	798.716	5e-06	Thiophenic compounds
6514	45	84	0	0	1	4	656.732	0.000147	Thiophenic compounds
6515	46	84	0	0	1	5	668.732	0.00013	Thiophenic compounds
6516	47	84	0	0	1	6	680.732	8.6e-05	Thiophenic compounds
6517	48	84	0	0	1	7	692.732	7.5e-05	Thiophenic compounds
6518	49	84	0	0	1	8	704.732	4.9e-05	Thiophenic compounds
6519	50	84	0	0	1	9	716.732	5.8e-05	Thiophenic compounds
6520	51	84	0	0	1	10	728.732	3.3e-05	Thiophenic compounds
6521	52	84	0	0	1	11	740.732	1.1e-05	Thiophenic compounds
6522	53	84	0	0	1	12	752.732	2.7e-05	Thiophenic compounds
6523	54	84	0	0	1	13	764.732	6e-06	Thiophenic compounds
6524	55	84	0	0	1	14	776.732	3.5e-05	Thiophenic compounds
6525	56	84	0	0	1	15	788.732	1.4e-05	Thiophenic compounds
6526	58	84	0	0	1	17	812.732	4e-06	Thiophenic compounds
6527	46	86	0	0	1	4	670.748	0.000139	Thiophenic compounds
6528	47	86	0	0	1	5	682.748	8.7e-05	Thiophenic compounds
6529	48	86	0	0	1	6	694.748	8.1e-05	Thiophenic compounds
6530	49	86	0	0	1	7	706.748	5.2e-05	Thiophenic compounds
6531	50	86	0	0	1	8	718.748	2.1e-05	Thiophenic compounds
6532	51	86	0	0	1	9	730.748	3.2e-05	Thiophenic compounds
6533	52	86	0	0	1	10	742.748	8e-06	Thiophenic compounds
6534	53	86	0	0	1	11	754.748	2.7e-05	Thiophenic compounds
6535	54	86	0	0	1	12	766.748	2e-05	Thiophenic compounds
6536	55	86	0	0	1	13	778.748	1.5e-05	Thiophenic compounds
6537	56	86	0	0	1	14	790.748	9e-06	Thiophenic compounds
6538	57	86	0	0	1	15	802.748	4e-06	Thiophenic compounds
6539	60	86	0	0	1	18	838.748	4e-06	Thiophenic compounds
6540	47	88	0	0	1	4	684.764	0.000124	Thiophenic compounds
6541	48	88	0	0	1	5	696.764	9.3e-05	Thiophenic compounds
6542	49	88	0	0	1	6	708.764	5.3e-05	Thiophenic compounds
6543	50	88	0	0	1	7	720.764	4.6e-05	Thiophenic compounds
6544	51	88	0	0	1	8	732.764	1.8e-05	Thiophenic compounds
6545	52	88	0	0	1	9	744.764	3.3e-05	Thiophenic compounds
6546	53	88	0	0	1	10	756.764	2.6e-05	Thiophenic compounds
6547	54	88	0	0	1	11	768.764	2.8e-05	Thiophenic compounds
6548	56	88	0	0	1	13	792.764	8e-06	Thiophenic compounds
6549	57	88	0	0	1	14	804.764	1.5e-05	Thiophenic compounds
6550	58	88	0	0	1	15	816.764	1.1e-05	Thiophenic compounds
6551	48	90	0	0	1	4	698.78	0.000104	Thiophenic compounds
6552	49	90	0	0	1	5	710.78	7.6e-05	Thiophenic compounds
6553	50	90	0	0	1	6	722.78	7.3e-05	Thiophenic compounds
6554	51	90	0	0	1	7	734.78	3.7e-05	Thiophenic compounds
6555	52	90	0	0	1	8	746.78	4.9e-05	Thiophenic compounds
6556	53	90	0	0	1	9	758.78	1.9e-05	Thiophenic compounds
6557	54	90	0	0	1	10	770.78	1e-05	Thiophenic compounds
6558	57	90	0	0	1	13	806.78	7e-06	Thiophenic compounds
6559	58	90	0	0	1	14	818.78	5e-06	Thiophenic compounds
6560	59	90	0	0	1	15	830.78	5e-06	Thiophenic compounds
6561	49	92	0	0	1	4	712.796	7.9e-05	Thiophenic compounds
6562	50	92	0	0	1	5	724.796	5.5e-05	Thiophenic compounds
6563	51	92	0	0	1	6	736.796	4.2e-05	Thiophenic compounds
6564	52	92	0	0	1	7	748.796	4.6e-05	Thiophenic compounds
6565	53	92	0	0	1	8	760.796	2.2e-05	Thiophenic compounds
6566	54	92	0	0	1	9	772.796	2.1e-05	Thiophenic compounds
6567	56	92	0	0	1	11	796.796	1.4e-05	Thiophenic compounds
6568	57	92	0	0	1	12	808.796	4e-06	Thiophenic compounds
6569	58	92	0	0	1	13	820.796	5e-06	Thiophenic compounds
6570	60	92	0	0	1	15	844.796	5e-06	Thiophenic compounds
6571	62	92	0	0	1	17	868.796	1.3e-05	Thiophenic compounds
6572	50	94	0	0	1	4	726.812	8.4e-05	Thiophenic compounds
6573	51	94	0	0	1	5	738.812	2.3e-05	Thiophenic compounds
6574	52	94	0	0	1	6	750.812	1.6e-05	Thiophenic compounds
6575	53	94	0	0	1	7	762.812	4e-05	Thiophenic compounds
6576	54	94	0	0	1	8	774.812	4e-06	Thiophenic compounds
6577	55	94	0	0	1	9	786.812	2e-05	Thiophenic compounds
6578	56	94	0	0	1	10	798.812	5e-06	Thiophenic compounds
6579	57	94	0	0	1	11	810.812	8e-06	Thiophenic compounds
6580	59	94	0	0	1	13	834.812	5e-06	Thiophenic compounds
6581	64	94	0	0	1	18	894.812	6e-06	Thiophenic compounds
6582	51	96	0	0	1	4	740.828	7.9e-05	Thiophenic compounds
6583	52	96	0	0	1	5	752.828	3.3e-05	Thiophenic compounds
6584	53	96	0	0	1	6	764.828	5e-05	Thiophenic compounds
6585	54	96	0	0	1	7	776.828	4.3e-05	Thiophenic compounds
6586	55	96	0	0	1	8	788.828	1.2e-05	Thiophenic compounds
6587	56	96	0	0	1	9	800.828	1.6e-05	Thiophenic compounds
6588	58	96	0	0	1	11	824.828	1.5e-05	Thiophenic compounds
6589	63	96	0	0	1	16	884.828	5e-06	Thiophenic compounds
6590	65	96	0	0	1	18	908.828	5e-06	Thiophenic compounds
6591	52	98	0	0	1	4	754.844	6.5e-05	Thiophenic compounds
6592	53	98	0	0	1	5	766.844	4.5e-05	Thiophenic compounds
6593	54	98	0	0	1	6	778.844	4.9e-05	Thiophenic compounds
6594	55	98	0	0	1	7	790.844	2.7e-05	Thiophenic compounds
6595	58	98	0	0	1	10	826.844	1.2e-05	Thiophenic compounds
6596	60	98	0	0	1	12	850.844	6e-06	Thiophenic compounds
6597	61	98	0	0	1	13	862.844	1e-05	Thiophenic compounds
6598	66	98	0	0	1	18	922.844	6e-06	Thiophenic compounds
6599	53	100	0	0	1	4	768.86	5.1e-05	Thiophenic compounds
6600	54	100	0	0	1	5	780.86	2.7e-05	Thiophenic compounds
6601	55	100	0	0	1	6	792.86	5e-06	Thiophenic compounds
6602	56	100	0	0	1	7	804.86	2.8e-05	Thiophenic compounds
6603	58	100	0	0	1	9	828.86	4e-06	Thiophenic compounds
6604	59	100	0	0	1	10	840.86	5e-06	Thiophenic compounds
6605	60	100	0	0	1	11	852.86	5e-06	Thiophenic compounds
6606	61	100	0	0	1	12	864.86	5e-06	Thiophenic compounds
6607	54	102	0	0	1	4	782.876	4.6e-05	Thiophenic compounds
6608	55	102	0	0	1	5	794.876	3e-05	Thiophenic compounds
6609	56	102	0	0	1	6	806.876	1e-05	Thiophenic compounds
6610	58	102	0	0	1	8	830.876	1.2e-05	Thiophenic compounds
6611	59	102	0	0	1	9	842.876	2e-05	Thiophenic compounds
6612	61	102	0	0	1	11	866.876	1.7e-05	Thiophenic compounds
6613	62	102	0	0	1	12	878.876	2.7e-05	Thiophenic compounds
6614	66	102	0	0	1	16	926.876	6e-06	Thiophenic compounds
6615	55	104	0	0	1	4	796.892	5e-05	Thiophenic compounds
6616	56	104	0	0	1	5	808.892	5e-06	Thiophenic compounds
6617	57	104	0	0	1	6	820.892	3.8e-05	Thiophenic compounds
6618	59	104	0	0	1	8	844.892	5e-06	Thiophenic compounds
6619	56	106	0	0	1	4	810.908	3.2e-05	Thiophenic compounds
6620	57	106	0	0	1	5	822.908	1.5e-05	Thiophenic compounds
6621	59	106	0	0	1	7	846.908	1.4e-05	Thiophenic compounds
6622	58	108	0	0	1	5	836.924	4e-06	Thiophenic compounds
6623	58	110	0	0	1	4	838.94	5e-06	Thiophenic compounds
6624	62	110	0	0	1	8	886.94	1e-05	Thiophenic compounds
6625	64	110	0	0	1	10	910.94	6e-06	Thiophenic compounds
6626	65	110	0	0	1	11	922.94	5e-06	Thiophenic compounds
6627	66	110	0	0	1	12	934.94	7e-06	Thiophenic compounds
6628	59	112	0	0	1	4	852.956	5e-06	Thiophenic compounds
6629	61	112	0	0	1	6	876.956	5e-06	Thiophenic compounds
6630	65	112	0	0	1	10	924.956	1.1e-05	Thiophenic compounds
6631	61	114	0	0	1	5	878.972	1e-05	Thiophenic compounds
6632	69	114	0	0	1	13	974.972	5e-06	Thiophenic compounds
6633	62	116	0	0	1	5	892.988	5e-06	Thiophenic compounds
6634	63	116	0	0	1	6	904.988	1.6e-05	Thiophenic compounds
6635	64	118	0	0	1	6	919.004	1.6e-05	Thiophenic compounds
6636	66	122	0	0	1	6	947.036	6e-06	Thiophenic compounds
6637	14	12	0	0	1	9	212.156	3.1e-05	Sulfidic compounds
6638	14	14	0	0	1	8	214.172	1.5e-05	Sulfidic compounds
6639	15	14	0	0	1	9	226.172	4.8e-05	Sulfidic compounds
6640	14	16	0	0	1	7	216.188	3.1e-05	Sulfidic compounds
6641	15	16	0	0	1	8	228.188	2.8e-05	Sulfidic compounds
6642	16	16	0	0	1	9	240.188	7.7e-05	Sulfidic compounds
6643	12	18	0	0	1	4	194.204	7e-06	Sulfidic compounds
6644	14	18	0	0	1	6	218.204	5e-06	Sulfidic compounds
6645	15	18	0	0	1	7	230.204	1.3e-05	Sulfidic compounds
6646	16	18	0	0	1	8	242.204	3e-05	Sulfidic compounds
6647	17	18	0	0	1	9	254.204	0.000133	Sulfidic compounds
6648	12	20	0	0	1	3	196.22	2e-06	Sulfidic compounds
6649	14	20	0	0	1	5	220.22	2e-06	Sulfidic compounds
6650	15	20	0	0	1	6	232.22	1e-06	Sulfidic compounds
6651	16	20	0	0	1	7	244.22	3.2e-05	Sulfidic compounds
6652	17	20	0	0	1	8	256.22	3.2e-05	Sulfidic compounds
6653	18	20	0	0	1	9	268.22	3e-05	Sulfidic compounds
6654	19	20	0	0	1	10	280.22	9.9e-05	Sulfidic compounds
6655	12	22	0	0	1	2	198.236	1e-06	Sulfidic compounds
6656	13	22	0	0	1	3	210.236	1e-06	Sulfidic compounds
6657	14	22	0	0	1	4	222.236	7e-06	Sulfidic compounds
6658	16	22	0	0	1	6	246.236	2.6e-05	Sulfidic compounds
6659	17	22	0	0	1	7	258.236	0.000177	Sulfidic compounds
6660	18	22	0	0	1	8	270.236	4e-05	Sulfidic compounds
6661	19	22	0	0	1	9	282.236	3.5e-05	Sulfidic compounds
6662	20	22	0	0	1	10	294.236	5.9e-05	Sulfidic compounds
6663	13	24	0	0	1	2	212.252	5e-06	Sulfidic compounds
6664	14	24	0	0	1	3	224.252	1.4e-05	Sulfidic compounds
6665	16	24	0	0	1	5	248.252	5e-05	Sulfidic compounds
6666	17	24	0	0	1	6	260.252	5.6e-05	Sulfidic compounds
6667	18	24	0	0	1	7	272.252	7.2e-05	Sulfidic compounds
6668	19	24	0	0	1	8	284.252	7.5e-05	Sulfidic compounds
6669	20	24	0	0	1	9	296.252	0.000148	Sulfidic compounds
6670	21	24	0	0	1	10	308.252	2.8e-05	Sulfidic compounds
6671	14	26	0	0	1	2	226.268	5e-06	Sulfidic compounds
6672	15	26	0	0	1	3	238.268	2e-05	Sulfidic compounds
6673	16	26	0	0	1	4	250.268	9.2e-05	Sulfidic compounds
6674	17	26	0	0	1	5	262.268	0.00016	Sulfidic compounds
6675	18	26	0	0	1	6	274.268	0.000147	Sulfidic compounds
6676	19	26	0	0	1	7	286.268	0.000137	Sulfidic compounds
6677	20	26	0	0	1	8	298.268	0.000115	Sulfidic compounds
6678	21	26	0	0	1	9	310.268	4.2e-05	Sulfidic compounds
6679	22	26	0	0	1	10	322.268	4.3e-05	Sulfidic compounds
6680	15	28	0	0	1	2	240.284	9e-06	Sulfidic compounds
6681	16	28	0	0	1	3	252.284	0.000108	Sulfidic compounds
6682	17	28	0	0	1	4	264.284	0.000235	Sulfidic compounds
6683	18	28	0	0	1	5	276.284	0.000394	Sulfidic compounds
6684	19	28	0	0	1	6	288.284	0.000258	Sulfidic compounds
6685	20	28	0	0	1	7	300.284	0.000231	Sulfidic compounds
6686	21	28	0	0	1	8	312.284	0.000124	Sulfidic compounds
6687	22	28	0	0	1	9	324.284	6.1e-05	Sulfidic compounds
6688	23	28	0	0	1	10	336.284	3.2e-05	Sulfidic compounds
6689	16	30	0	0	1	2	254.3	1.4e-05	Sulfidic compounds
6690	17	30	0	0	1	3	266.3	0.00018	Sulfidic compounds
6691	18	30	0	0	1	4	278.3	0.000504	Sulfidic compounds
6692	19	30	0	0	1	5	290.3	0.000608	Sulfidic compounds
6693	20	30	0	0	1	6	302.3	0.000444	Sulfidic compounds
6694	21	30	0	0	1	7	314.3	0.000346	Sulfidic compounds
6695	22	30	0	0	1	8	326.3	0.000145	Sulfidic compounds
6696	23	30	0	0	1	9	338.3	8.3e-05	Sulfidic compounds
6697	24	30	0	0	1	10	350.3	3.6e-05	Sulfidic compounds
6698	17	32	0	0	1	2	268.316	3.7e-05	Sulfidic compounds
6699	18	32	0	0	1	3	280.316	0.000392	Sulfidic compounds
6700	19	32	0	0	1	4	292.316	0.000678	Sulfidic compounds
6701	20	32	0	0	1	5	304.316	0.000823	Sulfidic compounds
6702	21	32	0	0	1	6	316.316	0.000485	Sulfidic compounds
6703	22	32	0	0	1	7	328.316	0.000313	Sulfidic compounds
6704	23	32	0	0	1	8	340.316	0.000168	Sulfidic compounds
6705	24	32	0	0	1	9	352.316	0.000111	Sulfidic compounds
6706	25	32	0	0	1	10	364.316	4.8e-05	Sulfidic compounds
6707	18	34	0	0	1	2	282.332	7.3e-05	Sulfidic compounds
6708	19	34	0	0	1	3	294.332	0.000497	Sulfidic compounds
6709	20	34	0	0	1	4	306.332	0.00086	Sulfidic compounds
6710	21	34	0	0	1	5	318.332	0.000754	Sulfidic compounds
6711	22	34	0	0	1	6	330.332	0.000643	Sulfidic compounds
6712	23	34	0	0	1	7	342.332	0.000325	Sulfidic compounds
6713	24	34	0	0	1	8	354.332	0.000177	Sulfidic compounds
6714	25	34	0	0	1	9	366.332	7.7e-05	Sulfidic compounds
6715	26	34	0	0	1	10	378.332	3.6e-05	Sulfidic compounds
6716	19	36	0	0	1	2	296.348	5e-05	Sulfidic compounds
6717	20	36	0	0	1	3	308.348	0.000444	Sulfidic compounds
6718	21	36	0	0	1	4	320.348	0.00076	Sulfidic compounds
6719	22	36	0	0	1	5	332.348	0.000827	Sulfidic compounds
6720	23	36	0	0	1	6	344.348	0.000531	Sulfidic compounds
6721	24	36	0	0	1	7	356.348	0.000311	Sulfidic compounds
6722	25	36	0	0	1	8	368.348	0.000148	Sulfidic compounds
6723	26	36	0	0	1	9	380.348	0.000107	Sulfidic compounds
6724	27	36	0	0	1	10	392.348	3.3e-05	Sulfidic compounds
6725	20	38	0	0	1	2	310.364	7.9e-05	Sulfidic compounds
6726	21	38	0	0	1	3	322.364	0.000418	Sulfidic compounds
6727	22	38	0	0	1	4	334.364	0.000699	Sulfidic compounds
6728	23	38	0	0	1	5	346.364	0.000673	Sulfidic compounds
6729	24	38	0	0	1	6	358.364	0.000525	Sulfidic compounds
6730	25	38	0	0	1	7	370.364	0.000317	Sulfidic compounds
6731	26	38	0	0	1	8	382.364	0.000133	Sulfidic compounds
6732	27	38	0	0	1	9	394.364	7.7e-05	Sulfidic compounds
6733	28	38	0	0	1	10	406.364	1.7e-05	Sulfidic compounds
6734	21	40	0	0	1	2	324.38	5.7e-05	Sulfidic compounds
6735	22	40	0	0	1	3	336.38	0.000365	Sulfidic compounds
6736	23	40	0	0	1	4	348.38	0.000606	Sulfidic compounds
6737	24	40	0	0	1	5	360.38	0.000616	Sulfidic compounds
6738	25	40	0	0	1	6	372.38	0.000435	Sulfidic compounds
6739	26	40	0	0	1	7	384.38	0.00029	Sulfidic compounds
6740	27	40	0	0	1	8	396.38	0.00015	Sulfidic compounds
6741	28	40	0	0	1	9	408.38	8.5e-05	Sulfidic compounds
6742	29	40	0	0	1	10	420.38	5.4e-05	Sulfidic compounds
6743	22	42	0	0	1	2	338.396	5.1e-05	Sulfidic compounds
6744	23	42	0	0	1	3	350.396	0.00027	Sulfidic compounds
6745	24	42	0	0	1	4	362.396	0.000501	Sulfidic compounds
6746	25	42	0	0	1	5	374.396	0.000565	Sulfidic compounds
6747	26	42	0	0	1	6	386.396	0.00043	Sulfidic compounds
6748	27	42	0	0	1	7	398.396	0.000259	Sulfidic compounds
6749	28	42	0	0	1	8	410.396	0.000149	Sulfidic compounds
6750	29	42	0	0	1	9	422.396	6.7e-05	Sulfidic compounds
6751	30	42	0	0	1	10	434.396	4.1e-05	Sulfidic compounds
6752	23	44	0	0	1	2	352.412	1.8e-05	Sulfidic compounds
6753	24	44	0	0	1	3	364.412	0.000248	Sulfidic compounds
6754	25	44	0	0	1	4	376.412	0.00044	Sulfidic compounds
6755	26	44	0	0	1	5	388.412	0.000505	Sulfidic compounds
6756	27	44	0	0	1	6	400.412	0.000422	Sulfidic compounds
6757	28	44	0	0	1	7	412.412	0.00022	Sulfidic compounds
6758	29	44	0	0	1	8	424.412	0.000166	Sulfidic compounds
6759	30	44	0	0	1	9	436.412	6.1e-05	Sulfidic compounds
6760	31	44	0	0	1	10	448.412	4.6e-05	Sulfidic compounds
6761	24	46	0	0	1	2	366.428	4.2e-05	Sulfidic compounds
6762	25	46	0	0	1	3	378.428	0.000239	Sulfidic compounds
6763	26	46	0	0	1	4	390.428	0.00041	Sulfidic compounds
6764	27	46	0	0	1	5	402.428	0.000455	Sulfidic compounds
6765	28	46	0	0	1	6	414.428	0.000349	Sulfidic compounds
6766	29	46	0	0	1	7	426.428	0.000213	Sulfidic compounds
6767	30	46	0	0	1	8	438.428	0.000114	Sulfidic compounds
6768	31	46	0	0	1	9	450.428	5.5e-05	Sulfidic compounds
6769	32	46	0	0	1	10	462.428	3.7e-05	Sulfidic compounds
6770	25	48	0	0	1	2	380.444	9e-06	Sulfidic compounds
6771	26	48	0	0	1	3	392.444	0.000189	Sulfidic compounds
6772	27	48	0	0	1	4	404.444	0.000366	Sulfidic compounds
6773	28	48	0	0	1	5	416.444	0.000419	Sulfidic compounds
6774	29	48	0	0	1	6	428.444	0.000384	Sulfidic compounds
6775	30	48	0	0	1	7	440.444	0.00021	Sulfidic compounds
6776	31	48	0	0	1	8	452.444	8.6e-05	Sulfidic compounds
6777	32	48	0	0	1	9	464.444	4.1e-05	Sulfidic compounds
6778	33	48	0	0	1	10	476.444	1.3e-05	Sulfidic compounds
6779	26	50	0	0	1	2	394.46	2e-05	Sulfidic compounds
6780	27	50	0	0	1	3	406.46	0.000171	Sulfidic compounds
6781	28	50	0	0	1	4	418.46	0.000291	Sulfidic compounds
6782	29	50	0	0	1	5	430.46	0.000368	Sulfidic compounds
6783	30	50	0	0	1	6	442.46	0.000289	Sulfidic compounds
6784	31	50	0	0	1	7	454.46	0.000162	Sulfidic compounds
6785	32	50	0	0	1	8	466.46	9.3e-05	Sulfidic compounds
6786	33	50	0	0	1	9	478.46	8e-06	Sulfidic compounds
6787	34	50	0	0	1	10	490.46	9e-06	Sulfidic compounds
6788	28	52	0	0	1	3	420.476	0.000144	Sulfidic compounds
6789	29	52	0	0	1	4	432.476	0.000298	Sulfidic compounds
6790	30	52	0	0	1	5	444.476	0.000359	Sulfidic compounds
6791	31	52	0	0	1	6	456.476	0.000292	Sulfidic compounds
6792	32	52	0	0	1	7	468.476	0.000144	Sulfidic compounds
6793	33	52	0	0	1	8	480.476	0.000109	Sulfidic compounds
6794	34	52	0	0	1	9	492.476	3.8e-05	Sulfidic compounds
6795	35	52	0	0	1	10	504.476	6e-06	Sulfidic compounds
6796	28	54	0	0	1	2	422.492	3e-06	Sulfidic compounds
6797	29	54	0	0	1	3	434.492	0.00012	Sulfidic compounds
6798	30	54	0	0	1	4	446.492	0.000233	Sulfidic compounds
6799	31	54	0	0	1	5	458.492	0.000263	Sulfidic compounds
6800	32	54	0	0	1	6	470.492	0.000233	Sulfidic compounds
6801	33	54	0	0	1	7	482.492	0.000132	Sulfidic compounds
6802	34	54	0	0	1	8	494.492	5.8e-05	Sulfidic compounds
6803	35	54	0	0	1	9	506.492	1.3e-05	Sulfidic compounds
6804	29	56	0	0	1	2	436.508	1e-05	Sulfidic compounds
6805	30	56	0	0	1	3	448.508	0.000112	Sulfidic compounds
6806	31	56	0	0	1	4	460.508	2.9e-05	Sulfidic compounds
6807	32	56	0	0	1	5	472.508	0.000221	Sulfidic compounds
6808	33	56	0	0	1	6	484.508	0.000173	Sulfidic compounds
6809	34	56	0	0	1	7	496.508	0.000107	Sulfidic compounds
6810	35	56	0	0	1	8	508.508	5.2e-05	Sulfidic compounds
6811	30	58	0	0	1	2	450.524	3e-06	Sulfidic compounds
6812	31	58	0	0	1	3	462.524	0.000107	Sulfidic compounds
6813	32	58	0	0	1	4	474.524	4e-06	Sulfidic compounds
6814	33	58	0	0	1	5	486.524	0.000148	Sulfidic compounds
6815	34	58	0	0	1	6	498.524	0.000133	Sulfidic compounds
6816	35	58	0	0	1	7	510.524	9.2e-05	Sulfidic compounds
6817	36	58	0	0	1	8	522.524	4.4e-05	Sulfidic compounds
6818	37	58	0	0	1	9	534.524	1.7e-05	Sulfidic compounds
6819	32	60	0	0	1	3	476.54	6.9e-05	Sulfidic compounds
6820	33	60	0	0	1	4	488.54	0.00012	Sulfidic compounds
6821	34	60	0	0	1	5	500.54	0.000109	Sulfidic compounds
6822	35	60	0	0	1	6	512.54	0.000124	Sulfidic compounds
6823	36	60	0	0	1	7	524.54	7e-05	Sulfidic compounds
6824	37	60	0	0	1	8	536.54	1.1e-05	Sulfidic compounds
6825	38	60	0	0	1	9	548.54	3.3e-05	Sulfidic compounds
6826	32	62	0	0	1	2	478.556	1e-05	Sulfidic compounds
6827	33	62	0	0	1	3	490.556	4.8e-05	Sulfidic compounds
6828	34	62	0	0	1	4	502.556	9.7e-05	Sulfidic compounds
6829	35	62	0	0	1	5	514.556	7.1e-05	Sulfidic compounds
6830	36	62	0	0	1	6	526.556	0.000125	Sulfidic compounds
6831	37	62	0	0	1	7	538.556	6.6e-05	Sulfidic compounds
6832	38	62	0	0	1	8	550.556	2.9e-05	Sulfidic compounds
6833	39	62	0	0	1	9	562.556	5.8e-05	Sulfidic compounds
6834	34	64	0	0	1	3	504.572	4.6e-05	Sulfidic compounds
6835	35	64	0	0	1	4	516.572	8.5e-05	Sulfidic compounds
6836	36	64	0	0	1	5	528.572	8.6e-05	Sulfidic compounds
6837	37	64	0	0	1	6	540.572	7.4e-05	Sulfidic compounds
6838	38	64	0	0	1	7	552.572	4.8e-05	Sulfidic compounds
6839	39	64	0	0	1	8	564.572	2.4e-05	Sulfidic compounds
6840	40	64	0	0	1	9	576.572	4.9e-05	Sulfidic compounds
6841	34	66	0	0	1	2	506.588	4e-06	Sulfidic compounds
6842	35	66	0	0	1	3	518.588	2.6e-05	Sulfidic compounds
6843	36	66	0	0	1	4	530.588	8.6e-05	Sulfidic compounds
6844	37	66	0	0	1	5	542.588	4.6e-05	Sulfidic compounds
6845	38	66	0	0	1	6	554.588	5.7e-05	Sulfidic compounds
6846	39	66	0	0	1	7	566.588	5e-06	Sulfidic compounds
6847	40	66	0	0	1	8	578.588	3.4e-05	Sulfidic compounds
6848	41	66	0	0	1	9	590.588	4e-06	Sulfidic compounds
6849	36	68	0	0	1	3	532.604	6e-05	Sulfidic compounds
6850	37	68	0	0	1	4	544.604	3.9e-05	Sulfidic compounds
6851	38	68	0	0	1	5	556.604	9.5e-05	Sulfidic compounds
6852	39	68	0	0	1	6	568.604	3.6e-05	Sulfidic compounds
6853	40	68	0	0	1	7	580.604	6e-05	Sulfidic compounds
6854	41	68	0	0	1	8	592.604	1.2e-05	Sulfidic compounds
6855	37	70	0	0	1	3	546.62	1.2e-05	Sulfidic compounds
6856	38	70	0	0	1	4	558.62	9e-06	Sulfidic compounds
6857	39	70	0	0	1	5	570.62	1.3e-05	Sulfidic compounds
6858	40	70	0	0	1	6	582.62	6.3e-05	Sulfidic compounds
6859	42	70	0	0	1	8	606.62	1.8e-05	Sulfidic compounds
6860	38	72	0	0	1	3	560.636	3.5e-05	Sulfidic compounds
6861	39	72	0	0	1	4	572.636	2e-05	Sulfidic compounds
6862	40	72	0	0	1	5	584.636	0.000141	Sulfidic compounds
6863	41	72	0	0	1	6	596.636	2.8e-05	Sulfidic compounds
6864	42	72	0	0	1	7	608.636	5e-06	Sulfidic compounds
6865	39	74	0	0	1	3	574.652	4e-06	Sulfidic compounds
6866	40	74	0	0	1	4	586.652	1.8e-05	Sulfidic compounds
6867	41	74	0	0	1	5	598.652	2.3e-05	Sulfidic compounds
6868	42	74	0	0	1	6	610.652	4e-06	Sulfidic compounds
6869	40	76	0	0	1	3	588.668	2.4e-05	Sulfidic compounds
6870	41	76	0	0	1	4	600.668	5e-05	Sulfidic compounds
6871	42	76	0	0	1	5	612.668	7.8e-05	Sulfidic compounds
6872	42	78	0	0	1	4	614.684	6.3e-05	Sulfidic compounds
6873	42	80	0	0	1	3	616.7	1.2e-05	Sulfidic compounds
6874	45	80	0	0	1	6	652.7	5e-06	Sulfidic compounds
6875	13	10	1	0	0	9	182.08	9e-06	Acidic fraction
6876	12	10	2	0	0	8	186.08	1.1e-05	Acidic fraction
6877	28	10	2	0	0	24	378.08	2.8e-05	Acidic fraction
6878	11	12	2	0	0	6	176.096	1.2e-05	Acidic fraction
6879	13	12	1	0	0	8	184.096	0.000789	Acidic fraction
6880	14	12	1	0	0	9	196.096	6.6e-05	Acidic fraction
6881	13	12	2	0	0	8	200.096	4.3e-05	Acidic fraction
6882	15	12	1	0	0	10	208.096	2e-05	Acidic fraction
6883	14	12	2	0	0	9	212.096	9e-06	Acidic fraction
6884	16	12	1	0	0	11	220.096	7.5e-05	Acidic fraction
6885	15	12	2	0	0	10	224.096	1.6e-05	Acidic fraction
6886	17	12	1	0	0	12	232.096	8e-06	Acidic fraction
6887	19	12	1	0	0	14	256.096	3.5e-05	Acidic fraction
6888	18	12	2	0	0	13	260.096	6e-06	Acidic fraction
6889	24	12	1	0	0	19	316.096	9e-06	Acidic fraction
6890	12	14	1	0	0	6	174.112	9e-06	Acidic fraction
6891	11	14	2	0	0	5	178.112	0.000167	Acidic fraction
6892	13	14	1	0	0	7	186.112	1.2e-05	Acidic fraction
6893	12	14	2	0	0	6	190.112	5e-05	Acidic fraction
6894	14	14	1	0	0	8	198.112	0.002829	Acidic fraction
6895	13	14	2	0	0	7	202.112	9e-06	Acidic fraction
6896	15	14	1	0	0	9	210.112	0.000187	Acidic fraction
6897	14	14	2	0	0	8	214.112	3.2e-05	Acidic fraction
6898	16	14	1	0	0	10	222.112	3.6e-05	Acidic fraction
6899	15	14	2	0	0	9	226.112	7e-06	Acidic fraction
6900	17	14	1	0	0	11	234.112	0.000528	Acidic fraction
6901	16	14	2	0	0	10	238.112	2e-05	Acidic fraction
6902	18	14	1	0	0	12	246.112	5.2e-05	Acidic fraction
6903	19	14	1	0	0	13	258.112	3.5e-05	Acidic fraction
6904	20	14	1	0	0	14	270.112	0.000233	Acidic fraction
6905	19	14	2	0	0	13	274.112	0.000105	Acidic fraction
6906	21	14	1	0	0	15	282.112	1.3e-05	Acidic fraction
6907	23	14	1	0	0	17	306.112	8e-06	Acidic fraction
6908	11	16	1	0	0	4	164.128	0.006303	Acidic fraction
6909	12	16	1	0	0	5	176.128	0.000166	Acidic fraction
6910	11	16	2	0	0	4	180.128	2.9e-05	Acidic fraction
6911	13	16	1	0	0	6	188.128	0.000201	Acidic fraction
6912	12	16	2	0	0	5	192.128	6.9e-05	Acidic fraction
6913	14	16	1	0	0	7	200.128	1.6e-05	Acidic fraction
6914	13	16	2	0	0	6	204.128	0.000383	Acidic fraction
6915	15	16	1	0	0	8	212.128	0.002751	Acidic fraction
6916	14	16	2	0	0	7	216.128	1e-05	Acidic fraction
6917	16	16	1	0	0	9	224.128	0.000289	Acidic fraction
6918	15	16	2	0	0	8	228.128	7.2e-05	Acidic fraction
6919	17	16	1	0	0	10	236.128	3.7e-05	Acidic fraction
6920	16	16	2	0	0	9	240.128	3e-05	Acidic fraction
6921	18	16	1	0	0	11	248.128	0.000981	Acidic fraction
6922	17	16	2	0	0	10	252.128	3.6e-05	Acidic fraction
6923	19	16	1	0	0	12	260.128	0.000171	Acidic fraction
6924	20	16	1	0	0	13	272.128	0.000203	Acidic fraction
6925	19	16	2	0	0	12	276.128	8e-06	Acidic fraction
6926	21	16	1	0	0	14	284.128	0.00038	Acidic fraction
6927	20	16	2	0	0	13	288.128	0.000503	Acidic fraction
6928	22	16	1	0	0	15	296.128	6.9e-05	Acidic fraction
6929	23	16	1	0	0	16	308.128	3.1e-05	Acidic fraction
6930	24	16	1	0	0	17	320.128	5.9e-05	Acidic fraction
6931	9	18	2	0	0	1	158.144	2.1e-05	Acidic fraction
6932	10	18	2	0	0	2	170.144	1.3e-05	Acidic fraction
6933	12	18	1	0	0	4	178.144	0.000321	Acidic fraction
6934	11	18	2	0	0	3	182.144	2.6e-05	Acidic fraction
6935	13	18	1	0	0	5	190.144	0.000608	Acidic fraction
6936	12	18	2	0	0	4	194.144	3.1e-05	Acidic fraction
6937	14	18	1	0	0	6	202.144	0.000591	Acidic fraction
6938	13	18	2	0	0	5	206.144	4.1e-05	Acidic fraction
6939	15	18	1	0	0	7	214.144	0.000107	Acidic fraction
6940	14	18	2	0	0	6	218.144	2.6e-05	Acidic fraction
6941	16	18	1	0	0	8	226.144	0.002438	Acidic fraction
6942	15	18	2	0	0	7	230.144	1.2e-05	Acidic fraction
6943	17	18	1	0	0	9	238.144	0.00063	Acidic fraction
6944	16	18	2	0	0	8	242.144	2.4e-05	Acidic fraction
6945	18	18	1	0	0	10	250.144	9.2e-05	Acidic fraction
6946	17	18	2	0	0	9	254.144	3e-05	Acidic fraction
6947	19	18	1	0	0	11	262.144	0.000916	Acidic fraction
6948	18	18	2	0	0	10	266.144	1.4e-05	Acidic fraction
6949	20	18	1	0	0	12	274.144	0.000399	Acidic fraction
6950	19	18	2	0	0	11	278.144	7e-06	Acidic fraction
6951	21	18	1	0	0	13	286.144	0.000382	Acidic fraction
6952	20	18	2	0	0	12	290.144	1.3e-05	Acidic fraction
6953	22	18	1	0	0	14	298.144	0.000472	Acidic fraction
6954	21	18	2	0	0	13	302.144	0.000971	Acidic fraction
6955	23	18	1	0	0	15	310.144	9e-05	Acidic fraction
6956	22	18	2	0	0	14	314.144	1.6e-05	Acidic fraction
6957	24	18	1	0	0	16	322.144	8.7e-05	Acidic fraction
6958	25	18	1	0	0	17	334.144	0.000121	Acidic fraction
6959	24	18	2	0	0	16	338.144	2.8e-05	Acidic fraction
6960	26	18	1	0	0	18	346.144	1.5e-05	Acidic fraction
6961	10	20	2	0	0	1	172.16	0.002418	Acidic fraction
6962	11	20	2	0	0	2	184.16	0.00012	Acidic fraction
6963	13	20	1	0	0	4	192.16	0.000314	Acidic fraction
6964	12	20	2	0	0	3	196.16	0.00072	Acidic fraction
6965	14	20	1	0	0	5	204.16	0.000724	Acidic fraction
6966	13	20	2	0	0	4	208.16	0.000304	Acidic fraction
6967	15	20	1	0	0	6	216.16	0.001036	Acidic fraction
6968	14	20	2	0	0	5	220.16	8.1e-05	Acidic fraction
6969	16	20	1	0	0	7	228.16	0.000368	Acidic fraction
6970	15	20	2	0	0	6	232.16	3.1e-05	Acidic fraction
6971	17	20	1	0	0	8	240.16	0.001991	Acidic fraction
6972	16	20	2	0	0	7	244.16	1.4e-05	Acidic fraction
6973	18	20	1	0	0	9	252.16	0.001198	Acidic fraction
6974	17	20	2	0	0	8	256.16	1.1e-05	Acidic fraction
6975	19	20	1	0	0	10	264.16	0.000251	Acidic fraction
6976	18	20	2	0	0	9	268.16	2.6e-05	Acidic fraction
6977	20	20	1	0	0	11	276.16	0.000604	Acidic fraction
6978	19	20	2	0	0	10	280.16	1.2e-05	Acidic fraction
6979	21	20	1	0	0	12	288.16	0.000525	Acidic fraction
6980	20	20	2	0	0	11	292.16	1.2e-05	Acidic fraction
6981	22	20	1	0	0	13	300.16	0.000527	Acidic fraction
6982	21	20	2	0	0	12	304.16	1.9e-05	Acidic fraction
6983	23	20	1	0	0	14	312.16	0.000358	Acidic fraction
6984	22	20	2	0	0	13	316.16	0.001031	Acidic fraction
6985	24	20	1	0	0	15	324.16	0.000145	Acidic fraction
6986	23	20	2	0	0	14	328.16	2.1e-05	Acidic fraction
6987	25	20	1	0	0	16	336.16	0.000127	Acidic fraction
6988	24	20	2	0	0	15	340.16	1.1e-05	Acidic fraction
6989	26	20	1	0	0	17	348.16	0.000132	Acidic fraction
6990	25	20	2	0	0	16	352.16	1.9e-05	Acidic fraction
6991	27	20	1	0	0	18	360.16	6.2e-05	Acidic fraction
6992	26	20	2	0	0	17	364.16	2.4e-05	Acidic fraction
6993	12	22	1	0	0	2	182.176	5e-06	Acidic fraction
6994	11	22	2	0	0	1	186.176	0.001202	Acidic fraction
6995	13	22	1	0	0	3	194.176	1.3e-05	Acidic fraction
6996	12	22	2	0	0	2	198.176	0.000229	Acidic fraction
6997	14	22	1	0	0	4	206.176	0.01023	Acidic fraction
6998	13	22	2	0	0	3	210.176	0.000472	Acidic fraction
6999	15	22	1	0	0	5	218.176	0.000787	Acidic fraction
7000	14	22	2	0	0	4	222.176	0.008679	Acidic fraction
7001	16	22	1	0	0	6	230.176	0.001522	Acidic fraction
7002	15	22	2	0	0	5	234.176	0.001071	Acidic fraction
7003	17	22	1	0	0	7	242.176	0.00093	Acidic fraction
7004	16	22	2	0	0	6	246.176	6e-05	Acidic fraction
7005	18	22	1	0	0	8	254.176	0.001736	Acidic fraction
7006	17	22	2	0	0	7	258.176	2.8e-05	Acidic fraction
7007	19	22	1	0	0	9	266.176	0.001601	Acidic fraction
7008	18	22	2	0	0	8	270.176	2e-05	Acidic fraction
7009	20	22	1	0	0	10	278.176	0.000542	Acidic fraction
7010	19	22	2	0	0	9	282.176	1.1e-05	Acidic fraction
7011	21	22	1	0	0	11	290.176	0.000578	Acidic fraction
7012	20	22	2	0	0	10	294.176	0.000141	Acidic fraction
7013	22	22	1	0	0	12	302.176	0.000518	Acidic fraction
7014	21	22	2	0	0	11	306.176	2.1e-05	Acidic fraction
7015	23	22	1	0	0	13	314.176	0.000543	Acidic fraction
7016	22	22	2	0	0	12	318.176	1.1e-05	Acidic fraction
7017	24	22	1	0	0	14	326.176	0.000298	Acidic fraction
7018	23	22	2	0	0	13	330.176	0.0007	Acidic fraction
7019	25	22	1	0	0	15	338.176	0.000134	Acidic fraction
7020	24	22	2	0	0	14	342.176	6.4e-05	Acidic fraction
7021	26	22	1	0	0	16	350.176	0.000136	Acidic fraction
7022	25	22	2	0	0	15	354.176	9e-06	Acidic fraction
7023	27	22	1	0	0	17	362.176	0.000106	Acidic fraction
7024	26	22	2	0	0	16	366.176	1.4e-05	Acidic fraction
7025	28	22	1	0	0	18	374.176	8.1e-05	Acidic fraction
7026	27	22	2	0	0	17	378.176	3.8e-05	Acidic fraction
7027	29	22	1	0	0	19	386.176	1.6e-05	Acidic fraction
7028	30	22	2	0	0	20	414.176	1e-05	Acidic fraction
7029	12	24	1	0	0	1	184.192	8e-06	Acidic fraction
7030	12	24	2	0	0	1	200.192	0.026027	Acidic fraction
7031	13	24	2	0	0	2	212.192	0.000107	Acidic fraction
7032	15	24	1	0	0	4	220.192	0.010689	Acidic fraction
7033	14	24	2	0	0	3	224.192	0.000178	Acidic fraction
7034	16	24	1	0	0	5	232.192	0.000794	Acidic fraction
7035	15	24	2	0	0	4	236.192	0.000836	Acidic fraction
7036	17	24	1	0	0	6	244.192	0.001408	Acidic fraction
7037	16	24	2	0	0	5	248.192	0.000169	Acidic fraction
7038	18	24	1	0	0	7	256.192	0.001583	Acidic fraction
7039	17	24	2	0	0	6	260.192	3e-05	Acidic fraction
7040	19	24	1	0	0	8	268.192	0.001601	Acidic fraction
7041	18	24	2	0	0	7	272.192	5.5e-05	Acidic fraction
7042	20	24	1	0	0	9	280.192	0.001741	Acidic fraction
7043	19	24	2	0	0	8	284.192	2.6e-05	Acidic fraction
7044	21	24	1	0	0	10	292.192	0.000942	Acidic fraction
7045	20	24	2	0	0	9	296.192	2.7e-05	Acidic fraction
7046	22	24	1	0	0	11	304.192	0.000597	Acidic fraction
7047	21	24	2	0	0	10	308.192	3.8e-05	Acidic fraction
7048	23	24	1	0	0	12	316.192	0.00049	Acidic fraction
7049	22	24	2	0	0	11	320.192	2.4e-05	Acidic fraction
7050	24	24	1	0	0	13	328.192	0.000507	Acidic fraction
7051	23	24	2	0	0	12	332.192	1.6e-05	Acidic fraction
7052	25	24	1	0	0	14	340.192	0.00025	Acidic fraction
7053	24	24	2	0	0	13	344.192	0.000447	Acidic fraction
7054	26	24	1	0	0	15	352.192	0.000121	Acidic fraction
7055	25	24	2	0	0	14	356.192	0.000112	Acidic fraction
7056	27	24	1	0	0	16	364.192	9.3e-05	Acidic fraction
7057	26	24	2	0	0	15	368.192	4.2e-05	Acidic fraction
7058	28	24	1	0	0	17	376.192	0.000114	Acidic fraction
7059	27	24	2	0	0	16	380.192	3.2e-05	Acidic fraction
7060	29	24	1	0	0	18	388.192	6.7e-05	Acidic fraction
7061	28	24	2	0	0	17	392.192	7.1e-05	Acidic fraction
7062	30	24	1	0	0	19	400.192	1.6e-05	Acidic fraction
7063	13	26	1	0	0	1	198.208	8e-06	Acidic fraction
7064	13	26	2	0	0	1	214.208	0.002681	Acidic fraction
7065	14	26	2	0	0	2	226.208	0.001328	Acidic fraction
7066	16	26	1	0	0	4	234.208	0.002649	Acidic fraction
7067	15	26	2	0	0	3	238.208	0.000162	Acidic fraction
7068	17	26	1	0	0	5	246.208	0.000565	Acidic fraction
7069	16	26	2	0	0	4	250.208	0.000268	Acidic fraction
7070	18	26	1	0	0	6	258.208	0.001383	Acidic fraction
7071	17	26	2	0	0	5	262.208	0.000109	Acidic fraction
7072	19	26	1	0	0	7	270.208	0.002212	Acidic fraction
7073	18	26	2	0	0	6	274.208	0.000139	Acidic fraction
7074	20	26	1	0	0	8	282.208	0.001357	Acidic fraction
7075	19	26	2	0	0	7	286.208	5.9e-05	Acidic fraction
7076	21	26	1	0	0	9	294.208	0.001687	Acidic fraction
7077	20	26	2	0	0	8	298.208	4e-05	Acidic fraction
7078	22	26	1	0	0	10	306.208	0.001123	Acidic fraction
7079	21	26	2	0	0	9	310.208	3.3e-05	Acidic fraction
7080	23	26	1	0	0	11	318.208	0.0007	Acidic fraction
7081	22	26	2	0	0	10	322.208	4.3e-05	Acidic fraction
7082	24	26	1	0	0	12	330.208	0.000463	Acidic fraction
7083	23	26	2	0	0	11	334.208	2.6e-05	Acidic fraction
7084	25	26	1	0	0	13	342.208	0.000419	Acidic fraction
7085	24	26	2	0	0	12	346.208	1e-05	Acidic fraction
7086	26	26	1	0	0	14	354.208	0.000274	Acidic fraction
7087	25	26	2	0	0	13	358.208	0.000331	Acidic fraction
7088	27	26	1	0	0	15	366.208	0.000168	Acidic fraction
7089	26	26	2	0	0	14	370.208	0.000164	Acidic fraction
7090	28	26	1	0	0	16	378.208	0.000102	Acidic fraction
7091	27	26	2	0	0	15	382.208	8.7e-05	Acidic fraction
7092	29	26	1	0	0	17	390.208	0.000113	Acidic fraction
7093	30	26	1	0	0	18	402.208	5.8e-05	Acidic fraction
7094	29	26	2	0	0	17	406.208	3.5e-05	Acidic fraction
7095	31	26	1	0	0	19	414.208	1.5e-05	Acidic fraction
7096	30	26	2	0	0	18	418.208	1e-05	Acidic fraction
7097	37	26	2	0	0	25	502.208	0.000165	Acidic fraction
7098	14	28	1	0	0	1	212.224	1.6e-05	Acidic fraction
7099	14	28	2	0	0	1	228.224	0.023406	Acidic fraction
7100	15	28	2	0	0	2	240.224	0.001199	Acidic fraction
7101	17	28	1	0	0	4	248.224	0.000558	Acidic fraction
7102	16	28	2	0	0	3	252.224	0.000519	Acidic fraction
7103	18	28	1	0	0	5	260.224	0.000523	Acidic fraction
7104	17	28	2	0	0	4	264.224	0.00024	Acidic fraction
7105	19	28	1	0	0	6	272.224	0.001505	Acidic fraction
7106	18	28	2	0	0	5	276.224	0.003019	Acidic fraction
7107	20	28	1	0	0	7	284.224	0.00209	Acidic fraction
7108	19	28	2	0	0	6	288.224	7e-05	Acidic fraction
7109	21	28	1	0	0	8	296.224	0.002265	Acidic fraction
7110	20	28	2	0	0	7	300.224	0.002239	Acidic fraction
7111	22	28	1	0	0	9	308.224	0.00143	Acidic fraction
7112	21	28	2	0	0	8	312.224	8.4e-05	Acidic fraction
7113	23	28	1	0	0	10	320.224	0.001132	Acidic fraction
7114	22	28	2	0	0	9	324.224	2.2e-05	Acidic fraction
7115	24	28	1	0	0	11	332.224	0.000775	Acidic fraction
7116	23	28	2	0	0	10	336.224	9e-06	Acidic fraction
7117	25	28	1	0	0	12	344.224	0.000506	Acidic fraction
7118	24	28	2	0	0	11	348.224	2.7e-05	Acidic fraction
7119	26	28	1	0	0	13	356.224	0.000424	Acidic fraction
7120	25	28	2	0	0	12	360.224	1.9e-05	Acidic fraction
7121	27	28	1	0	0	14	368.224	0.000268	Acidic fraction
7122	26	28	2	0	0	13	372.224	0.000185	Acidic fraction
7123	28	28	1	0	0	15	380.224	0.000149	Acidic fraction
7124	27	28	2	0	0	14	384.224	0.000234	Acidic fraction
7125	29	28	1	0	0	16	392.224	0.000111	Acidic fraction
7126	28	28	2	0	0	15	396.224	8.7e-05	Acidic fraction
7127	30	28	1	0	0	17	404.224	6.8e-05	Acidic fraction
7128	29	28	2	0	0	16	408.224	1e-05	Acidic fraction
7129	31	28	1	0	0	18	416.224	4.4e-05	Acidic fraction
7130	30	28	2	0	0	17	420.224	2.5e-05	Acidic fraction
7131	32	28	1	0	0	19	428.224	2e-05	Acidic fraction
7132	33	28	1	0	0	20	440.224	1.3e-05	Acidic fraction
7133	15	30	1	0	0	1	226.24	2.7e-05	Acidic fraction
7134	15	30	2	0	0	1	242.24	0.015657	Acidic fraction
7135	17	30	1	0	0	3	250.24	1e-05	Acidic fraction
7136	16	30	2	0	0	2	254.24	0.016615	Acidic fraction
7137	18	30	1	0	0	4	262.24	0.000425	Acidic fraction
7138	17	30	2	0	0	3	266.24	0.000296	Acidic fraction
7139	19	30	1	0	0	5	274.24	0.00048	Acidic fraction
7140	18	30	2	0	0	4	278.24	0.006943	Acidic fraction
7141	20	30	1	0	0	6	286.24	0.001307	Acidic fraction
7142	19	30	2	0	0	5	290.24	0.000165	Acidic fraction
7143	21	30	1	0	0	7	298.24	0.002175	Acidic fraction
7144	20	30	2	0	0	6	302.24	0.001247	Acidic fraction
7145	22	30	1	0	0	8	310.24	0.002294	Acidic fraction
7146	21	30	2	0	0	7	314.24	0.002022	Acidic fraction
7147	23	30	1	0	0	9	322.24	0.001474	Acidic fraction
7148	22	30	2	0	0	8	326.24	7.1e-05	Acidic fraction
7149	24	30	1	0	0	10	334.24	0.000998	Acidic fraction
7150	23	30	2	0	0	9	338.24	2.3e-05	Acidic fraction
7151	25	30	1	0	0	11	346.24	0.000764	Acidic fraction
7152	24	30	2	0	0	10	350.24	2.2e-05	Acidic fraction
7153	26	30	1	0	0	12	358.24	0.000543	Acidic fraction
7154	25	30	2	0	0	11	362.24	1.1e-05	Acidic fraction
7155	27	30	1	0	0	13	370.24	0.000407	Acidic fraction
7156	26	30	2	0	0	12	374.24	2.9e-05	Acidic fraction
7157	28	30	1	0	0	14	382.24	0.000274	Acidic fraction
7158	27	30	2	0	0	13	386.24	0.000122	Acidic fraction
7159	29	30	1	0	0	15	394.24	0.000179	Acidic fraction
7160	28	30	2	0	0	14	398.24	0.000195	Acidic fraction
7161	30	30	1	0	0	16	406.24	0.000129	Acidic fraction
7162	29	30	2	0	0	15	410.24	6.2e-05	Acidic fraction
7163	31	30	1	0	0	17	418.24	6.8e-05	Acidic fraction
7164	30	30	2	0	0	16	422.24	1.7e-05	Acidic fraction
7165	32	30	1	0	0	18	430.24	2.6e-05	Acidic fraction
7166	31	30	2	0	0	17	434.24	1.5e-05	Acidic fraction
7167	16	32	1	0	0	1	240.256	3.8e-05	Acidic fraction
7168	17	32	1	0	0	2	252.256	1.1e-05	Acidic fraction
7169	16	32	2	0	0	1	256.256	0.139487	Acidic fraction
7170	17	32	2	0	0	2	268.256	0.002397	Acidic fraction
7171	19	32	1	0	0	4	276.256	0.000471	Acidic fraction
7172	18	32	2	0	0	3	280.256	0.085077	Acidic fraction
7173	20	32	1	0	0	5	288.256	0.000501	Acidic fraction
7174	19	32	2	0	0	4	292.256	0.000236	Acidic fraction
7175	21	32	1	0	0	6	300.256	0.001164	Acidic fraction
7176	20	32	2	0	0	5	304.256	0.000653	Acidic fraction
7177	22	32	1	0	0	7	312.256	0.001845	Acidic fraction
7178	21	32	2	0	0	6	316.256	6.7e-05	Acidic fraction
7179	23	32	1	0	0	8	324.256	0.002177	Acidic fraction
7180	22	32	2	0	0	7	328.256	0.000105	Acidic fraction
7181	24	32	1	0	0	9	336.256	0.001434	Acidic fraction
7182	23	32	2	0	0	8	340.256	5e-05	Acidic fraction
7183	25	32	1	0	0	10	348.256	0.000908	Acidic fraction
7184	24	32	2	0	0	9	352.256	1.7e-05	Acidic fraction
7185	26	32	1	0	0	11	360.256	0.00072	Acidic fraction
7186	25	32	2	0	0	10	364.256	1.2e-05	Acidic fraction
7187	27	32	1	0	0	12	372.256	0.000552	Acidic fraction
7188	26	32	2	0	0	11	376.256	4.2e-05	Acidic fraction
7189	28	32	1	0	0	13	384.256	0.000387	Acidic fraction
7190	27	32	2	0	0	12	388.256	1.7e-05	Acidic fraction
7191	29	32	1	0	0	14	396.256	0.000232	Acidic fraction
7192	28	32	2	0	0	13	400.256	7.3e-05	Acidic fraction
7193	30	32	1	0	0	15	408.256	0.000145	Acidic fraction
7194	29	32	2	0	0	14	412.256	0.000152	Acidic fraction
7195	31	32	1	0	0	16	420.256	0.000105	Acidic fraction
7196	30	32	2	0	0	15	424.256	6.5e-05	Acidic fraction
7197	32	32	1	0	0	17	432.256	6.2e-05	Acidic fraction
7198	31	32	2	0	0	16	436.256	1.4e-05	Acidic fraction
7199	33	32	1	0	0	18	444.256	2.5e-05	Acidic fraction
7200	32	32	2	0	0	17	448.256	2e-05	Acidic fraction
7201	17	34	1	0	0	1	254.272	2.5e-05	Acidic fraction
7202	17	34	2	0	0	1	270.272	0.007776	Acidic fraction
7203	19	34	1	0	0	3	278.272	8e-06	Acidic fraction
7204	18	34	2	0	0	2	282.272	0.089499	Acidic fraction
7205	20	34	1	0	0	4	290.272	0.000516	Acidic fraction
7206	19	34	2	0	0	3	294.272	0.000216	Acidic fraction
7207	21	34	1	0	0	5	302.272	0.000441	Acidic fraction
7208	20	34	2	0	0	4	306.272	0.000292	Acidic fraction
7209	22	34	1	0	0	6	314.272	0.001031	Acidic fraction
7210	21	34	2	0	0	5	318.272	0.000137	Acidic fraction
7211	23	34	1	0	0	7	326.272	0.001584	Acidic fraction
7212	22	34	2	0	0	6	330.272	8.4e-05	Acidic fraction
7213	24	34	1	0	0	8	338.272	0.001993	Acidic fraction
7214	23	34	2	0	0	7	342.272	6.6e-05	Acidic fraction
7215	25	34	1	0	0	9	350.272	0.001249	Acidic fraction
7216	24	34	2	0	0	8	354.272	2.1e-05	Acidic fraction
7217	26	34	1	0	0	10	362.272	0.000832	Acidic fraction
7218	27	34	1	0	0	11	374.272	0.000688	Acidic fraction
7219	26	34	2	0	0	10	378.272	1.7e-05	Acidic fraction
7220	28	34	1	0	0	12	386.272	0.000478	Acidic fraction
7221	27	34	2	0	0	11	390.272	1.8e-05	Acidic fraction
7222	29	34	1	0	0	13	398.272	0.000335	Acidic fraction
7223	28	34	2	0	0	12	402.272	3.6e-05	Acidic fraction
7224	30	34	1	0	0	14	410.272	0.000217	Acidic fraction
7225	29	34	2	0	0	13	414.272	7.7e-05	Acidic fraction
7226	31	34	1	0	0	15	422.272	0.000124	Acidic fraction
7227	30	34	2	0	0	14	426.272	9.6e-05	Acidic fraction
7228	32	34	1	0	0	16	434.272	8.9e-05	Acidic fraction
7229	31	34	2	0	0	15	438.272	6.7e-05	Acidic fraction
7230	33	34	1	0	0	17	446.272	6.8e-05	Acidic fraction
7231	32	34	2	0	0	16	450.272	1.5e-05	Acidic fraction
7232	34	34	1	0	0	18	458.272	2.4e-05	Acidic fraction
7233	35	34	1	0	0	19	470.272	1.2e-05	Acidic fraction
7234	18	36	1	0	0	1	268.288	3.1e-05	Acidic fraction
7235	18	36	2	0	0	1	284.288	0.048782	Acidic fraction
7236	19	36	2	0	0	2	296.288	0.000303	Acidic fraction
7237	21	36	1	0	0	4	304.288	0.000459	Acidic fraction
7238	20	36	2	0	0	3	308.288	0.000458	Acidic fraction
7239	22	36	1	0	0	5	316.288	0.00057	Acidic fraction
7240	21	36	2	0	0	4	320.288	0.000204	Acidic fraction
7241	23	36	1	0	0	6	328.288	0.000854	Acidic fraction
7242	22	36	2	0	0	5	332.288	0.000179	Acidic fraction
7243	24	36	1	0	0	7	340.288	0.001353	Acidic fraction
7244	23	36	2	0	0	6	344.288	7e-05	Acidic fraction
7245	25	36	1	0	0	8	352.288	0.001727	Acidic fraction
7246	24	36	2	0	0	7	356.288	5.8e-05	Acidic fraction
7247	26	36	1	0	0	9	364.288	0.001175	Acidic fraction
7248	25	36	2	0	0	8	368.288	4.2e-05	Acidic fraction
7249	27	36	1	0	0	10	376.288	0.000863	Acidic fraction
7250	28	36	1	0	0	11	388.288	0.000628	Acidic fraction
7251	27	36	2	0	0	10	392.288	1.1e-05	Acidic fraction
7252	29	36	1	0	0	12	400.288	0.000419	Acidic fraction
7253	28	36	2	0	0	11	404.288	0.000437	Acidic fraction
7254	30	36	1	0	0	13	412.288	0.000317	Acidic fraction
7255	29	36	2	0	0	12	416.288	1.5e-05	Acidic fraction
7256	31	36	1	0	0	14	424.288	0.000188	Acidic fraction
7257	30	36	2	0	0	13	428.288	6.4e-05	Acidic fraction
7258	32	36	1	0	0	15	436.288	0.000115	Acidic fraction
7259	31	36	2	0	0	14	440.288	7.1e-05	Acidic fraction
7260	33	36	1	0	0	16	448.288	8.6e-05	Acidic fraction
7261	32	36	2	0	0	15	452.288	3.3e-05	Acidic fraction
7262	34	36	1	0	0	17	460.288	4.6e-05	Acidic fraction
7263	33	36	2	0	0	16	464.288	1.8e-05	Acidic fraction
7264	18	38	2	0	0	0	286.304	1.6e-05	Acidic fraction
7265	19	38	2	0	0	1	298.304	0.00066	Acidic fraction
7266	20	38	2	0	0	2	310.304	0.001102	Acidic fraction
7267	22	38	1	0	0	4	318.304	0.000501	Acidic fraction
7268	21	38	2	0	0	3	322.304	0.000244	Acidic fraction
7269	23	38	1	0	0	5	330.304	0.000393	Acidic fraction
7270	22	38	2	0	0	4	334.304	0.000196	Acidic fraction
7271	24	38	1	0	0	6	342.304	0.000826	Acidic fraction
7272	23	38	2	0	0	5	346.304	0.000139	Acidic fraction
7273	25	38	1	0	0	7	354.304	0.001172	Acidic fraction
7274	24	38	2	0	0	6	358.304	0.000118	Acidic fraction
7275	26	38	1	0	0	8	366.304	0.001328	Acidic fraction
7276	25	38	2	0	0	7	370.304	4.4e-05	Acidic fraction
7277	27	38	1	0	0	9	378.304	0.001113	Acidic fraction
7278	26	38	2	0	0	8	382.304	4.5e-05	Acidic fraction
7279	28	38	1	0	0	10	390.304	0.000701	Acidic fraction
7280	27	38	2	0	0	9	394.304	2.8e-05	Acidic fraction
7281	29	38	1	0	0	11	402.304	0.000529	Acidic fraction
7282	28	38	2	0	0	10	406.304	2.8e-05	Acidic fraction
7283	30	38	1	0	0	12	414.304	0.000368	Acidic fraction
7284	29	38	2	0	0	11	418.304	5e-05	Acidic fraction
7285	31	38	1	0	0	13	426.304	0.000278	Acidic fraction
7286	32	38	1	0	0	14	438.304	0.000196	Acidic fraction
7287	31	38	2	0	0	13	442.304	2.7e-05	Acidic fraction
7288	33	38	1	0	0	15	450.304	0.000128	Acidic fraction
7289	32	38	2	0	0	14	454.304	3.5e-05	Acidic fraction
7290	34	38	1	0	0	16	462.304	7.4e-05	Acidic fraction
7291	33	38	2	0	0	15	466.304	1.3e-05	Acidic fraction
7292	35	38	1	0	0	17	474.304	2.8e-05	Acidic fraction
7293	20	40	1	0	0	1	296.32	8e-06	Acidic fraction
7294	20	40	2	0	0	1	312.32	0.002277	Acidic fraction
7295	21	40	2	0	0	2	324.32	0.000185	Acidic fraction
7296	23	40	1	0	0	4	332.32	0.000524	Acidic fraction
7297	22	40	2	0	0	3	336.32	0.000247	Acidic fraction
7298	24	40	1	0	0	5	344.32	0.000343	Acidic fraction
7299	23	40	2	0	0	4	348.32	0.000181	Acidic fraction
7300	25	40	1	0	0	6	356.32	0.00073	Acidic fraction
7301	24	40	2	0	0	5	360.32	0.000135	Acidic fraction
7302	26	40	1	0	0	7	368.32	0.000959	Acidic fraction
7303	25	40	2	0	0	6	372.32	9.2e-05	Acidic fraction
7304	27	40	1	0	0	8	380.32	0.001262	Acidic fraction
7305	26	40	2	0	0	7	384.32	6.6e-05	Acidic fraction
7306	28	40	1	0	0	9	392.32	0.000953	Acidic fraction
7307	27	40	2	0	0	8	396.32	0.000171	Acidic fraction
7308	29	40	1	0	0	10	404.32	0.000635	Acidic fraction
7309	28	40	2	0	0	9	408.32	2.4e-05	Acidic fraction
7310	30	40	1	0	0	11	416.32	0.000414	Acidic fraction
7311	31	40	1	0	0	12	428.32	0.000324	Acidic fraction
7312	30	40	2	0	0	11	432.32	6.8e-05	Acidic fraction
7313	32	40	1	0	0	13	440.32	0.000255	Acidic fraction
7314	31	40	2	0	0	12	444.32	1.2e-05	Acidic fraction
7315	33	40	1	0	0	14	452.32	0.000164	Acidic fraction
7316	32	40	2	0	0	13	456.32	4e-05	Acidic fraction
7317	34	40	1	0	0	15	464.32	0.000113	Acidic fraction
7318	33	40	2	0	0	14	468.32	1.9e-05	Acidic fraction
7319	35	40	1	0	0	16	476.32	4.7e-05	Acidic fraction
7320	34	40	2	0	0	15	480.32	1.8e-05	Acidic fraction
7321	36	40	1	0	0	17	488.32	2.5e-05	Acidic fraction
7322	20	42	2	0	0	0	314.336	2.2e-05	Acidic fraction
7323	21	42	2	0	0	1	326.336	0.000479	Acidic fraction
7324	22	42	2	0	0	2	338.336	0.000297	Acidic fraction
7325	24	42	1	0	0	4	346.336	0.000462	Acidic fraction
7326	23	42	2	0	0	3	350.336	0.000194	Acidic fraction
7327	25	42	1	0	0	5	358.336	0.000373	Acidic fraction
7328	24	42	2	0	0	4	362.336	0.00016	Acidic fraction
7329	26	42	1	0	0	6	370.336	0.000738	Acidic fraction
7330	25	42	2	0	0	5	374.336	0.000133	Acidic fraction
7331	27	42	1	0	0	7	382.336	0.000901	Acidic fraction
7332	26	42	2	0	0	6	386.336	8.9e-05	Acidic fraction
7333	28	42	1	0	0	8	394.336	0.001001	Acidic fraction
7334	27	42	2	0	0	7	398.336	7.8e-05	Acidic fraction
7335	29	42	1	0	0	9	406.336	0.000789	Acidic fraction
7336	28	42	2	0	0	8	410.336	0.000977	Acidic fraction
7337	30	42	1	0	0	10	418.336	0.00051	Acidic fraction
7338	29	42	2	0	0	9	422.336	3.4e-05	Acidic fraction
7339	31	42	1	0	0	11	430.336	0.000412	Acidic fraction
7340	30	42	2	0	0	10	434.336	2.7e-05	Acidic fraction
7341	32	42	1	0	0	12	442.336	0.000294	Acidic fraction
7342	31	42	2	0	0	11	446.336	1.6e-05	Acidic fraction
7343	33	42	1	0	0	13	454.336	0.000196	Acidic fraction
7344	32	42	2	0	0	12	458.336	5.1e-05	Acidic fraction
7345	34	42	1	0	0	14	466.336	0.00012	Acidic fraction
7346	33	42	2	0	0	13	470.336	2.5e-05	Acidic fraction
7347	35	42	1	0	0	15	478.336	8.4e-05	Acidic fraction
7348	36	42	1	0	0	16	490.336	4.2e-05	Acidic fraction
7349	35	42	2	0	0	15	494.336	3e-05	Acidic fraction
7350	37	42	1	0	0	17	502.336	1.4e-05	Acidic fraction
7351	45	42	1	0	0	25	598.336	6.2e-05	Acidic fraction
7352	22	44	2	0	0	1	340.352	0.001401	Acidic fraction
7353	23	44	2	0	0	2	352.352	0.000195	Acidic fraction
7354	25	44	1	0	0	4	360.352	0.000404	Acidic fraction
7355	24	44	2	0	0	3	364.352	0.000218	Acidic fraction
7356	26	44	1	0	0	5	372.352	0.000345	Acidic fraction
7357	25	44	2	0	0	4	376.352	0.00019	Acidic fraction
7358	27	44	1	0	0	6	384.352	0.000917	Acidic fraction
7359	26	44	2	0	0	5	388.352	0.000112	Acidic fraction
7360	28	44	1	0	0	7	396.352	0.000706	Acidic fraction
7361	27	44	2	0	0	6	400.352	0.000191	Acidic fraction
7362	29	44	1	0	0	8	408.352	0.000848	Acidic fraction
7363	28	44	2	0	0	7	412.352	5.8e-05	Acidic fraction
7364	30	44	1	0	0	9	420.352	0.000629	Acidic fraction
7365	29	44	2	0	0	8	424.352	0.000137	Acidic fraction
7366	31	44	1	0	0	10	432.352	0.000495	Acidic fraction
7367	30	44	2	0	0	9	436.352	1.8e-05	Acidic fraction
7368	32	44	1	0	0	11	444.352	0.000366	Acidic fraction
7369	33	44	1	0	0	12	456.352	0.000233	Acidic fraction
7370	32	44	2	0	0	11	460.352	0.002955	Acidic fraction
7371	34	44	1	0	0	13	468.352	0.000144	Acidic fraction
7372	35	44	1	0	0	14	480.352	0.000127	Acidic fraction
7373	34	44	2	0	0	13	484.352	2.5e-05	Acidic fraction
7374	36	44	1	0	0	15	492.352	8.3e-05	Acidic fraction
7375	37	44	1	0	0	16	504.352	4.3e-05	Acidic fraction
7376	36	44	2	0	0	15	508.352	1.4e-05	Acidic fraction
7377	38	44	1	0	0	17	516.352	1.9e-05	Acidic fraction
7378	47	44	1	0	0	26	624.352	2.4e-05	Acidic fraction
7379	23	46	2	0	0	1	354.368	0.000762	Acidic fraction
7380	24	46	2	0	0	2	366.368	0.000266	Acidic fraction
7381	26	46	1	0	0	4	374.368	0.000451	Acidic fraction
7382	25	46	2	0	0	3	378.368	0.000202	Acidic fraction
7383	27	46	1	0	0	5	386.368	0.000342	Acidic fraction
7384	26	46	2	0	0	4	390.368	0.000188	Acidic fraction
7385	28	46	1	0	0	6	398.368	0.000523	Acidic fraction
7386	27	46	2	0	0	5	402.368	0.000145	Acidic fraction
7387	29	46	1	0	0	7	410.368	0.000619	Acidic fraction
7388	28	46	2	0	0	6	414.368	9.4e-05	Acidic fraction
7389	30	46	1	0	0	8	422.368	0.000701	Acidic fraction
7390	29	46	2	0	0	7	426.368	7.6e-05	Acidic fraction
7391	31	46	1	0	0	9	434.368	0.000593	Acidic fraction
7392	30	46	2	0	0	8	438.368	1.2e-05	Acidic fraction
7393	32	46	1	0	0	10	446.368	0.000389	Acidic fraction
7394	33	46	1	0	0	11	458.368	0.000315	Acidic fraction
7395	32	46	2	0	0	10	462.368	2.7e-05	Acidic fraction
7396	34	46	1	0	0	12	470.368	0.000239	Acidic fraction
7397	35	46	1	0	0	13	482.368	0.000145	Acidic fraction
7398	36	46	1	0	0	14	494.368	0.000101	Acidic fraction
7399	35	46	2	0	0	13	498.368	1.8e-05	Acidic fraction
7400	37	46	1	0	0	15	506.368	8.1e-05	Acidic fraction
7401	38	46	1	0	0	16	518.368	1.4e-05	Acidic fraction
7402	39	46	1	0	0	17	530.368	2.2e-05	Acidic fraction
7403	48	46	1	0	0	26	638.368	2.5e-05	Acidic fraction
7404	24	48	2	0	0	1	368.384	0.003253	Acidic fraction
7405	25	48	2	0	0	2	380.384	0.000201	Acidic fraction
7406	27	48	1	0	0	4	388.384	0.000433	Acidic fraction
7407	26	48	2	0	0	3	392.384	0.000204	Acidic fraction
7408	28	48	1	0	0	5	400.384	0.000291	Acidic fraction
7409	27	48	2	0	0	4	404.384	0.000169	Acidic fraction
7410	29	48	1	0	0	6	412.384	0.000501	Acidic fraction
7411	28	48	2	0	0	5	416.384	0.000125	Acidic fraction
7412	30	48	1	0	0	7	424.384	0.000516	Acidic fraction
7413	29	48	2	0	0	6	428.384	0.000164	Acidic fraction
7414	31	48	1	0	0	8	436.384	0.000744	Acidic fraction
7415	30	48	2	0	0	7	440.384	6.7e-05	Acidic fraction
7416	32	48	1	0	0	9	448.384	0.000518	Acidic fraction
7417	31	48	2	0	0	8	452.384	1.9e-05	Acidic fraction
7418	33	48	1	0	0	10	460.384	0.00033	Acidic fraction
7419	34	48	1	0	0	11	472.384	0.000277	Acidic fraction
7420	35	48	1	0	0	12	484.384	0.000187	Acidic fraction
7421	36	48	1	0	0	13	496.384	0.000132	Acidic fraction
7422	37	48	1	0	0	14	508.384	6.7e-05	Acidic fraction
7423	38	48	1	0	0	15	520.384	4.9e-05	Acidic fraction
7424	37	48	2	0	0	14	524.384	2.5e-05	Acidic fraction
7425	38	48	2	0	0	15	536.384	1.4e-05	Acidic fraction
7426	40	48	1	0	0	17	544.384	1.9e-05	Acidic fraction
7427	25	50	2	0	0	1	382.4	0.001176	Acidic fraction
7428	26	50	2	0	0	2	394.4	0.000252	Acidic fraction
7429	28	50	1	0	0	4	402.4	0.000411	Acidic fraction
7430	27	50	2	0	0	3	406.4	0.000178	Acidic fraction
7431	29	50	1	0	0	5	414.4	0.000272	Acidic fraction
7432	28	50	2	0	0	4	418.4	0.000129	Acidic fraction
7433	30	50	1	0	0	6	426.4	0.000437	Acidic fraction
7434	29	50	2	0	0	5	430.4	0.000184	Acidic fraction
7435	31	50	1	0	0	7	438.4	0.000516	Acidic fraction
7436	30	50	2	0	0	6	442.4	0.000197	Acidic fraction
7437	32	50	1	0	0	8	450.4	0.000549	Acidic fraction
7438	31	50	2	0	0	7	454.4	2.4e-05	Acidic fraction
7439	33	50	1	0	0	9	462.4	0.00044	Acidic fraction
7440	32	50	2	0	0	8	466.4	2.1e-05	Acidic fraction
7441	34	50	1	0	0	10	474.4	0.000309	Acidic fraction
7442	33	50	2	0	0	9	478.4	1.3e-05	Acidic fraction
7443	35	50	1	0	0	11	486.4	0.000256	Acidic fraction
7444	36	50	1	0	0	12	498.4	0.000169	Acidic fraction
7445	37	50	1	0	0	13	510.4	9.4e-05	Acidic fraction
7446	38	50	1	0	0	14	522.4	8.2e-05	Acidic fraction
7447	37	50	2	0	0	13	526.4	2.1e-05	Acidic fraction
7448	39	50	1	0	0	15	534.4	3.2e-05	Acidic fraction
7449	40	50	1	0	0	16	546.4	1.8e-05	Acidic fraction
7450	26	52	2	0	0	1	396.416	0.001215	Acidic fraction
7451	27	52	2	0	0	2	408.416	0.000215	Acidic fraction
7452	29	52	1	0	0	4	416.416	0.000369	Acidic fraction
7453	28	52	2	0	0	3	420.416	0.000175	Acidic fraction
7454	30	52	1	0	0	5	428.416	0.00025	Acidic fraction
7455	29	52	2	0	0	4	432.416	0.00015	Acidic fraction
7456	31	52	1	0	0	6	440.416	0.000426	Acidic fraction
7457	30	52	2	0	0	5	444.416	0.000172	Acidic fraction
7458	32	52	1	0	0	7	452.416	0.000439	Acidic fraction
7459	31	52	2	0	0	6	456.416	0.000122	Acidic fraction
7460	33	52	1	0	0	8	464.416	0.000513	Acidic fraction
7461	32	52	2	0	0	7	468.416	1.4e-05	Acidic fraction
7462	34	52	1	0	0	9	476.416	0.00035	Acidic fraction
7463	33	52	2	0	0	8	480.416	1.8e-05	Acidic fraction
7464	35	52	1	0	0	10	488.416	0.000277	Acidic fraction
7465	36	52	1	0	0	11	500.416	0.000191	Acidic fraction
7466	37	52	1	0	0	12	512.416	0.000145	Acidic fraction
7467	36	52	2	0	0	11	516.416	3.2e-05	Acidic fraction
7468	38	52	1	0	0	13	524.416	9.6e-05	Acidic fraction
7469	39	52	1	0	0	14	536.416	6.1e-05	Acidic fraction
7470	38	52	2	0	0	13	540.416	1.3e-05	Acidic fraction
7471	40	52	1	0	0	15	548.416	4.1e-05	Acidic fraction
7472	27	54	2	0	0	1	410.432	0.000308	Acidic fraction
7473	28	54	2	0	0	2	422.432	0.000211	Acidic fraction
7474	30	54	1	0	0	4	430.432	0.000339	Acidic fraction
7475	29	54	2	0	0	3	434.432	0.000188	Acidic fraction
7476	31	54	1	0	0	5	442.432	0.000218	Acidic fraction
7477	30	54	2	0	0	4	446.432	0.000151	Acidic fraction
7478	32	54	1	0	0	6	454.432	0.000342	Acidic fraction
7479	31	54	2	0	0	5	458.432	0.00014	Acidic fraction
7480	33	54	1	0	0	7	466.432	0.000349	Acidic fraction
7481	32	54	2	0	0	6	470.432	6.7e-05	Acidic fraction
7482	34	54	1	0	0	8	478.432	0.000423	Acidic fraction
7483	33	54	2	0	0	7	482.432	2.6e-05	Acidic fraction
7484	35	54	1	0	0	9	490.432	0.000333	Acidic fraction
7485	36	54	1	0	0	10	502.432	0.000242	Acidic fraction
7486	37	54	1	0	0	11	514.432	0.000178	Acidic fraction
7487	38	54	1	0	0	12	526.432	0.000137	Acidic fraction
7488	39	54	1	0	0	13	538.432	7.1e-05	Acidic fraction
7489	40	54	1	0	0	14	550.432	3.6e-05	Acidic fraction
7490	41	54	1	0	0	15	562.432	1.5e-05	Acidic fraction
7491	42	54	1	0	0	16	574.432	1.5e-05	Acidic fraction
7492	28	56	2	0	0	1	424.448	0.00039	Acidic fraction
7493	29	56	2	0	0	2	436.448	0.000168	Acidic fraction
7494	31	56	1	0	0	4	444.448	0.000321	Acidic fraction
7495	30	56	2	0	0	3	448.448	0.000187	Acidic fraction
7496	32	56	1	0	0	5	456.448	0.000202	Acidic fraction
7497	31	56	2	0	0	4	460.448	0.000138	Acidic fraction
7498	33	56	1	0	0	6	468.448	0.000312	Acidic fraction
7499	32	56	2	0	0	5	472.448	0.000176	Acidic fraction
7500	34	56	1	0	0	7	480.448	0.000329	Acidic fraction
7501	33	56	2	0	0	6	484.448	8.3e-05	Acidic fraction
7502	35	56	1	0	0	8	492.448	0.000397	Acidic fraction
7503	36	56	1	0	0	9	504.448	0.000286	Acidic fraction
7504	35	56	2	0	0	8	508.448	1.9e-05	Acidic fraction
7505	37	56	1	0	0	10	516.448	0.000192	Acidic fraction
7506	38	56	1	0	0	11	528.448	0.000179	Acidic fraction
7507	39	56	1	0	0	12	540.448	0.000118	Acidic fraction
7508	40	56	1	0	0	13	552.448	4.6e-05	Acidic fraction
7509	41	56	1	0	0	14	564.448	2.5e-05	Acidic fraction
7510	42	56	1	0	0	15	576.448	1.4e-05	Acidic fraction
7511	29	58	2	0	0	1	438.464	0.000167	Acidic fraction
7512	30	58	2	0	0	2	450.464	0.00021	Acidic fraction
7513	32	58	1	0	0	4	458.464	0.00024	Acidic fraction
7514	31	58	2	0	0	3	462.464	0.000129	Acidic fraction
7515	33	58	1	0	0	5	470.464	0.000192	Acidic fraction
7516	32	58	2	0	0	4	474.464	9.3e-05	Acidic fraction
7517	34	58	1	0	0	6	482.464	0.000285	Acidic fraction
7518	33	58	2	0	0	5	486.464	9.4e-05	Acidic fraction
7519	35	58	1	0	0	7	494.464	0.000263	Acidic fraction
7520	34	58	2	0	0	6	498.464	6.5e-05	Acidic fraction
7521	36	58	1	0	0	8	506.464	0.000312	Acidic fraction
7522	35	58	2	0	0	7	510.464	2.6e-05	Acidic fraction
7523	37	58	1	0	0	9	518.464	0.000253	Acidic fraction
7524	38	58	1	0	0	10	530.464	0.000221	Acidic fraction
7525	39	58	1	0	0	11	542.464	0.000132	Acidic fraction
7526	40	58	1	0	0	12	554.464	9.2e-05	Acidic fraction
7527	41	58	1	0	0	13	566.464	2.9e-05	Acidic fraction
7528	42	58	1	0	0	14	578.464	2.4e-05	Acidic fraction
7529	30	60	2	0	0	1	452.48	0.000157	Acidic fraction
7530	31	60	2	0	0	2	464.48	0.000158	Acidic fraction
7531	33	60	1	0	0	4	472.48	0.000236	Acidic fraction
7532	32	60	2	0	0	3	476.48	0.00015	Acidic fraction
7533	34	60	1	0	0	5	484.48	0.000159	Acidic fraction
7534	33	60	2	0	0	4	488.48	7.8e-05	Acidic fraction
7535	35	60	1	0	0	6	496.48	0.00025	Acidic fraction
7536	34	60	2	0	0	5	500.48	9.9e-05	Acidic fraction
7537	36	60	1	0	0	7	508.48	0.000274	Acidic fraction
7538	35	60	2	0	0	6	512.48	2.7e-05	Acidic fraction
7539	37	60	1	0	0	8	520.48	0.000322	Acidic fraction
7540	38	60	1	0	0	9	532.48	0.000243	Acidic fraction
7541	39	60	1	0	0	10	544.48	0.000177	Acidic fraction
7542	40	60	1	0	0	11	556.48	9.8e-05	Acidic fraction
7543	41	60	1	0	0	12	568.48	6.7e-05	Acidic fraction
7544	42	60	1	0	0	13	580.48	4.1e-05	Acidic fraction
7545	31	62	2	0	0	1	466.496	0.000102	Acidic fraction
7546	32	62	2	0	0	2	478.496	0.000135	Acidic fraction
7547	34	62	1	0	0	4	486.496	0.000208	Acidic fraction
7548	33	62	2	0	0	3	490.496	8.8e-05	Acidic fraction
7549	35	62	1	0	0	5	498.496	0.000128	Acidic fraction
7550	34	62	2	0	0	4	502.496	8.6e-05	Acidic fraction
7551	36	62	1	0	0	6	510.496	0.00024	Acidic fraction
7552	35	62	2	0	0	5	514.496	4e-05	Acidic fraction
7553	37	62	1	0	0	7	522.496	0.000226	Acidic fraction
7554	36	62	2	0	0	6	526.496	3.7e-05	Acidic fraction
7555	38	62	1	0	0	8	534.496	0.000309	Acidic fraction
7556	39	62	1	0	0	9	546.496	0.0002	Acidic fraction
7557	40	62	1	0	0	10	558.496	0.000126	Acidic fraction
7558	41	62	1	0	0	11	570.496	0.000104	Acidic fraction
7559	42	62	1	0	0	12	582.496	6.9e-05	Acidic fraction
7560	43	62	1	0	0	13	594.496	3.3e-05	Acidic fraction
7561	32	64	2	0	0	1	480.512	6.2e-05	Acidic fraction
7562	33	64	2	0	0	2	492.512	0.000128	Acidic fraction
7563	35	64	1	0	0	4	500.512	0.000174	Acidic fraction
7564	34	64	2	0	0	3	504.512	8.8e-05	Acidic fraction
7565	36	64	1	0	0	5	512.512	0.000133	Acidic fraction
7566	35	64	2	0	0	4	516.512	2.7e-05	Acidic fraction
7567	37	64	1	0	0	6	524.512	0.000164	Acidic fraction
7568	36	64	2	0	0	5	528.512	4.1e-05	Acidic fraction
7569	38	64	1	0	0	7	536.512	0.00022	Acidic fraction
7570	37	64	2	0	0	6	540.512	1.8e-05	Acidic fraction
7571	39	64	1	0	0	8	548.512	0.000225	Acidic fraction
7572	40	64	1	0	0	9	560.512	0.000137	Acidic fraction
7573	41	64	1	0	0	10	572.512	9e-05	Acidic fraction
7574	42	64	1	0	0	11	584.512	6.6e-05	Acidic fraction
7575	43	64	1	0	0	12	596.512	5.4e-05	Acidic fraction
7576	44	64	1	0	0	13	608.512	3.2e-05	Acidic fraction
7577	33	66	2	0	0	1	494.528	4.7e-05	Acidic fraction
7578	34	66	2	0	0	2	506.528	7.6e-05	Acidic fraction
7579	36	66	1	0	0	4	514.528	0.000147	Acidic fraction
7580	35	66	2	0	0	3	518.528	6.9e-05	Acidic fraction
7581	37	66	1	0	0	5	526.528	0.000106	Acidic fraction
7582	36	66	2	0	0	4	530.528	3e-05	Acidic fraction
7583	38	66	1	0	0	6	538.528	0.000149	Acidic fraction
7584	37	66	2	0	0	5	542.528	4.8e-05	Acidic fraction
7585	39	66	1	0	0	7	550.528	0.000162	Acidic fraction
7586	38	66	2	0	0	6	554.528	1.8e-05	Acidic fraction
7587	40	66	1	0	0	8	562.528	0.000155	Acidic fraction
7588	41	66	1	0	0	9	574.528	0.000153	Acidic fraction
7589	42	66	1	0	0	10	586.528	0.000114	Acidic fraction
7590	43	66	1	0	0	11	598.528	4.6e-05	Acidic fraction
7591	34	68	2	0	0	1	508.544	1.9e-05	Acidic fraction
7592	35	68	2	0	0	2	520.544	3.4e-05	Acidic fraction
7593	37	68	1	0	0	4	528.544	0.000123	Acidic fraction
7594	36	68	2	0	0	3	532.544	3.8e-05	Acidic fraction
7595	38	68	1	0	0	5	540.544	5.4e-05	Acidic fraction
7596	37	68	2	0	0	4	544.544	5.1e-05	Acidic fraction
7597	39	68	1	0	0	6	552.544	0.00016	Acidic fraction
7598	40	68	1	0	0	7	564.544	0.000131	Acidic fraction
7599	39	68	2	0	0	6	568.544	1.5e-05	Acidic fraction
7600	41	68	1	0	0	8	576.544	0.000171	Acidic fraction
7601	40	68	2	0	0	7	580.544	1.5e-05	Acidic fraction
7602	42	68	1	0	0	9	588.544	9e-05	Acidic fraction
7603	43	68	1	0	0	10	600.544	7e-05	Acidic fraction
7604	44	68	1	0	0	11	612.544	4.5e-05	Acidic fraction
7605	35	70	2	0	0	1	522.56	2.8e-05	Acidic fraction
7606	36	70	2	0	0	2	534.56	4.7e-05	Acidic fraction
7607	38	70	1	0	0	4	542.56	7.5e-05	Acidic fraction
7608	37	70	2	0	0	3	546.56	2.7e-05	Acidic fraction
7609	39	70	1	0	0	5	554.56	5.3e-05	Acidic fraction
7610	40	70	1	0	0	6	566.56	0.000131	Acidic fraction
7611	41	70	1	0	0	7	578.56	0.000111	Acidic fraction
7612	42	70	1	0	0	8	590.56	0.0001	Acidic fraction
7613	43	70	1	0	0	9	602.56	8.7e-05	Acidic fraction
7614	44	70	1	0	0	10	614.56	4e-05	Acidic fraction
7615	45	70	1	0	0	11	626.56	1.6e-05	Acidic fraction
7616	36	72	2	0	0	1	536.576	1.6e-05	Acidic fraction
7617	37	72	2	0	0	2	548.576	3.3e-05	Acidic fraction
7618	39	72	1	0	0	4	556.576	4.4e-05	Acidic fraction
7619	38	72	2	0	0	3	560.576	1.8e-05	Acidic fraction
7620	40	72	1	0	0	5	568.576	3.2e-05	Acidic fraction
7621	41	72	1	0	0	6	580.576	9.2e-05	Acidic fraction
7622	42	72	1	0	0	7	592.576	6.4e-05	Acidic fraction
7623	43	72	1	0	0	8	604.576	6.8e-05	Acidic fraction
7624	44	72	1	0	0	9	616.576	3.5e-05	Acidic fraction
7625	45	72	1	0	0	10	628.576	3.4e-05	Acidic fraction
7626	40	74	1	0	0	4	570.592	2e-05	Acidic fraction
7627	41	74	1	0	0	5	582.592	5.4e-05	Acidic fraction
7628	42	74	1	0	0	6	594.592	5.8e-05	Acidic fraction
7629	43	74	1	0	0	7	606.592	9.6e-05	Acidic fraction
7630	44	74	1	0	0	8	618.592	7e-05	Acidic fraction
7631	45	74	1	0	0	9	630.592	5.4e-05	Acidic fraction
7632	46	74	1	0	0	10	642.592	3.3e-05	Acidic fraction
7633	47	74	1	0	0	11	654.592	1.7e-05	Acidic fraction
7634	42	76	1	0	0	5	596.608	1.9e-05	Acidic fraction
7635	43	76	1	0	0	6	608.608	6.3e-05	Acidic fraction
7636	44	76	1	0	0	7	620.608	5.3e-05	Acidic fraction
7637	45	76	1	0	0	8	632.608	7.4e-05	Acidic fraction
7638	46	76	1	0	0	9	644.608	6e-05	Acidic fraction
7639	47	76	1	0	0	10	656.608	2.6e-05	Acidic fraction
7640	42	78	1	0	0	4	598.624	2.5e-05	Acidic fraction
7641	43	78	1	0	0	5	610.624	2.7e-05	Acidic fraction
7642	44	78	1	0	0	6	622.624	3e-05	Acidic fraction
7643	45	78	1	0	0	7	634.624	3e-05	Acidic fraction
7644	46	78	1	0	0	8	646.624	4.5e-05	Acidic fraction
7645	47	78	1	0	0	9	658.624	3.5e-05	Acidic fraction
7646	48	78	1	0	0	10	670.624	3.1e-05	Acidic fraction
7647	45	80	1	0	0	6	636.64	1.8e-05	Acidic fraction
7648	46	80	1	0	0	7	648.64	4.2e-05	Acidic fraction
7649	47	80	1	0	0	8	660.64	3.7e-05	Acidic fraction
7650	48	80	1	0	0	9	672.64	3.2e-05	Acidic fraction
7651	47	82	1	0	0	7	662.656	1.9e-05	Acidic fraction
7652	48	82	1	0	0	8	674.656	3.7e-05	Acidic fraction
7653	48	84	1	0	0	7	676.672	2.8e-05	Acidic fraction
7654	49	84	1	0	0	8	688.672	3.3e-05	Acidic fraction
7655	64	130	1	0	0	0	915.04	3e-05	Acidic fraction