vgo_38_formula

id
C
H
O
N
S
DBE
molecular_weight
mass fraction_wtpct
compound type
1 17 36 0 0 0 0 240.288 0.08961 Saturates
2 18 38 0 0 0 0 254.304 0.094837 Saturates
3 19 40 0 0 0 0 268.32 0.278369 Saturates
4 20 42 0 0 0 0 282.336 0.686034 Saturates
5 21 44 0 0 0 0 296.352 1.09744 Saturates
6 22 46 0 0 0 0 310.368 1.71982 Saturates
7 23 48 0 0 0 0 324.384 2.32413 Saturates
8 24 50 0 0 0 0 338.4 3.56452 Saturates
9 25 52 0 0 0 0 352.416 3.31247 Saturates
10 26 54 0 0 0 0 366.432 4.15061 Saturates
11 27 56 0 0 0 0 380.448 3.62191 Saturates
12 28 58 0 0 0 0 394.464 3.49678 Saturates
13 29 60 0 0 0 0 408.48 3.23479 Saturates
14 30 62 0 0 0 0 422.496 3.21726 Saturates
15 31 64 0 0 0 0 436.512 2.82622 Saturates
16 32 66 0 0 0 0 450.528 2.69529 Saturates
17 33 68 0 0 0 0 464.544 2.07389 Saturates
18 34 70 0 0 0 0 478.56 1.80491 Saturates
19 35 72 0 0 0 0 492.576 1.30887 Saturates
20 36 74 0 0 0 0 506.592 0.876696 Saturates
21 37 76 0 0 0 0 520.608 0.728116 Saturates
22 38 78 0 0 0 0 534.624 0.592034 Saturates
23 39 80 0 0 0 0 548.64 0.389776 Saturates
24 40 82 0 0 0 0 562.656 0.266063 Saturates
25 16 32 0 0 0 1 224.256 0.052576 Saturates
26 17 34 0 0 0 1 238.272 0.084743 Saturates
27 18 36 0 0 0 1 252.288 0.114014 Saturates
28 19 38 0 0 0 1 266.304 0.161693 Saturates
29 20 40 0 0 0 1 280.32 0.234 Saturates
30 21 42 0 0 0 1 294.336 0.289657 Saturates
31 22 44 0 0 0 1 308.352 0.423431 Saturates
32 23 46 0 0 0 1 322.368 0.489595 Saturates
33 24 48 0 0 0 1 336.384 0.58567 Saturates
34 25 50 0 0 0 1 350.4 0.647195 Saturates
35 26 52 0 0 0 1 364.416 0.70659 Saturates
36 27 54 0 0 0 1 378.432 0.736862 Saturates
37 28 56 0 0 0 1 392.448 0.844435 Saturates
38 29 58 0 0 0 1 406.464 0.917114 Saturates
39 30 60 0 0 0 1 420.48 0.940938 Saturates
40 31 62 0 0 0 1 434.496 0.971618 Saturates
41 32 64 0 0 0 1 448.512 0.891481 Saturates
42 33 66 0 0 0 1 462.528 0.861238 Saturates
43 34 68 0 0 0 1 476.544 0.786973 Saturates
44 35 70 0 0 0 1 490.56 0.679318 Saturates
45 36 72 0 0 0 1 504.576 0.508538 Saturates
46 37 74 0 0 0 1 518.592 0.37862 Saturates
47 38 76 0 0 0 1 532.608 0.293046 Saturates
48 39 78 0 0 0 1 546.624 0.211155 Saturates
49 40 80 0 0 0 1 560.64 0.179773 Saturates
50 41 82 0 0 0 1 574.656 0.146972 Saturates
51 19 36 0 0 0 2 264.288 0.081281 Saturates
52 20 38 0 0 0 2 278.304 0.188205 Saturates
53 21 40 0 0 0 2 292.32 0.176399 Saturates
54 22 42 0 0 0 2 306.336 0.303661 Saturates
55 23 44 0 0 0 2 320.352 0.444572 Saturates
56 24 46 0 0 0 2 334.368 0.536299 Saturates
57 25 48 0 0 0 2 348.384 0.723621 Saturates
58 26 50 0 0 0 2 362.4 0.678379 Saturates
59 27 52 0 0 0 2 376.416 0.653031 Saturates
60 28 54 0 0 0 2 390.432 0.783031 Saturates
61 29 56 0 0 0 2 404.448 0.747564 Saturates
62 30 58 0 0 0 2 418.464 0.825074 Saturates
63 31 60 0 0 0 2 432.48 0.839744 Saturates
64 32 62 0 0 0 2 446.496 0.764391 Saturates
65 33 64 0 0 0 2 460.512 0.749183 Saturates
66 34 66 0 0 0 2 474.528 0.692709 Saturates
67 35 68 0 0 0 2 488.544 0.663072 Saturates
68 36 70 0 0 0 2 502.56 0.439698 Saturates
69 37 72 0 0 0 2 516.576 0.407493 Saturates
70 38 74 0 0 0 2 530.592 0.267402 Saturates
71 39 76 0 0 0 2 544.608 0.196805 Saturates
72 21 38 0 0 0 3 290.304 0.122287 Saturates
73 22 40 0 0 0 3 304.32 0.17424 Saturates
74 23 42 0 0 0 3 318.336 0.285828 Saturates
75 24 44 0 0 0 3 332.352 0.271458 Saturates
76 25 46 0 0 0 3 346.368 0.343072 Saturates
77 26 48 0 0 0 3 360.384 0.351429 Saturates
78 27 50 0 0 0 3 374.4 0.387814 Saturates
79 28 52 0 0 0 3 388.416 0.378782 Saturates
80 29 54 0 0 0 3 402.432 0.478762 Saturates
81 30 56 0 0 0 3 416.448 0.476045 Saturates
82 31 58 0 0 0 3 430.464 0.609271 Saturates
83 32 60 0 0 0 3 444.48 0.56797 Saturates
84 33 62 0 0 0 3 458.496 0.578171 Saturates
85 34 64 0 0 0 3 472.512 0.455153 Saturates
86 35 66 0 0 0 3 486.528 0.32063 Saturates
87 36 68 0 0 0 3 500.544 0.171627 Saturates
88 23 40 0 0 0 4 316.32 0.132228 Saturates
89 24 42 0 0 0 4 330.336 0.13825 Saturates
90 25 44 0 0 0 4 344.352 0.185415 Saturates
91 26 46 0 0 0 4 358.368 0.232617 Saturates
92 27 48 0 0 0 4 372.384 0.214273 Saturates
93 28 50 0 0 0 4 386.4 0.220046 Saturates
94 29 52 0 0 0 4 400.416 0.187748 Saturates
95 30 54 0 0 0 4 414.432 0.311601 Saturates
96 31 56 0 0 0 4 428.448 1.25153 Saturates
97 32 58 0 0 0 4 442.464 1.15863 Saturates
98 33 60 0 0 0 4 456.48 1.40114 Saturates
99 34 62 0 0 0 4 470.496 0.772365 Saturates
100 35 64 0 0 0 4 484.512 0.260559 Saturates
101 31 54 0 0 0 5 426.432 0.064039 Saturates
102 32 56 0 0 0 5 440.448 0.036337 Saturates
103 33 58 0 0 0 5 454.464 0.044032 Saturates
104 34 60 0 0 0 5 468.48 0.071343 Saturates
105 35 64 0 0 0 4 484.512 0.222619 Aromatics
106 36 64 0 0 0 5 496.512 0.084453 Aromatics
107 34 62 0 0 0 4 470.496 0.270145 Aromatics
108 35 62 0 0 0 5 482.496 0.102183 Aromatics
109 33 60 0 0 0 4 456.48 0.364532 Aromatics
110 34 60 0 0 0 5 468.48 0.099214 Aromatics
111 32 58 0 0 0 4 442.464 0.432461 Aromatics
112 33 58 0 0 0 5 454.464 0.189558 Aromatics
113 34 58 0 0 0 6 466.464 0.148665 Aromatics
114 35 58 0 0 0 7 478.464 0.06116 Aromatics
115 31 56 0 0 0 4 428.448 0.397304 Aromatics
116 32 56 0 0 0 5 440.448 0.211736 Aromatics
117 33 56 0 0 0 6 452.448 0.146202 Aromatics
118 34 56 0 0 0 7 464.448 0.073033 Aromatics
119 30 54 0 0 0 4 414.432 0.373082 Aromatics
120 31 54 0 0 0 5 426.432 0.224506 Aromatics
121 32 54 0 0 0 6 438.432 0.16698 Aromatics
122 33 54 0 0 0 7 450.432 0.124078 Aromatics
123 34 54 0 0 0 8 462.432 0.050032 Aromatics
124 29 52 0 0 0 4 400.416 0.388965 Aromatics
125 30 52 0 0 0 5 412.416 0.220802 Aromatics
126 31 52 0 0 0 6 424.416 0.191393 Aromatics
127 32 52 0 0 0 7 436.416 0.124649 Aromatics
128 33 52 0 0 0 8 448.416 0.052581 Aromatics
129 28 50 0 0 0 4 386.4 0.370222 Aromatics
130 29 50 0 0 0 5 398.4 0.191921 Aromatics
131 30 50 0 0 0 6 410.4 0.197176 Aromatics
132 31 50 0 0 0 7 422.4 0.11144 Aromatics
133 32 50 0 0 0 8 434.4 0.054112 Aromatics
134 27 48 0 0 0 4 372.384 0.327937 Aromatics
135 28 48 0 0 0 5 384.384 0.187353 Aromatics
136 29 48 0 0 0 6 396.384 0.169499 Aromatics
137 30 48 0 0 0 7 408.384 0.119768 Aromatics
138 31 48 0 0 0 8 420.384 0.057641 Aromatics
139 32 48 0 0 0 9 432.384 0.058945 Aromatics
140 26 46 0 0 0 4 358.368 0.277896 Aromatics
141 27 46 0 0 0 5 370.368 0.191731 Aromatics
142 28 46 0 0 0 6 382.368 0.17014 Aromatics
143 29 46 0 0 0 7 394.368 0.081884 Aromatics
144 30 46 0 0 0 8 406.368 0.064959 Aromatics
145 31 46 0 0 0 9 418.368 0.067827 Aromatics
146 25 44 0 0 0 4 344.352 0.269414 Aromatics
147 26 44 0 0 0 5 356.352 0.170434 Aromatics
148 27 44 0 0 0 6 368.352 0.140553 Aromatics
149 28 44 0 0 0 7 380.352 0.079467 Aromatics
150 29 44 0 0 0 8 392.352 0.063749 Aromatics
151 30 44 0 0 0 9 404.352 0.065554 Aromatics
152 24 42 0 0 0 4 330.336 0.229227 Aromatics
153 25 42 0 0 0 5 342.336 0.155024 Aromatics
154 26 42 0 0 0 6 354.336 0.140161 Aromatics
155 27 42 0 0 0 7 366.336 0.088111 Aromatics
156 28 42 0 0 0 8 378.336 0.059644 Aromatics
157 29 42 0 0 0 9 390.336 0.049822 Aromatics
158 30 42 0 0 0 10 402.336 0.040688 Aromatics
159 31 42 0 0 0 11 414.336 0.048766 Aromatics
160 23 40 0 0 0 4 316.32 0.202907 Aromatics
161 24 40 0 0 0 5 328.32 0.178784 Aromatics
162 25 40 0 0 0 6 340.32 0.165915 Aromatics
163 26 40 0 0 0 7 352.32 0.103001 Aromatics
164 27 40 0 0 0 8 364.32 0.056249 Aromatics
165 28 40 0 0 0 9 376.32 0.073832 Aromatics
166 29 40 0 0 0 10 388.32 0.060628 Aromatics
167 30 40 0 0 0 11 400.32 0.029685 Aromatics
168 22 38 0 0 0 4 302.304 0.154048 Aromatics
169 23 38 0 0 0 5 314.304 0.123982 Aromatics
170 24 38 0 0 0 6 326.304 0.13348 Aromatics
171 25 38 0 0 0 7 338.304 0.109436 Aromatics
172 26 38 0 0 0 8 350.304 0.066215 Aromatics
173 27 38 0 0 0 9 362.304 0.062813 Aromatics
174 28 38 0 0 0 10 374.304 0.058439 Aromatics
175 30 38 0 0 0 12 398.304 0.016436 Aromatics
176 21 36 0 0 0 4 288.288 0.111441 Aromatics
177 22 36 0 0 0 5 300.288 0.116282 Aromatics
178 23 36 0 0 0 6 312.288 0.127747 Aromatics
179 24 36 0 0 0 7 324.288 0.090619 Aromatics
180 25 36 0 0 0 8 336.288 0.053311 Aromatics
181 26 36 0 0 0 9 348.288 0.077207 Aromatics
182 27 36 0 0 0 10 360.288 0.036429 Aromatics
183 20 34 0 0 0 4 274.272 0.083323 Aromatics
184 21 34 0 0 0 5 286.272 0.076257 Aromatics
185 22 34 0 0 0 6 298.272 0.114927 Aromatics
186 23 34 0 0 0 7 310.272 0.096271 Aromatics
187 24 34 0 0 0 8 322.272 0.052056 Aromatics
188 25 34 0 0 0 9 334.272 0.072788 Aromatics
189 26 34 0 0 0 10 346.272 0.048448 Aromatics
190 20 32 0 0 0 5 272.256 0.079396 Aromatics
191 21 32 0 0 0 6 284.256 0.108014 Aromatics
192 22 32 0 0 0 7 296.256 0.062801 Aromatics
193 23 32 0 0 0 8 308.256 0.054554 Aromatics
194 24 32 0 0 0 9 320.256 0.063239 Aromatics
195 25 32 0 0 0 10 332.256 0.041773 Aromatics
196 26 32 0 0 0 11 344.256 0.043776 Aromatics
197 27 32 0 0 0 12 356.256 0.021334 Aromatics
198 19 30 0 0 0 5 258.24 0.045353 Aromatics
199 20 30 0 0 0 6 270.24 0.076643 Aromatics
200 21 30 0 0 0 7 282.24 0.059637 Aromatics
201 22 30 0 0 0 8 294.24 0.060543 Aromatics
202 23 30 0 0 0 9 306.24 0.059309 Aromatics
203 24 30 0 0 0 10 318.24 0.037915 Aromatics
204 25 30 0 0 0 11 330.24 0.054558 Aromatics
205 26 30 0 0 0 12 342.24 0.013647 Aromatics
206 19 28 0 0 0 6 256.224 0.056605 Aromatics
207 20 28 0 0 0 7 268.224 0.065302 Aromatics
208 21 28 0 0 0 8 280.224 0.080527 Aromatics
209 22 28 0 0 0 9 292.224 0.065704 Aromatics
210 23 28 0 0 0 10 304.224 0.040491 Aromatics
211 24 28 0 0 0 11 316.224 0.064194 Aromatics
212 19 26 0 0 0 7 254.208 0.066192 Aromatics
213 20 26 0 0 0 8 266.208 0.068245 Aromatics
214 21 26 0 0 0 9 278.208 0.062311 Aromatics
215 22 26 0 0 0 10 290.208 0.055369 Aromatics
216 23 26 0 0 0 11 302.208 0.048402 Aromatics
217 24 26 0 0 0 12 314.208 0.018071 Aromatics
218 18 24 0 0 0 7 240.192 0.077097 Aromatics
219 19 24 0 0 0 8 252.192 0.04913 Aromatics
220 20 24 0 0 0 9 264.192 0.056615 Aromatics
221 21 24 0 0 0 10 276.192 0.070155 Aromatics
222 22 24 0 0 0 11 288.192 0.058143 Aromatics
223 23 24 0 0 0 12 300.192 0.019137 Aromatics
224 17 22 0 0 0 7 226.176 0.07767 Aromatics
225 18 22 0 0 0 8 238.176 0.031738 Aromatics
226 19 22 0 0 0 9 250.176 0.056371 Aromatics
227 20 22 0 0 0 10 262.176 0.078825 Aromatics
228 16 20 0 0 0 7 212.16 0.026728 Aromatics
229 18 20 0 0 0 9 236.16 0.025549 Aromatics
230 19 20 0 0 0 10 248.16 0.053177 Aromatics
231 22 15 0 1 0 16 293.13 1e-05 Neutral nitrogen compounds
232 23 17 0 1 0 16 307.146 1.4e-05 Neutral nitrogen compounds
233 24 19 0 1 0 16 321.162 2.7e-05 Neutral nitrogen compounds
234 25 21 0 1 0 16 335.178 2.5e-05 Neutral nitrogen compounds
235 26 23 0 1 0 16 349.194 3.6e-05 Neutral nitrogen compounds
236 20 13 0 1 0 15 267.114 1.7e-05 Neutral nitrogen compounds
237 21 15 0 1 0 15 281.13 5e-05 Neutral nitrogen compounds
238 22 17 0 1 0 15 295.146 7.5e-05 Neutral nitrogen compounds
239 23 19 0 1 0 15 309.162 8.3e-05 Neutral nitrogen compounds
240 24 21 0 1 0 15 323.178 9.5e-05 Neutral nitrogen compounds
241 25 23 0 1 0 15 337.194 7.6e-05 Neutral nitrogen compounds
242 26 25 0 1 0 15 351.21 9.9e-05 Neutral nitrogen compounds
243 27 27 0 1 0 15 365.226 0.000108 Neutral nitrogen compounds
244 28 29 0 1 0 15 379.242 8.9e-05 Neutral nitrogen compounds
245 29 31 0 1 0 15 393.258 6.7e-05 Neutral nitrogen compounds
246 30 33 0 1 0 15 407.274 4.1e-05 Neutral nitrogen compounds
247 31 35 0 1 0 15 421.29 4e-05 Neutral nitrogen compounds
248 32 37 0 1 0 15 435.306 3.2e-05 Neutral nitrogen compounds
249 33 39 0 1 0 15 449.322 3.4e-05 Neutral nitrogen compounds
250 34 41 0 1 0 15 463.338 3.8e-05 Neutral nitrogen compounds
251 35 43 0 1 0 15 477.354 2e-05 Neutral nitrogen compounds
252 36 45 0 1 0 15 491.37 1.7e-05 Neutral nitrogen compounds
253 19 13 0 1 0 14 255.114 8e-06 Neutral nitrogen compounds
254 20 15 0 1 0 14 269.13 4.1e-05 Neutral nitrogen compounds
255 21 17 0 1 0 14 283.146 0.000109 Neutral nitrogen compounds
256 22 19 0 1 0 14 297.162 0.000161 Neutral nitrogen compounds
257 22 19 1 1 0 14 313.162 1.4e-05 Neutral nitrogen compounds
258 23 21 0 1 0 14 311.178 0.000222 Neutral nitrogen compounds
259 23 21 1 1 0 14 327.178 1.7e-05 Neutral nitrogen compounds
260 24 23 0 1 0 14 325.194 0.000266 Neutral nitrogen compounds
261 24 23 1 1 0 14 341.194 2.1e-05 Neutral nitrogen compounds
262 25 25 0 1 0 14 339.21 0.000288 Neutral nitrogen compounds
263 25 25 1 1 0 14 355.21 1.8e-05 Neutral nitrogen compounds
264 26 27 0 1 0 14 353.226 0.000304 Neutral nitrogen compounds
265 26 27 1 1 0 14 369.226 2e-05 Neutral nitrogen compounds
266 27 29 0 1 0 14 367.242 0.000304 Neutral nitrogen compounds
267 27 29 1 1 0 14 383.242 1.4e-05 Neutral nitrogen compounds
268 28 31 0 1 0 14 381.258 0.000242 Neutral nitrogen compounds
269 28 31 1 1 0 14 397.258 2e-05 Neutral nitrogen compounds
270 29 33 0 1 0 14 395.274 0.000189 Neutral nitrogen compounds
271 30 35 0 1 0 14 409.29 8.9e-05 Neutral nitrogen compounds
272 31 37 0 1 0 14 423.306 0.000105 Neutral nitrogen compounds
273 32 39 0 1 0 14 437.322 8.8e-05 Neutral nitrogen compounds
274 33 41 0 1 0 14 451.338 6.8e-05 Neutral nitrogen compounds
275 34 43 0 1 0 14 465.354 5.2e-05 Neutral nitrogen compounds
276 35 45 0 1 0 14 479.37 3.7e-05 Neutral nitrogen compounds
277 36 47 0 1 0 14 493.386 2.3e-05 Neutral nitrogen compounds
278 37 49 0 1 0 14 507.402 1.2e-05 Neutral nitrogen compounds
279 38 51 0 1 0 14 521.418 1.2e-05 Neutral nitrogen compounds
280 41 57 0 1 0 14 563.466 1.3e-05 Neutral nitrogen compounds
281 17 11 0 1 0 13 229.098 1.1e-05 Neutral nitrogen compounds
282 18 13 0 1 0 13 243.114 6.1e-05 Neutral nitrogen compounds
283 18 13 1 1 0 13 259.114 1.2e-05 Neutral nitrogen compounds
284 19 15 0 1 0 13 257.13 0.000182 Neutral nitrogen compounds
285 19 15 1 1 0 13 273.13 2e-05 Neutral nitrogen compounds
286 20 17 0 1 0 13 271.146 0.000276 Neutral nitrogen compounds
287 20 17 1 1 0 13 287.146 3.1e-05 Neutral nitrogen compounds
288 21 19 0 1 0 13 285.162 0.000362 Neutral nitrogen compounds
289 21 19 1 1 0 13 301.162 4.2e-05 Neutral nitrogen compounds
290 22 21 0 1 0 13 299.178 0.00044 Neutral nitrogen compounds
291 22 21 1 1 0 13 315.178 4.9e-05 Neutral nitrogen compounds
292 23 23 0 1 0 13 313.194 0.000598 Neutral nitrogen compounds
293 23 23 1 1 0 13 329.194 6e-05 Neutral nitrogen compounds
294 24 25 0 1 0 13 327.21 0.000723 Neutral nitrogen compounds
295 24 25 1 1 0 13 343.21 5.6e-05 Neutral nitrogen compounds
296 25 27 0 1 0 13 341.226 0.000764 Neutral nitrogen compounds
297 25 27 1 1 0 13 357.226 5.6e-05 Neutral nitrogen compounds
298 26 29 0 1 0 13 355.242 0.000759 Neutral nitrogen compounds
299 26 29 1 1 0 13 371.242 4.8e-05 Neutral nitrogen compounds
300 27 31 0 1 0 13 369.258 0.000672 Neutral nitrogen compounds
301 27 31 1 1 0 13 385.258 3.9e-05 Neutral nitrogen compounds
302 28 33 0 1 0 13 383.274 0.000525 Neutral nitrogen compounds
303 28 33 1 1 0 13 399.274 3.3e-05 Neutral nitrogen compounds
304 29 35 0 1 0 13 397.29 0.000442 Neutral nitrogen compounds
305 29 35 1 1 0 13 413.29 2.3e-05 Neutral nitrogen compounds
306 30 37 0 1 0 13 411.306 0.000287 Neutral nitrogen compounds
307 30 37 1 1 0 13 427.306 1.8e-05 Neutral nitrogen compounds
308 31 39 0 1 0 13 425.322 0.000236 Neutral nitrogen compounds
309 32 41 0 1 0 13 439.338 0.000195 Neutral nitrogen compounds
310 33 43 0 1 0 13 453.354 0.000119 Neutral nitrogen compounds
311 34 45 0 1 0 13 467.37 9.7e-05 Neutral nitrogen compounds
312 35 47 0 1 0 13 481.386 6.8e-05 Neutral nitrogen compounds
313 36 49 0 1 0 13 495.402 4.5e-05 Neutral nitrogen compounds
314 37 51 0 1 0 13 509.418 2.7e-05 Neutral nitrogen compounds
315 38 53 0 1 0 13 523.434 2.2e-05 Neutral nitrogen compounds
316 39 55 0 1 0 13 537.45 1.3e-05 Neutral nitrogen compounds
317 16 11 0 1 0 12 217.098 9e-06 Neutral nitrogen compounds
318 17 13 0 1 0 12 231.114 0.000115 Neutral nitrogen compounds
319 17 13 1 1 0 12 247.114 1e-05 Neutral nitrogen compounds
320 18 15 0 1 0 12 245.13 0.000286 Neutral nitrogen compounds
321 18 15 1 1 0 12 261.13 2.2e-05 Neutral nitrogen compounds
322 19 17 0 1 0 12 259.146 0.000577 Neutral nitrogen compounds
323 19 17 1 1 0 12 275.146 3.8e-05 Neutral nitrogen compounds
324 20 19 0 1 0 12 273.162 0.000768 Neutral nitrogen compounds
325 20 19 1 1 0 12 289.162 5.6e-05 Neutral nitrogen compounds
326 21 21 0 1 0 12 287.178 0.001264 Neutral nitrogen compounds
327 21 21 1 1 0 12 303.178 6.2e-05 Neutral nitrogen compounds
328 22 23 0 1 0 12 301.194 0.00145 Neutral nitrogen compounds
329 22 23 1 1 0 12 317.194 8e-05 Neutral nitrogen compounds
330 23 25 0 1 0 12 315.21 0.001659 Neutral nitrogen compounds
331 23 25 1 1 0 12 331.21 7.5e-05 Neutral nitrogen compounds
332 24 27 0 1 0 12 329.226 0.001798 Neutral nitrogen compounds
333 24 27 1 1 0 12 345.226 8.8e-05 Neutral nitrogen compounds
334 25 29 0 1 0 12 343.242 0.001674 Neutral nitrogen compounds
335 25 29 1 1 0 12 359.242 8.9e-05 Neutral nitrogen compounds
336 26 31 0 1 0 12 357.258 0.001629 Neutral nitrogen compounds
337 26 31 1 1 0 12 373.258 7.7e-05 Neutral nitrogen compounds
338 27 33 0 1 0 12 371.274 0.001358 Neutral nitrogen compounds
339 27 33 1 1 0 12 387.274 6.2e-05 Neutral nitrogen compounds
340 28 35 0 1 0 12 385.29 0.00106 Neutral nitrogen compounds
341 28 35 1 1 0 12 401.29 5.6e-05 Neutral nitrogen compounds
342 29 37 0 1 0 12 399.306 0.000888 Neutral nitrogen compounds
343 29 37 1 1 0 12 415.306 3e-05 Neutral nitrogen compounds
344 30 39 0 1 0 12 413.322 0.000663 Neutral nitrogen compounds
345 30 39 1 1 0 12 429.322 2.3e-05 Neutral nitrogen compounds
346 31 41 0 1 0 12 427.338 0.000503 Neutral nitrogen compounds
347 32 43 0 1 0 12 441.354 0.000508 Neutral nitrogen compounds
348 33 45 0 1 0 12 455.37 0.000254 Neutral nitrogen compounds
349 34 47 0 1 0 12 469.386 0.000235 Neutral nitrogen compounds
350 35 49 0 1 0 12 483.402 0.000133 Neutral nitrogen compounds
351 36 51 0 1 0 12 497.418 8.1e-05 Neutral nitrogen compounds
352 37 53 0 1 0 12 511.434 4.2e-05 Neutral nitrogen compounds
353 38 55 0 1 0 12 525.45 1.6e-05 Neutral nitrogen compounds
354 40 59 0 1 0 12 553.482 1.2e-05 Neutral nitrogen compounds
355 15 11 0 1 0 11 205.098 1.2e-05 Neutral nitrogen compounds
356 16 13 0 1 0 11 219.114 8.4e-05 Neutral nitrogen compounds
357 16 13 1 1 0 11 235.114 4e-06 Neutral nitrogen compounds
358 17 15 0 1 0 11 233.13 0.000274 Neutral nitrogen compounds
359 17 15 1 1 0 11 249.13 5e-06 Neutral nitrogen compounds
360 18 17 0 1 0 11 247.146 0.000583 Neutral nitrogen compounds
361 18 17 1 1 0 11 263.146 1.6e-05 Neutral nitrogen compounds
362 19 19 0 1 0 11 261.162 0.001003 Neutral nitrogen compounds
363 19 19 1 1 0 11 277.162 4e-05 Neutral nitrogen compounds
364 20 21 0 1 0 11 275.178 0.001587 Neutral nitrogen compounds
365 20 21 1 1 0 11 291.178 5.3e-05 Neutral nitrogen compounds
366 21 23 0 1 0 11 289.194 0.00207 Neutral nitrogen compounds
367 21 23 1 1 0 11 305.194 7.4e-05 Neutral nitrogen compounds
368 22 25 0 1 0 11 303.21 0.002267 Neutral nitrogen compounds
369 22 25 1 1 0 11 319.21 0.000105 Neutral nitrogen compounds
370 23 27 0 1 0 11 317.226 0.002879 Neutral nitrogen compounds
371 23 27 1 1 0 11 333.226 0.000117 Neutral nitrogen compounds
372 24 29 0 1 0 11 331.242 0.003048 Neutral nitrogen compounds
373 24 29 1 1 0 11 347.242 0.00013 Neutral nitrogen compounds
374 25 31 0 1 0 11 345.258 0.002833 Neutral nitrogen compounds
375 25 31 1 1 0 11 361.258 0.000152 Neutral nitrogen compounds
376 26 33 0 1 0 11 359.274 0.002713 Neutral nitrogen compounds
377 26 33 1 1 0 11 375.274 0.000128 Neutral nitrogen compounds
378 27 35 0 1 0 11 373.29 0.002387 Neutral nitrogen compounds
379 27 35 1 1 0 11 389.29 9.1e-05 Neutral nitrogen compounds
380 28 37 0 1 0 11 387.306 0.001731 Neutral nitrogen compounds
381 28 37 1 1 0 11 403.306 7.7e-05 Neutral nitrogen compounds
382 29 39 0 1 0 11 401.322 0.001523 Neutral nitrogen compounds
383 29 39 1 1 0 11 417.322 6.5e-05 Neutral nitrogen compounds
384 30 41 0 1 0 11 415.338 0.001133 Neutral nitrogen compounds
385 30 41 1 1 0 11 431.338 4.7e-05 Neutral nitrogen compounds
386 31 43 0 1 0 11 429.354 0.000901 Neutral nitrogen compounds
387 32 45 0 1 0 11 443.37 0.000787 Neutral nitrogen compounds
388 33 47 0 1 0 11 457.386 0.000606 Neutral nitrogen compounds
389 34 49 0 1 0 11 471.402 0.000319 Neutral nitrogen compounds
390 35 51 0 1 0 11 485.418 0.000214 Neutral nitrogen compounds
391 36 53 0 1 0 11 499.434 0.000115 Neutral nitrogen compounds
392 37 55 0 1 0 11 513.45 6.7e-05 Neutral nitrogen compounds
393 38 57 0 1 0 11 527.466 3.5e-05 Neutral nitrogen compounds
394 39 59 0 1 0 11 541.482 2.1e-05 Neutral nitrogen compounds
395 15 13 0 1 0 10 207.114 0.000385 Neutral nitrogen compounds
396 15 13 1 1 0 10 223.114 7e-06 Neutral nitrogen compounds
397 16 15 0 1 0 10 221.13 0.000914 Neutral nitrogen compounds
398 16 15 1 1 0 10 237.13 1.2e-05 Neutral nitrogen compounds
399 17 17 0 1 0 10 235.146 0.000946 Neutral nitrogen compounds
400 17 17 1 1 0 10 251.146 1.7e-05 Neutral nitrogen compounds
401 18 19 0 1 0 10 249.162 0.000881 Neutral nitrogen compounds
402 18 19 1 1 0 10 265.162 3.8e-05 Neutral nitrogen compounds
403 19 21 0 1 0 10 263.178 0.001432 Neutral nitrogen compounds
404 19 21 1 1 0 10 279.178 7.2e-05 Neutral nitrogen compounds
405 20 23 0 1 0 10 277.194 0.002544 Neutral nitrogen compounds
406 20 23 1 1 0 10 293.194 0.000119 Neutral nitrogen compounds
407 21 25 0 1 0 10 291.21 0.003596 Neutral nitrogen compounds
408 21 25 1 1 0 10 307.21 0.000195 Neutral nitrogen compounds
409 22 27 0 1 0 10 305.226 0.004953 Neutral nitrogen compounds
410 22 27 1 1 0 10 321.226 0.000199 Neutral nitrogen compounds
411 23 29 0 1 0 10 319.242 0.005593 Neutral nitrogen compounds
412 23 29 1 1 0 10 335.242 0.000251 Neutral nitrogen compounds
413 24 31 0 1 0 10 333.258 0.005173 Neutral nitrogen compounds
414 24 31 1 1 0 10 349.258 0.000239 Neutral nitrogen compounds
415 25 33 0 1 0 10 347.274 0.005591 Neutral nitrogen compounds
416 25 33 1 1 0 10 363.274 0.000223 Neutral nitrogen compounds
417 26 35 0 1 0 10 361.29 0.004998 Neutral nitrogen compounds
418 26 35 1 1 0 10 377.29 0.000198 Neutral nitrogen compounds
419 27 37 0 1 0 10 375.306 0.004277 Neutral nitrogen compounds
420 27 37 1 1 0 10 391.306 0.000141 Neutral nitrogen compounds
421 28 39 0 1 0 10 389.322 0.002748 Neutral nitrogen compounds
422 28 39 1 1 0 10 405.322 0.00012 Neutral nitrogen compounds
423 29 41 0 1 0 10 403.338 0.002469 Neutral nitrogen compounds
424 29 41 1 1 0 10 419.338 9.4e-05 Neutral nitrogen compounds
425 30 43 0 1 0 10 417.354 0.001931 Neutral nitrogen compounds
426 31 45 0 1 0 10 431.37 0.001533 Neutral nitrogen compounds
427 31 45 1 1 0 10 447.37 3.7e-05 Neutral nitrogen compounds
428 32 47 0 1 0 10 445.386 0.001214 Neutral nitrogen compounds
429 33 49 0 1 0 10 459.402 0.000883 Neutral nitrogen compounds
430 34 51 0 1 0 10 473.418 0.000496 Neutral nitrogen compounds
431 35 53 0 1 0 10 487.434 0.000354 Neutral nitrogen compounds
432 36 55 0 1 0 10 501.45 0.000184 Neutral nitrogen compounds
433 37 57 0 1 0 10 515.466 9.3e-05 Neutral nitrogen compounds
434 38 59 0 1 0 10 529.482 5.1e-05 Neutral nitrogen compounds
435 39 61 0 1 0 10 543.498 2.1e-05 Neutral nitrogen compounds
436 40 63 0 1 0 10 557.514 1.8e-05 Neutral nitrogen compounds
437 13 11 0 1 0 9 181.098 4e-06 Neutral nitrogen compounds
438 14 13 0 1 0 9 195.114 2e-05 Neutral nitrogen compounds
439 14 13 1 1 0 9 211.114 1.1e-05 Neutral nitrogen compounds
440 15 15 0 1 0 9 209.13 9.5e-05 Neutral nitrogen compounds
441 15 15 1 1 0 9 225.13 2.7e-05 Neutral nitrogen compounds
442 16 17 0 1 0 9 223.146 0.000255 Neutral nitrogen compounds
443 16 17 1 1 0 9 239.146 5.3e-05 Neutral nitrogen compounds
444 17 19 0 1 0 9 237.162 0.000655 Neutral nitrogen compounds
445 17 19 1 1 0 9 253.162 8.2e-05 Neutral nitrogen compounds
446 18 21 0 1 0 9 251.178 0.001674 Neutral nitrogen compounds
447 18 21 1 1 0 9 267.178 0.000134 Neutral nitrogen compounds
448 19 23 0 1 0 9 265.194 0.003031 Neutral nitrogen compounds
449 19 23 1 1 0 9 281.194 0.000188 Neutral nitrogen compounds
450 20 25 0 1 0 9 279.21 0.00464 Neutral nitrogen compounds
451 20 25 1 1 0 9 295.21 0.000253 Neutral nitrogen compounds
452 21 27 0 1 0 9 293.226 0.00551 Neutral nitrogen compounds
453 21 27 1 1 0 9 309.226 0.000301 Neutral nitrogen compounds
454 22 29 0 1 0 9 307.242 0.007084 Neutral nitrogen compounds
455 22 29 1 1 0 9 323.242 0.000318 Neutral nitrogen compounds
456 23 31 0 1 0 9 321.258 0.006382 Neutral nitrogen compounds
457 23 31 1 1 0 9 337.258 0.000285 Neutral nitrogen compounds
458 24 33 0 1 0 9 335.274 0.007344 Neutral nitrogen compounds
459 24 33 1 1 0 9 351.274 0.000314 Neutral nitrogen compounds
460 25 35 0 1 0 9 349.29 0.006529 Neutral nitrogen compounds
461 25 35 1 1 0 9 365.29 0.000281 Neutral nitrogen compounds
462 26 37 0 1 0 9 363.306 0.006649 Neutral nitrogen compounds
463 26 37 1 1 0 9 379.306 0.000239 Neutral nitrogen compounds
464 27 39 0 1 0 9 377.322 0.005675 Neutral nitrogen compounds
465 27 39 1 1 0 9 393.322 0.000174 Neutral nitrogen compounds
466 28 41 0 1 0 9 391.338 0.00401 Neutral nitrogen compounds
467 28 41 1 1 0 9 407.338 0.000135 Neutral nitrogen compounds
468 29 43 0 1 0 9 405.354 0.00368 Neutral nitrogen compounds
469 29 43 1 1 0 9 421.354 9.3e-05 Neutral nitrogen compounds
470 30 45 0 1 0 9 419.37 0.003009 Neutral nitrogen compounds
471 31 47 0 1 0 9 433.386 0.002252 Neutral nitrogen compounds
472 32 49 0 1 0 9 447.402 0.001687 Neutral nitrogen compounds
473 33 51 0 1 0 9 461.418 0.00116 Neutral nitrogen compounds
474 34 53 0 1 0 9 475.434 0.000758 Neutral nitrogen compounds
475 35 55 0 1 0 9 489.45 0.000446 Neutral nitrogen compounds
476 36 57 0 1 0 9 503.466 0.000237 Neutral nitrogen compounds
477 38 61 0 1 0 9 531.498 7.4e-05 Neutral nitrogen compounds
478 39 63 0 1 0 9 545.514 3.3e-05 Neutral nitrogen compounds
479 40 65 0 1 0 9 559.53 1.3e-05 Neutral nitrogen compounds
480 13 13 0 1 0 8 183.114 3e-06 Neutral nitrogen compounds
481 14 15 0 1 0 8 197.13 5.2e-05 Neutral nitrogen compounds
482 14 15 1 1 0 8 213.13 1.6e-05 Neutral nitrogen compounds
483 15 17 0 1 0 8 211.146 0.000286 Neutral nitrogen compounds
484 15 17 1 1 0 8 227.146 8.5e-05 Neutral nitrogen compounds
485 16 19 0 1 0 8 225.162 0.000883 Neutral nitrogen compounds
486 16 19 1 1 0 8 241.162 0.000277 Neutral nitrogen compounds
487 17 21 0 1 0 8 239.178 0.00183 Neutral nitrogen compounds
488 17 21 1 1 0 8 255.178 0.000187 Neutral nitrogen compounds
489 18 23 0 1 0 8 253.194 0.002772 Neutral nitrogen compounds
490 18 23 1 1 0 8 269.194 0.000139 Neutral nitrogen compounds
491 19 25 0 1 0 8 267.21 0.003706 Neutral nitrogen compounds
492 19 25 1 1 0 8 283.21 0.000157 Neutral nitrogen compounds
493 20 27 0 1 0 8 281.226 0.004798 Neutral nitrogen compounds
494 20 27 1 1 0 8 297.226 0.000192 Neutral nitrogen compounds
495 21 29 0 1 0 8 295.242 0.005736 Neutral nitrogen compounds
496 21 29 1 1 0 8 311.242 0.000232 Neutral nitrogen compounds
497 22 31 0 1 0 8 309.258 0.008068 Neutral nitrogen compounds
498 22 31 1 1 0 8 325.258 0.000275 Neutral nitrogen compounds
499 23 33 0 1 0 8 323.274 0.008474 Neutral nitrogen compounds
500 23 33 1 1 0 8 339.274 0.000272 Neutral nitrogen compounds
501 24 35 0 1 0 8 337.29 0.008321 Neutral nitrogen compounds
502 24 35 1 1 0 8 353.29 0.000281 Neutral nitrogen compounds
503 25 37 0 1 0 8 351.306 0.009864 Neutral nitrogen compounds
504 25 37 1 1 0 8 367.306 0.000286 Neutral nitrogen compounds
505 26 39 0 1 0 8 365.322 0.00839 Neutral nitrogen compounds
506 26 39 1 1 0 8 381.322 0.000223 Neutral nitrogen compounds
507 27 41 0 1 0 8 379.338 0.007039 Neutral nitrogen compounds
508 27 41 1 1 0 8 395.338 0.000188 Neutral nitrogen compounds
509 28 43 0 1 0 8 393.354 0.005621 Neutral nitrogen compounds
510 28 43 1 1 0 8 409.354 8.8e-05 Neutral nitrogen compounds
511 29 45 0 1 0 8 407.37 0.004303 Neutral nitrogen compounds
512 29 45 1 1 0 8 423.37 7.2e-05 Neutral nitrogen compounds
513 30 47 0 1 0 8 421.386 0.004259 Neutral nitrogen compounds
514 31 49 0 1 0 8 435.402 0.003348 Neutral nitrogen compounds
515 32 51 0 1 0 8 449.418 0.002406 Neutral nitrogen compounds
516 33 53 0 1 0 8 463.434 0.001679 Neutral nitrogen compounds
517 34 55 0 1 0 8 477.45 0.001178 Neutral nitrogen compounds
518 35 57 0 1 0 8 491.466 0.000628 Neutral nitrogen compounds
519 36 59 0 1 0 8 505.482 0.000316 Neutral nitrogen compounds
520 37 61 0 1 0 8 519.498 0.000182 Neutral nitrogen compounds
521 39 65 0 1 0 8 547.53 4.1e-05 Neutral nitrogen compounds
522 40 67 0 1 0 8 561.546 2.6e-05 Neutral nitrogen compounds
523 13 15 0 1 0 7 185.13 5e-06 Neutral nitrogen compounds
524 13 15 1 1 0 7 201.13 5e-06 Neutral nitrogen compounds
525 14 17 0 1 0 7 199.146 0.000303 Neutral nitrogen compounds
526 14 17 1 1 0 7 215.146 1.1e-05 Neutral nitrogen compounds
527 15 19 0 1 0 7 213.162 0.000865 Neutral nitrogen compounds
528 15 19 1 1 0 7 229.162 1.8e-05 Neutral nitrogen compounds
529 16 21 0 1 0 7 227.178 0.001114 Neutral nitrogen compounds
530 16 21 1 1 0 7 243.178 4.9e-05 Neutral nitrogen compounds
531 17 23 0 1 0 7 241.194 0.001527 Neutral nitrogen compounds
532 17 23 1 1 0 7 257.194 6.2e-05 Neutral nitrogen compounds
533 18 25 0 1 0 7 255.21 0.002386 Neutral nitrogen compounds
534 18 25 1 1 0 7 271.21 0.0001 Neutral nitrogen compounds
535 19 27 0 1 0 7 269.226 0.00408 Neutral nitrogen compounds
536 19 27 1 1 0 7 285.226 0.000161 Neutral nitrogen compounds
537 20 29 0 1 0 7 283.242 0.006922 Neutral nitrogen compounds
538 20 29 1 1 0 7 299.242 0.000186 Neutral nitrogen compounds
539 21 31 0 1 0 7 297.258 0.007896 Neutral nitrogen compounds
540 21 31 1 1 0 7 313.258 0.000233 Neutral nitrogen compounds
541 22 33 0 1 0 7 311.274 0.010636 Neutral nitrogen compounds
542 22 33 1 1 0 7 327.274 0.000287 Neutral nitrogen compounds
543 23 35 0 1 0 7 325.29 0.012121 Neutral nitrogen compounds
544 23 35 1 1 0 7 341.29 0.000289 Neutral nitrogen compounds
545 24 37 0 1 0 7 339.306 0.012545 Neutral nitrogen compounds
546 24 37 1 1 0 7 355.306 0.000333 Neutral nitrogen compounds
547 25 39 0 1 0 7 353.322 0.012021 Neutral nitrogen compounds
548 25 39 1 1 0 7 369.322 0.000316 Neutral nitrogen compounds
549 26 41 0 1 0 7 367.338 0.012497 Neutral nitrogen compounds
550 26 41 1 1 0 7 383.338 0.000275 Neutral nitrogen compounds
551 27 43 0 1 0 7 381.354 0.009558 Neutral nitrogen compounds
552 27 43 1 1 0 7 397.354 0.000243 Neutral nitrogen compounds
553 28 45 0 1 0 7 395.37 0.008141 Neutral nitrogen compounds
554 28 45 1 1 0 7 411.37 0.000136 Neutral nitrogen compounds
555 29 47 0 1 0 7 409.386 0.005257 Neutral nitrogen compounds
556 29 47 1 1 0 7 425.386 9.4e-05 Neutral nitrogen compounds
557 30 49 0 1 0 7 423.402 0.005908 Neutral nitrogen compounds
558 31 51 0 1 0 7 437.418 0.004702 Neutral nitrogen compounds
559 32 53 0 1 0 7 451.434 0.003074 Neutral nitrogen compounds
560 33 55 0 1 0 7 465.45 0.002111 Neutral nitrogen compounds
561 34 57 0 1 0 7 479.466 0.00152 Neutral nitrogen compounds
562 35 59 0 1 0 7 493.482 0.000843 Neutral nitrogen compounds
563 36 61 0 1 0 7 507.498 0.000454 Neutral nitrogen compounds
564 37 63 0 1 0 7 521.514 0.000214 Neutral nitrogen compounds
565 38 65 0 1 0 7 535.53 0.000115 Neutral nitrogen compounds
566 39 67 0 1 0 7 549.546 5.1e-05 Neutral nitrogen compounds
567 41 71 0 1 0 7 577.578 1.4e-05 Neutral nitrogen compounds
568 10 11 0 1 0 6 145.098 3e-06 Neutral nitrogen compounds
569 13 17 0 1 0 6 187.146 3e-06 Neutral nitrogen compounds
570 14 19 0 1 0 6 201.162 6.6e-05 Neutral nitrogen compounds
571 14 19 1 1 0 6 217.162 1.6e-05 Neutral nitrogen compounds
572 15 21 0 1 0 6 215.178 0.000347 Neutral nitrogen compounds
573 15 21 1 1 0 6 231.178 6.1e-05 Neutral nitrogen compounds
574 16 23 0 1 0 6 229.194 0.001115 Neutral nitrogen compounds
575 16 23 1 1 0 6 245.194 0.000117 Neutral nitrogen compounds
576 17 25 0 1 0 6 243.21 0.00204 Neutral nitrogen compounds
577 17 25 1 1 0 6 259.21 0.00012 Neutral nitrogen compounds
578 18 27 0 1 0 6 257.226 0.00385 Neutral nitrogen compounds
579 18 27 1 1 0 6 273.226 0.000143 Neutral nitrogen compounds
580 19 29 0 1 0 6 271.242 0.005643 Neutral nitrogen compounds
581 19 29 1 1 0 6 287.242 0.000211 Neutral nitrogen compounds
582 20 31 0 1 0 6 285.258 0.00754 Neutral nitrogen compounds
583 20 31 1 1 0 6 301.258 0.000255 Neutral nitrogen compounds
584 21 33 0 1 0 6 299.274 0.008426 Neutral nitrogen compounds
585 21 33 1 1 0 6 315.274 0.000324 Neutral nitrogen compounds
586 22 35 0 1 0 6 313.29 0.009786 Neutral nitrogen compounds
587 22 35 1 1 0 6 329.29 0.000368 Neutral nitrogen compounds
588 23 37 0 1 0 6 327.306 0.01059 Neutral nitrogen compounds
589 23 37 1 1 0 6 343.306 0.000398 Neutral nitrogen compounds
590 24 39 0 1 0 6 341.322 0.012417 Neutral nitrogen compounds
591 24 39 1 1 0 6 357.322 0.000411 Neutral nitrogen compounds
592 25 41 0 1 0 6 355.338 0.013729 Neutral nitrogen compounds
593 25 41 1 1 0 6 371.338 0.000375 Neutral nitrogen compounds
594 26 43 0 1 0 6 369.354 0.012977 Neutral nitrogen compounds
595 26 43 1 1 0 6 385.354 0.000323 Neutral nitrogen compounds
596 27 45 0 1 0 6 383.37 0.011384 Neutral nitrogen compounds
597 27 45 1 1 0 6 399.37 0.000275 Neutral nitrogen compounds
598 28 47 0 1 0 6 397.386 0.009608 Neutral nitrogen compounds
599 28 47 1 1 0 6 413.386 0.000172 Neutral nitrogen compounds
600 29 49 0 1 0 6 411.402 0.008524 Neutral nitrogen compounds
601 29 49 1 1 0 6 427.402 8.8e-05 Neutral nitrogen compounds
602 30 51 0 1 0 6 425.418 0.007653 Neutral nitrogen compounds
603 31 53 0 1 0 6 439.434 0.006355 Neutral nitrogen compounds
604 32 55 0 1 0 6 453.45 0.003838 Neutral nitrogen compounds
605 33 57 0 1 0 6 467.466 0.002897 Neutral nitrogen compounds
606 34 59 0 1 0 6 481.482 0.001683 Neutral nitrogen compounds
607 35 61 0 1 0 6 495.498 0.001084 Neutral nitrogen compounds
608 36 63 0 1 0 6 509.514 0.000514 Neutral nitrogen compounds
609 38 67 0 1 0 6 537.546 0.000119 Neutral nitrogen compounds
610 39 69 0 1 0 6 551.562 8.6e-05 Neutral nitrogen compounds
611 40 71 0 1 0 6 565.578 5.5e-05 Neutral nitrogen compounds
612 9 11 0 1 0 5 133.098 2e-06 Neutral nitrogen compounds
613 10 13 0 1 0 5 147.114 3e-06 Neutral nitrogen compounds
614 13 19 0 1 0 5 189.162 5e-06 Neutral nitrogen compounds
615 13 19 1 1 0 5 205.162 7e-06 Neutral nitrogen compounds
616 14 21 0 1 0 5 203.178 0.000133 Neutral nitrogen compounds
617 14 21 1 1 0 5 219.178 2.4e-05 Neutral nitrogen compounds
618 15 23 0 1 0 5 217.194 0.000486 Neutral nitrogen compounds
619 15 23 1 1 0 5 233.194 3.5e-05 Neutral nitrogen compounds
620 16 25 0 1 0 5 231.21 0.00239 Neutral nitrogen compounds
621 16 25 1 1 0 5 247.21 5e-05 Neutral nitrogen compounds
622 17 27 0 1 0 5 245.226 0.001729 Neutral nitrogen compounds
623 17 27 1 1 0 5 261.226 8e-05 Neutral nitrogen compounds
624 18 29 0 1 0 5 259.242 0.003166 Neutral nitrogen compounds
625 18 29 1 1 0 5 275.242 0.000142 Neutral nitrogen compounds
626 19 31 0 1 0 5 273.258 0.003806 Neutral nitrogen compounds
627 19 31 1 1 0 5 289.258 0.000192 Neutral nitrogen compounds
628 20 33 0 1 0 5 287.274 0.005901 Neutral nitrogen compounds
629 20 33 1 1 0 5 303.274 0.000239 Neutral nitrogen compounds
630 21 35 0 1 0 5 301.29 0.006326 Neutral nitrogen compounds
631 21 35 1 1 0 5 317.29 0.000306 Neutral nitrogen compounds
632 22 37 0 1 0 5 315.306 0.00738 Neutral nitrogen compounds
633 22 37 1 1 0 5 331.306 0.000317 Neutral nitrogen compounds
634 23 39 0 1 0 5 329.322 0.009035 Neutral nitrogen compounds
635 23 39 1 1 0 5 345.322 0.000341 Neutral nitrogen compounds
636 24 41 0 1 0 5 343.338 0.011705 Neutral nitrogen compounds
637 24 41 1 1 0 5 359.338 0.00035 Neutral nitrogen compounds
638 25 43 0 1 0 5 357.354 0.013665 Neutral nitrogen compounds
639 25 43 1 1 0 5 373.354 0.000345 Neutral nitrogen compounds
640 26 45 0 1 0 5 371.37 0.011834 Neutral nitrogen compounds
641 26 45 1 1 0 5 387.37 0.000276 Neutral nitrogen compounds
642 27 47 0 1 0 5 385.386 0.010941 Neutral nitrogen compounds
643 27 47 1 1 0 5 401.386 0.00028 Neutral nitrogen compounds
644 28 49 0 1 0 5 399.402 0.009595 Neutral nitrogen compounds
645 28 49 1 1 0 5 415.402 0.000162 Neutral nitrogen compounds
646 29 51 0 1 0 5 413.418 0.009451 Neutral nitrogen compounds
647 29 51 1 1 0 5 429.418 8.4e-05 Neutral nitrogen compounds
648 30 53 0 1 0 5 427.434 0.008594 Neutral nitrogen compounds
649 30 53 1 1 0 5 443.434 8.8e-05 Neutral nitrogen compounds
650 31 55 0 1 0 5 441.45 0.007714 Neutral nitrogen compounds
651 31 55 1 1 0 5 457.45 8.5e-05 Neutral nitrogen compounds
652 32 57 0 1 0 5 455.466 0.004401 Neutral nitrogen compounds
653 33 59 0 1 0 5 469.482 0.003372 Neutral nitrogen compounds
654 34 61 0 1 0 5 483.498 0.001824 Neutral nitrogen compounds
655 35 63 0 1 0 5 497.514 0.001008 Neutral nitrogen compounds
656 36 65 0 1 0 5 511.53 0.000535 Neutral nitrogen compounds
657 37 67 0 1 0 5 525.546 0.000302 Neutral nitrogen compounds
658 38 69 0 1 0 5 539.562 0.000132 Neutral nitrogen compounds
659 39 71 0 1 0 5 553.578 6.6e-05 Neutral nitrogen compounds
660 14 23 0 1 0 4 205.194 3.9e-05 Neutral nitrogen compounds
661 14 23 1 1 0 4 221.194 1.2e-05 Neutral nitrogen compounds
662 15 25 0 1 0 4 219.21 0.00013 Neutral nitrogen compounds
663 15 25 1 1 0 4 235.21 3.9e-05 Neutral nitrogen compounds
664 16 27 0 1 0 4 233.226 0.000221 Neutral nitrogen compounds
665 16 27 1 1 0 4 249.226 4.7e-05 Neutral nitrogen compounds
666 17 29 0 1 0 4 247.242 0.000354 Neutral nitrogen compounds
667 17 29 1 1 0 4 263.242 5.7e-05 Neutral nitrogen compounds
668 18 31 0 1 0 4 261.258 0.000642 Neutral nitrogen compounds
669 18 31 1 1 0 4 277.258 7.5e-05 Neutral nitrogen compounds
670 19 33 0 1 0 4 275.274 0.001246 Neutral nitrogen compounds
671 19 33 1 1 0 4 291.274 0.000101 Neutral nitrogen compounds
672 20 35 0 1 0 4 289.29 0.002201 Neutral nitrogen compounds
673 20 35 1 1 0 4 305.29 0.000132 Neutral nitrogen compounds
674 21 37 0 1 0 4 303.306 0.002309 Neutral nitrogen compounds
675 21 37 1 1 0 4 319.306 0.000135 Neutral nitrogen compounds
676 22 39 0 1 0 4 317.322 0.003046 Neutral nitrogen compounds
677 22 39 1 1 0 4 333.322 0.000158 Neutral nitrogen compounds
678 23 41 0 1 0 4 331.338 0.003855 Neutral nitrogen compounds
679 23 41 1 1 0 4 347.338 0.000185 Neutral nitrogen compounds
680 24 43 0 1 0 4 345.354 0.004636 Neutral nitrogen compounds
681 24 43 1 1 0 4 361.354 0.000198 Neutral nitrogen compounds
682 25 45 0 1 0 4 359.37 0.006309 Neutral nitrogen compounds
683 25 45 1 1 0 4 375.37 0.000193 Neutral nitrogen compounds
684 26 47 0 1 0 4 373.386 0.005258 Neutral nitrogen compounds
685 26 47 1 1 0 4 389.386 0.000145 Neutral nitrogen compounds
686 27 49 0 1 0 4 387.402 0.003882 Neutral nitrogen compounds
687 27 49 1 1 0 4 403.402 0.000136 Neutral nitrogen compounds
688 28 51 0 1 0 4 401.418 0.00426 Neutral nitrogen compounds
689 28 51 1 1 0 4 417.418 0.000124 Neutral nitrogen compounds
690 29 53 0 1 0 4 415.434 0.004323 Neutral nitrogen compounds
691 29 53 1 1 0 4 431.434 0.00011 Neutral nitrogen compounds
692 30 55 0 1 0 4 429.45 0.004325 Neutral nitrogen compounds
693 30 55 1 1 0 4 445.45 8.6e-05 Neutral nitrogen compounds
694 31 57 0 1 0 4 443.466 0.003414 Neutral nitrogen compounds
695 31 57 1 1 0 4 459.466 6.5e-05 Neutral nitrogen compounds
696 32 59 0 1 0 4 457.482 0.00208 Neutral nitrogen compounds
697 32 59 1 1 0 4 473.482 3.5e-05 Neutral nitrogen compounds
698 33 61 0 1 0 4 471.498 0.001602 Neutral nitrogen compounds
699 33 61 1 1 0 4 487.498 2.4e-05 Neutral nitrogen compounds
700 34 63 0 1 0 4 485.514 0.001062 Neutral nitrogen compounds
701 34 63 1 1 0 4 501.514 1.4e-05 Neutral nitrogen compounds
702 35 65 0 1 0 4 499.53 0.00061 Neutral nitrogen compounds
703 36 67 0 1 0 4 513.546 0.000298 Neutral nitrogen compounds
704 37 69 0 1 0 4 527.562 0.000126 Neutral nitrogen compounds
705 38 71 0 1 0 4 541.578 8.6e-05 Neutral nitrogen compounds
706 13 23 1 1 0 3 209.194 5e-06 Neutral nitrogen compounds
707 14 25 1 1 0 3 223.21 4e-06 Neutral nitrogen compounds
708 15 27 1 1 0 3 237.226 9e-06 Neutral nitrogen compounds
709 16 29 1 1 0 3 251.242 1.1e-05 Neutral nitrogen compounds
710 17 31 1 1 0 3 265.258 1.5e-05 Neutral nitrogen compounds
711 18 33 1 1 0 3 279.274 2e-05 Neutral nitrogen compounds
712 19 35 1 1 0 3 293.29 2.3e-05 Neutral nitrogen compounds
713 20 37 1 1 0 3 307.306 3.2e-05 Neutral nitrogen compounds
714 21 39 1 1 0 3 321.322 4.1e-05 Neutral nitrogen compounds
715 22 41 1 1 0 3 335.338 5.2e-05 Neutral nitrogen compounds
716 23 43 1 1 0 3 349.354 5.3e-05 Neutral nitrogen compounds
717 24 45 1 1 0 3 363.37 5.9e-05 Neutral nitrogen compounds
718 25 47 1 1 0 3 377.386 6.8e-05 Neutral nitrogen compounds
719 26 49 1 1 0 3 391.402 5.7e-05 Neutral nitrogen compounds
720 27 51 1 1 0 3 405.418 5.4e-05 Neutral nitrogen compounds
721 28 53 1 1 0 3 419.434 5.9e-05 Neutral nitrogen compounds
722 29 55 1 1 0 3 433.45 3.9e-05 Neutral nitrogen compounds
723 30 57 1 1 0 3 447.466 3.7e-05 Neutral nitrogen compounds
724 31 59 1 1 0 3 461.482 2.4e-05 Neutral nitrogen compounds
725 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
726 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
727 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
728 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
729 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
730 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
731 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
732 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
733 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
734 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
735 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
736 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
737 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
738 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
739 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
740 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
741 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
742 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
743 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
744 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
745 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
746 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
747 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
748 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
749 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
750 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
751 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
752 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
753 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
754 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
755 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
756 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
757 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
758 19 35 1 1 0 3 293.29 1.9e-05 Basic nitrogen compounds
759 20 37 1 1 0 3 307.306 1.8e-05 Basic nitrogen compounds
760 21 39 1 1 0 3 321.322 2.1e-05 Basic nitrogen compounds
761 22 41 1 1 0 3 335.338 3.6e-05 Basic nitrogen compounds
762 23 43 1 1 0 3 349.354 1.9e-05 Basic nitrogen compounds
763 24 45 1 1 0 3 363.37 2.9e-05 Basic nitrogen compounds
764 25 47 1 1 0 3 377.386 3.1e-05 Basic nitrogen compounds
765 26 49 1 1 0 3 391.402 3.1e-05 Basic nitrogen compounds
766 27 51 1 1 0 3 405.418 3.5e-05 Basic nitrogen compounds
767 28 53 1 1 0 3 419.434 1.6e-05 Basic nitrogen compounds
768 12 19 2 1 0 4 209.162 6e-06 Basic nitrogen compounds
769 13 21 1 1 0 4 207.178 6e-06 Basic nitrogen compounds
770 13 21 2 1 0 4 223.178 7e-06 Basic nitrogen compounds
771 14 23 1 1 0 4 221.194 1.1e-05 Basic nitrogen compounds
772 14 23 2 1 0 4 237.194 2.2e-05 Basic nitrogen compounds
773 15 25 1 1 0 4 235.21 1.4e-05 Basic nitrogen compounds
774 15 25 2 1 0 4 251.21 9e-06 Basic nitrogen compounds
775 16 27 1 1 0 4 249.226 2.1e-05 Basic nitrogen compounds
776 16 27 2 1 0 4 265.226 1.2e-05 Basic nitrogen compounds
777 17 29 1 1 0 4 263.242 3.8e-05 Basic nitrogen compounds
778 17 29 2 1 0 4 279.242 1.5e-05 Basic nitrogen compounds
779 18 31 1 1 0 4 277.258 6.4e-05 Basic nitrogen compounds
780 18 31 2 1 0 4 293.258 6.7e-05 Basic nitrogen compounds
781 19 33 1 1 0 4 291.274 7.5e-05 Basic nitrogen compounds
782 19 33 2 1 0 4 307.274 1e-05 Basic nitrogen compounds
783 20 35 1 1 0 4 305.29 0.000123 Basic nitrogen compounds
784 20 35 2 1 0 4 321.29 2e-05 Basic nitrogen compounds
785 21 37 1 1 0 4 319.306 0.000108 Basic nitrogen compounds
786 21 37 2 1 0 4 335.306 1.8e-05 Basic nitrogen compounds
787 22 39 1 1 0 4 333.322 0.000103 Basic nitrogen compounds
788 22 39 2 1 0 4 349.322 2.1e-05 Basic nitrogen compounds
789 23 41 1 1 0 4 347.338 9.4e-05 Basic nitrogen compounds
790 23 41 2 1 0 4 363.338 2.2e-05 Basic nitrogen compounds
791 24 43 1 1 0 4 361.354 0.000105 Basic nitrogen compounds
792 24 43 2 1 0 4 377.354 2.8e-05 Basic nitrogen compounds
793 25 45 1 1 0 4 375.37 0.000102 Basic nitrogen compounds
794 25 45 2 1 0 4 391.37 1.7e-05 Basic nitrogen compounds
795 26 47 1 1 0 4 389.386 7.9e-05 Basic nitrogen compounds
796 27 49 1 1 0 4 403.402 7.3e-05 Basic nitrogen compounds
797 28 51 1 1 0 4 417.418 4.5e-05 Basic nitrogen compounds
798 29 53 1 1 0 4 431.434 3.2e-05 Basic nitrogen compounds
799 30 55 1 1 0 4 445.45 1.4e-05 Basic nitrogen compounds
800 11 15 1 1 0 5 177.13 4e-06 Basic nitrogen compounds
801 13 19 1 1 0 5 205.162 8e-06 Basic nitrogen compounds
802 13 19 2 1 0 5 221.162 1e-05 Basic nitrogen compounds
803 14 21 1 1 0 5 219.178 1.4e-05 Basic nitrogen compounds
804 14 21 2 1 0 5 235.178 1.2e-05 Basic nitrogen compounds
805 15 23 1 1 0 5 233.194 2.4e-05 Basic nitrogen compounds
806 15 23 2 1 0 5 249.194 1.2e-05 Basic nitrogen compounds
807 16 25 1 1 0 5 247.21 2.9e-05 Basic nitrogen compounds
808 16 25 2 1 0 5 263.21 1.7e-05 Basic nitrogen compounds
809 17 27 1 1 0 5 261.226 5.3e-05 Basic nitrogen compounds
810 17 27 2 1 0 5 277.226 2.6e-05 Basic nitrogen compounds
811 18 29 1 1 0 5 275.242 6.6e-05 Basic nitrogen compounds
812 18 29 2 1 0 5 291.242 3e-05 Basic nitrogen compounds
813 19 31 1 1 0 5 289.258 8.1e-05 Basic nitrogen compounds
814 19 31 2 1 0 5 305.258 2.5e-05 Basic nitrogen compounds
815 20 33 1 1 0 5 303.274 8.4e-05 Basic nitrogen compounds
816 20 33 2 1 0 5 319.274 3.6e-05 Basic nitrogen compounds
817 21 35 1 1 0 5 317.29 9.1e-05 Basic nitrogen compounds
818 21 35 2 1 0 5 333.29 3.8e-05 Basic nitrogen compounds
819 22 37 1 1 0 5 331.306 0.000109 Basic nitrogen compounds
820 22 37 2 1 0 5 347.306 4.3e-05 Basic nitrogen compounds
821 23 39 1 1 0 5 345.322 0.000101 Basic nitrogen compounds
822 23 39 2 1 0 5 361.322 5e-05 Basic nitrogen compounds
823 24 41 1 1 0 5 359.338 0.000104 Basic nitrogen compounds
824 24 41 2 1 0 5 375.338 4.4e-05 Basic nitrogen compounds
825 25 43 1 1 0 5 373.354 8.6e-05 Basic nitrogen compounds
826 25 43 2 1 0 5 389.354 4.3e-05 Basic nitrogen compounds
827 26 45 1 1 0 5 387.37 8.3e-05 Basic nitrogen compounds
828 26 45 2 1 0 5 403.37 3e-05 Basic nitrogen compounds
829 27 47 1 1 0 5 401.386 5.9e-05 Basic nitrogen compounds
830 27 47 2 1 0 5 417.386 4.3e-05 Basic nitrogen compounds
831 28 49 1 1 0 5 415.402 4.8e-05 Basic nitrogen compounds
832 28 49 2 1 0 5 431.402 2.5e-05 Basic nitrogen compounds
833 29 51 1 1 0 5 429.418 2.6e-05 Basic nitrogen compounds
834 29 51 2 1 0 5 445.418 2e-05 Basic nitrogen compounds
835 30 53 1 1 0 5 443.434 2.2e-05 Basic nitrogen compounds
836 31 55 1 1 0 5 457.45 1.5e-05 Basic nitrogen compounds
837 32 57 1 1 0 5 471.466 1.4e-05 Basic nitrogen compounds
838 12 15 0 1 0 6 173.13 7e-06 Basic nitrogen compounds
839 12 15 1 1 0 6 189.13 5e-06 Basic nitrogen compounds
840 12 15 2 1 0 6 205.13 5e-06 Basic nitrogen compounds
841 13 17 0 1 0 6 187.146 1.6e-05 Basic nitrogen compounds
842 13 17 1 1 0 6 203.146 7e-06 Basic nitrogen compounds
843 13 17 2 1 0 6 219.146 1.1e-05 Basic nitrogen compounds
844 14 19 0 1 0 6 201.162 4.7e-05 Basic nitrogen compounds
845 14 19 1 1 0 6 217.162 8e-06 Basic nitrogen compounds
846 14 19 2 1 0 6 233.162 1.2e-05 Basic nitrogen compounds
847 15 21 0 1 0 6 215.178 0.000127 Basic nitrogen compounds
848 15 21 1 1 0 6 231.178 1.8e-05 Basic nitrogen compounds
849 15 21 2 1 0 6 247.178 1.5e-05 Basic nitrogen compounds
850 16 23 0 1 0 6 229.194 0.000176 Basic nitrogen compounds
851 16 23 1 1 0 6 245.194 2.8e-05 Basic nitrogen compounds
852 16 23 2 1 0 6 261.194 2.1e-05 Basic nitrogen compounds
853 17 25 0 1 0 6 243.21 0.000272 Basic nitrogen compounds
854 17 25 1 1 0 6 259.21 4.4e-05 Basic nitrogen compounds
855 17 25 2 1 0 6 275.21 1.8e-05 Basic nitrogen compounds
856 18 27 0 1 0 6 257.226 0.000493 Basic nitrogen compounds
857 18 27 1 1 0 6 273.226 6.2e-05 Basic nitrogen compounds
858 18 27 2 1 0 6 289.226 3.3e-05 Basic nitrogen compounds
859 19 29 0 1 0 6 271.242 0.000644 Basic nitrogen compounds
860 19 29 1 1 0 6 287.242 8e-05 Basic nitrogen compounds
861 19 29 2 1 0 6 303.242 4e-05 Basic nitrogen compounds
862 20 31 0 1 0 6 285.258 0.000755 Basic nitrogen compounds
863 20 31 1 1 0 6 301.258 9.8e-05 Basic nitrogen compounds
864 20 31 2 1 0 6 317.258 5e-05 Basic nitrogen compounds
865 21 33 0 1 0 6 299.274 0.000759 Basic nitrogen compounds
866 21 33 1 1 0 6 315.274 0.000101 Basic nitrogen compounds
867 21 33 2 1 0 6 331.274 5.5e-05 Basic nitrogen compounds
868 22 35 0 1 0 6 313.29 0.000933 Basic nitrogen compounds
869 22 35 1 1 0 6 329.29 0.000112 Basic nitrogen compounds
870 22 35 2 1 0 6 345.29 4.9e-05 Basic nitrogen compounds
871 23 37 0 1 0 6 327.306 0.001142 Basic nitrogen compounds
872 23 37 1 1 0 6 343.306 0.000116 Basic nitrogen compounds
873 23 37 2 1 0 6 359.306 7.4e-05 Basic nitrogen compounds
874 24 39 0 1 0 6 341.322 0.001167 Basic nitrogen compounds
875 24 39 1 1 0 6 357.322 0.00011 Basic nitrogen compounds
876 24 39 2 1 0 6 373.322 6.2e-05 Basic nitrogen compounds
877 25 41 0 1 0 6 355.338 0.001152 Basic nitrogen compounds
878 25 41 1 1 0 6 371.338 0.0001 Basic nitrogen compounds
879 25 41 2 1 0 6 387.338 5.4e-05 Basic nitrogen compounds
880 26 43 0 1 0 6 369.354 0.001051 Basic nitrogen compounds
881 26 43 1 1 0 6 385.354 8.8e-05 Basic nitrogen compounds
882 26 43 2 1 0 6 401.354 4.8e-05 Basic nitrogen compounds
883 27 45 0 1 0 6 383.37 0.000913 Basic nitrogen compounds
884 27 45 1 1 0 6 399.37 7.5e-05 Basic nitrogen compounds
885 27 45 2 1 0 6 415.37 3.4e-05 Basic nitrogen compounds
886 28 47 0 1 0 6 397.386 0.000769 Basic nitrogen compounds
887 28 47 1 1 0 6 413.386 4.9e-05 Basic nitrogen compounds
888 28 47 2 1 0 6 429.386 2.9e-05 Basic nitrogen compounds
889 29 49 0 1 0 6 411.402 0.000251 Basic nitrogen compounds
890 29 49 1 1 0 6 427.402 3.4e-05 Basic nitrogen compounds
891 29 49 2 1 0 6 443.402 1.5e-05 Basic nitrogen compounds
892 30 51 0 1 0 6 425.418 0.000387 Basic nitrogen compounds
893 30 51 2 1 0 6 457.418 1.7e-05 Basic nitrogen compounds
894 31 53 0 1 0 6 439.434 0.000243 Basic nitrogen compounds
895 31 53 1 1 0 6 455.434 1.4e-05 Basic nitrogen compounds
896 31 53 2 1 0 6 471.434 1.5e-05 Basic nitrogen compounds
897 32 55 0 1 0 6 453.45 0.000122 Basic nitrogen compounds
898 33 57 0 1 0 6 467.466 6.7e-05 Basic nitrogen compounds
899 12 13 1 1 0 7 187.114 6e-06 Basic nitrogen compounds
900 12 13 2 1 0 7 203.114 5e-06 Basic nitrogen compounds
901 13 15 1 1 0 7 201.13 2.5e-05 Basic nitrogen compounds
902 13 15 2 1 0 7 217.13 7e-06 Basic nitrogen compounds
903 14 17 0 1 0 7 199.146 1.3e-05 Basic nitrogen compounds
904 14 17 1 1 0 7 215.146 5e-05 Basic nitrogen compounds
905 14 17 2 1 0 7 231.146 1.5e-05 Basic nitrogen compounds
906 15 19 0 1 0 7 213.162 0.0001 Basic nitrogen compounds
907 15 19 1 1 0 7 229.162 8.2e-05 Basic nitrogen compounds
908 15 19 2 1 0 7 245.162 1.7e-05 Basic nitrogen compounds
909 16 21 0 1 0 7 227.178 0.000311 Basic nitrogen compounds
910 16 21 1 1 0 7 243.178 8.9e-05 Basic nitrogen compounds
911 16 21 2 1 0 7 259.178 3.3e-05 Basic nitrogen compounds
912 17 23 0 1 0 7 241.194 0.000484 Basic nitrogen compounds
913 17 23 1 1 0 7 257.194 0.000147 Basic nitrogen compounds
914 17 23 2 1 0 7 273.194 4.4e-05 Basic nitrogen compounds
915 18 25 0 1 0 7 255.21 0.001212 Basic nitrogen compounds
916 18 25 1 1 0 7 271.21 0.000179 Basic nitrogen compounds
917 18 25 2 1 0 7 287.21 5e-05 Basic nitrogen compounds
918 19 27 0 1 0 7 269.226 0.001849 Basic nitrogen compounds
919 19 27 1 1 0 7 285.226 0.000207 Basic nitrogen compounds
920 19 27 2 1 0 7 301.226 5.8e-05 Basic nitrogen compounds
921 20 29 0 1 0 7 283.242 0.001649 Basic nitrogen compounds
922 20 29 1 1 0 7 299.242 0.000182 Basic nitrogen compounds
923 20 29 2 1 0 7 315.242 6.4e-05 Basic nitrogen compounds
924 21 31 0 1 0 7 297.258 0.001525 Basic nitrogen compounds
925 21 31 1 1 0 7 313.258 0.000217 Basic nitrogen compounds
926 21 31 2 1 0 7 329.258 7.7e-05 Basic nitrogen compounds
927 22 33 0 1 0 7 311.274 0.00167 Basic nitrogen compounds
928 22 33 1 1 0 7 327.274 0.00021 Basic nitrogen compounds
929 22 33 2 1 0 7 343.274 7.2e-05 Basic nitrogen compounds
930 23 35 0 1 0 7 325.29 0.001737 Basic nitrogen compounds
931 23 35 1 1 0 7 341.29 0.0002 Basic nitrogen compounds
932 23 35 2 1 0 7 357.29 8.5e-05 Basic nitrogen compounds
933 24 37 0 1 0 7 339.306 0.001657 Basic nitrogen compounds
934 24 37 1 1 0 7 355.306 0.000198 Basic nitrogen compounds
935 24 37 2 1 0 7 371.306 7.5e-05 Basic nitrogen compounds
936 25 39 0 1 0 7 353.322 0.001598 Basic nitrogen compounds
937 25 39 1 1 0 7 369.322 0.000179 Basic nitrogen compounds
938 25 39 2 1 0 7 385.322 6.8e-05 Basic nitrogen compounds
939 26 41 0 1 0 7 367.338 0.001386 Basic nitrogen compounds
940 26 41 1 1 0 7 383.338 0.000154 Basic nitrogen compounds
941 26 41 2 1 0 7 399.338 7.4e-05 Basic nitrogen compounds
942 27 43 0 1 0 7 381.354 0.001134 Basic nitrogen compounds
943 27 43 1 1 0 7 397.354 0.000108 Basic nitrogen compounds
944 27 43 2 1 0 7 413.354 4.4e-05 Basic nitrogen compounds
945 28 45 0 1 0 7 395.37 0.000871 Basic nitrogen compounds
946 28 45 1 1 0 7 411.37 4.1e-05 Basic nitrogen compounds
947 28 45 2 1 0 7 427.37 3.5e-05 Basic nitrogen compounds
948 29 47 0 1 0 7 409.386 0.000571 Basic nitrogen compounds
949 29 47 1 1 0 7 425.386 4.8e-05 Basic nitrogen compounds
950 29 47 2 1 0 7 441.386 2.5e-05 Basic nitrogen compounds
951 30 49 0 1 0 7 423.402 0.000411 Basic nitrogen compounds
952 30 49 1 1 0 7 439.402 3.4e-05 Basic nitrogen compounds
953 30 49 2 1 0 7 455.402 1.6e-05 Basic nitrogen compounds
954 31 51 0 1 0 7 437.418 0.000265 Basic nitrogen compounds
955 31 51 1 1 0 7 453.418 1.5e-05 Basic nitrogen compounds
956 31 51 2 1 0 7 469.418 1.3e-05 Basic nitrogen compounds
957 32 53 0 1 0 7 451.434 0.000164 Basic nitrogen compounds
958 32 53 1 1 0 7 467.434 1.6e-05 Basic nitrogen compounds
959 33 55 0 1 0 7 465.45 9.5e-05 Basic nitrogen compounds
960 34 57 0 1 0 7 479.466 4.4e-05 Basic nitrogen compounds
961 12 11 1 1 0 8 185.098 6e-06 Basic nitrogen compounds
962 14 15 1 1 0 8 213.13 1.1e-05 Basic nitrogen compounds
963 14 15 2 1 0 8 229.13 9e-06 Basic nitrogen compounds
964 15 17 0 1 0 8 211.146 7e-06 Basic nitrogen compounds
965 15 17 1 1 0 8 227.146 2.4e-05 Basic nitrogen compounds
966 15 17 2 1 0 8 243.146 1e-05 Basic nitrogen compounds
967 16 19 0 1 0 8 225.162 3.8e-05 Basic nitrogen compounds
968 16 19 1 1 0 8 241.162 4.6e-05 Basic nitrogen compounds
969 16 19 2 1 0 8 257.162 1.9e-05 Basic nitrogen compounds
970 17 21 0 1 0 8 239.178 0.000115 Basic nitrogen compounds
971 17 21 1 1 0 8 255.178 6.8e-05 Basic nitrogen compounds
972 17 21 2 1 0 8 271.178 2.3e-05 Basic nitrogen compounds
973 18 23 0 1 0 8 253.194 0.000336 Basic nitrogen compounds
974 18 23 1 1 0 8 269.194 0.000111 Basic nitrogen compounds
975 18 23 2 1 0 8 285.194 4.3e-05 Basic nitrogen compounds
976 19 25 0 1 0 8 267.21 0.00075 Basic nitrogen compounds
977 19 25 1 1 0 8 283.21 0.000131 Basic nitrogen compounds
978 19 25 2 1 0 8 299.21 4.4e-05 Basic nitrogen compounds
979 20 27 0 1 0 8 281.226 0.000985 Basic nitrogen compounds
980 20 27 1 1 0 8 297.226 0.00016 Basic nitrogen compounds
981 20 27 2 1 0 8 313.226 5.7e-05 Basic nitrogen compounds
982 21 29 0 1 0 8 295.242 0.001062 Basic nitrogen compounds
983 21 29 1 1 0 8 311.242 0.000172 Basic nitrogen compounds
984 21 29 2 1 0 8 327.242 6.7e-05 Basic nitrogen compounds
985 22 31 0 1 0 8 309.258 0.001335 Basic nitrogen compounds
986 22 31 1 1 0 8 325.258 0.000186 Basic nitrogen compounds
987 22 31 2 1 0 8 341.258 7.6e-05 Basic nitrogen compounds
988 23 33 0 1 0 8 323.274 0.001374 Basic nitrogen compounds
989 23 33 1 1 0 8 339.274 0.000159 Basic nitrogen compounds
990 23 33 2 1 0 8 355.274 6.2e-05 Basic nitrogen compounds
991 24 35 0 1 0 8 337.29 0.001294 Basic nitrogen compounds
992 24 35 1 1 0 8 353.29 0.000146 Basic nitrogen compounds
993 24 35 2 1 0 8 369.29 7.2e-05 Basic nitrogen compounds
994 25 37 0 1 0 8 351.306 0.001157 Basic nitrogen compounds
995 25 37 1 1 0 8 367.306 0.000117 Basic nitrogen compounds
996 25 37 2 1 0 8 383.306 5.9e-05 Basic nitrogen compounds
997 26 39 0 1 0 8 365.322 0.000992 Basic nitrogen compounds
998 26 39 1 1 0 8 381.322 0.000118 Basic nitrogen compounds
999 26 39 2 1 0 8 397.322 5.8e-05 Basic nitrogen compounds
1000 27 41 0 1 0 8 379.338 0.00081 Basic nitrogen compounds
1001 27 41 1 1 0 8 395.338 8.4e-05 Basic nitrogen compounds
1002 27 41 2 1 0 8 411.338 2.3e-05 Basic nitrogen compounds
1003 28 43 0 1 0 8 393.354 0.000626 Basic nitrogen compounds
1004 28 43 1 1 0 8 409.354 5.4e-05 Basic nitrogen compounds
1005 28 43 2 1 0 8 425.354 3.5e-05 Basic nitrogen compounds
1006 29 45 0 1 0 8 407.37 0.000424 Basic nitrogen compounds
1007 29 45 1 1 0 8 423.37 3.6e-05 Basic nitrogen compounds
1008 29 45 2 1 0 8 439.37 2.8e-05 Basic nitrogen compounds
1009 30 47 0 1 0 8 421.386 0.000269 Basic nitrogen compounds
1010 30 47 1 1 0 8 437.386 2.8e-05 Basic nitrogen compounds
1011 31 49 0 1 0 8 435.402 0.000188 Basic nitrogen compounds
1012 32 51 0 1 0 8 449.418 0.000101 Basic nitrogen compounds
1013 33 53 0 1 0 8 463.434 6.3e-05 Basic nitrogen compounds
1014 34 55 0 1 0 8 477.45 3.6e-05 Basic nitrogen compounds
1015 13 11 0 1 0 9 181.098 0.000195 Basic nitrogen compounds
1016 14 13 0 1 0 9 195.114 0.000638 Basic nitrogen compounds
1017 15 15 0 1 0 9 209.13 0.001959 Basic nitrogen compounds
1018 15 15 1 1 0 9 225.13 7e-06 Basic nitrogen compounds
1019 15 15 2 1 0 9 241.13 7e-06 Basic nitrogen compounds
1020 16 17 0 1 0 9 223.146 0.003319 Basic nitrogen compounds
1021 16 17 1 1 0 9 239.146 1.6e-05 Basic nitrogen compounds
1022 16 17 2 1 0 9 255.146 1.3e-05 Basic nitrogen compounds
1023 17 19 0 1 0 9 237.162 0.003637 Basic nitrogen compounds
1024 17 19 1 1 0 9 253.162 3.3e-05 Basic nitrogen compounds
1025 17 19 2 1 0 9 269.162 1.9e-05 Basic nitrogen compounds
1026 18 21 0 1 0 9 251.178 0.005193 Basic nitrogen compounds
1027 18 21 1 1 0 9 267.178 6.4e-05 Basic nitrogen compounds
1028 18 21 2 1 0 9 283.178 2.5e-05 Basic nitrogen compounds
1029 19 23 0 1 0 9 265.194 0.007993 Basic nitrogen compounds
1030 19 23 1 1 0 9 281.194 8.5e-05 Basic nitrogen compounds
1031 19 23 2 1 0 9 297.194 2.5e-05 Basic nitrogen compounds
1032 20 25 0 1 0 9 279.21 0.008506 Basic nitrogen compounds
1033 20 25 1 1 0 9 295.21 9.9e-05 Basic nitrogen compounds
1034 20 25 2 1 0 9 311.21 4.2e-05 Basic nitrogen compounds
1035 21 27 0 1 0 9 293.226 0.008018 Basic nitrogen compounds
1036 21 27 1 1 0 9 309.226 0.000129 Basic nitrogen compounds
1037 21 27 2 1 0 9 325.226 5.5e-05 Basic nitrogen compounds
1038 22 29 0 1 0 9 307.242 0.007816 Basic nitrogen compounds
1039 22 29 1 1 0 9 323.242 0.000126 Basic nitrogen compounds
1040 22 29 2 1 0 9 339.242 4.1e-05 Basic nitrogen compounds
1041 23 31 0 1 0 9 321.258 0.007203 Basic nitrogen compounds
1042 23 31 1 1 0 9 337.258 0.000126 Basic nitrogen compounds
1043 23 31 2 1 0 9 353.258 6e-05 Basic nitrogen compounds
1044 24 33 0 1 0 9 335.274 0.005877 Basic nitrogen compounds
1045 24 33 1 1 0 9 351.274 0.000116 Basic nitrogen compounds
1046 24 33 2 1 0 9 367.274 5.7e-05 Basic nitrogen compounds
1047 25 35 0 1 0 9 349.29 0.005006 Basic nitrogen compounds
1048 25 35 1 1 0 9 365.29 0.0001 Basic nitrogen compounds
1049 25 35 2 1 0 9 381.29 5.3e-05 Basic nitrogen compounds
1050 26 37 0 1 0 9 363.306 0.003736 Basic nitrogen compounds
1051 26 37 1 1 0 9 379.306 8.5e-05 Basic nitrogen compounds
1052 26 37 2 1 0 9 395.306 4.7e-05 Basic nitrogen compounds
1053 27 39 0 1 0 9 377.322 0.002668 Basic nitrogen compounds
1054 27 39 1 1 0 9 393.322 6.1e-05 Basic nitrogen compounds
1055 27 39 2 1 0 9 409.322 3.7e-05 Basic nitrogen compounds
1056 28 41 0 1 0 9 391.338 0.001808 Basic nitrogen compounds
1057 28 41 1 1 0 9 407.338 3.9e-05 Basic nitrogen compounds
1058 28 41 2 1 0 9 423.338 2.4e-05 Basic nitrogen compounds
1059 29 43 0 1 0 9 405.354 0.001094 Basic nitrogen compounds
1060 29 43 1 1 0 9 421.354 2.7e-05 Basic nitrogen compounds
1061 29 43 2 1 0 9 437.354 2.2e-05 Basic nitrogen compounds
1062 30 45 0 1 0 9 419.37 0.000617 Basic nitrogen compounds
1063 30 45 1 1 0 9 435.37 1.9e-05 Basic nitrogen compounds
1064 30 45 2 1 0 9 451.37 1.6e-05 Basic nitrogen compounds
1065 31 47 0 1 0 9 433.386 0.000343 Basic nitrogen compounds
1066 32 49 0 1 0 9 447.402 0.00019 Basic nitrogen compounds
1067 33 51 0 1 0 9 461.418 0.000101 Basic nitrogen compounds
1068 33 51 1 1 0 9 477.418 1.3e-05 Basic nitrogen compounds
1069 34 53 0 1 0 9 475.434 5.1e-05 Basic nitrogen compounds
1070 35 55 0 1 0 9 489.45 2.6e-05 Basic nitrogen compounds
1071 14 11 1 1 0 10 209.098 1.3e-05 Basic nitrogen compounds
1072 15 13 0 1 0 10 207.114 3.8e-05 Basic nitrogen compounds
1073 15 13 1 1 0 10 223.114 3.5e-05 Basic nitrogen compounds
1074 15 13 2 1 0 10 239.114 6e-06 Basic nitrogen compounds
1075 16 15 0 1 0 10 221.13 0.00019 Basic nitrogen compounds
1076 16 15 1 1 0 10 237.13 5.1e-05 Basic nitrogen compounds
1077 16 15 2 1 0 10 253.13 1e-05 Basic nitrogen compounds
1078 17 17 0 1 0 10 235.146 0.000537 Basic nitrogen compounds
1079 17 17 1 1 0 10 251.146 6.9e-05 Basic nitrogen compounds
1080 17 17 2 1 0 10 267.146 1e-05 Basic nitrogen compounds
1081 18 19 0 1 0 10 249.162 0.001451 Basic nitrogen compounds
1082 18 19 1 1 0 10 265.162 0.000102 Basic nitrogen compounds
1083 18 19 2 1 0 10 281.162 1.8e-05 Basic nitrogen compounds
1084 19 21 0 1 0 10 263.178 0.003266 Basic nitrogen compounds
1085 19 21 1 1 0 10 279.178 0.000116 Basic nitrogen compounds
1086 19 21 2 1 0 10 295.178 2.6e-05 Basic nitrogen compounds
1087 20 23 0 1 0 10 277.194 0.004119 Basic nitrogen compounds
1088 20 23 1 1 0 10 293.194 0.000128 Basic nitrogen compounds
1089 20 23 2 1 0 10 309.194 3.3e-05 Basic nitrogen compounds
1090 21 25 0 1 0 10 291.21 0.004549 Basic nitrogen compounds
1091 21 25 1 1 0 10 307.21 0.00012 Basic nitrogen compounds
1092 21 25 2 1 0 10 323.21 3.7e-05 Basic nitrogen compounds
1093 22 27 0 1 0 10 305.226 0.004436 Basic nitrogen compounds
1094 22 27 1 1 0 10 321.226 0.000125 Basic nitrogen compounds
1095 22 27 2 1 0 10 337.226 4.1e-05 Basic nitrogen compounds
1096 23 29 0 1 0 10 319.242 0.004458 Basic nitrogen compounds
1097 23 29 1 1 0 10 335.242 0.000122 Basic nitrogen compounds
1098 23 29 2 1 0 10 351.242 4.3e-05 Basic nitrogen compounds
1099 24 31 0 1 0 10 333.258 0.003321 Basic nitrogen compounds
1100 24 31 1 1 0 10 349.258 0.000104 Basic nitrogen compounds
1101 24 31 2 1 0 10 365.258 4.1e-05 Basic nitrogen compounds
1102 25 33 0 1 0 10 347.274 0.002707 Basic nitrogen compounds
1103 25 33 1 1 0 10 363.274 8.5e-05 Basic nitrogen compounds
1104 25 33 2 1 0 10 379.274 3.5e-05 Basic nitrogen compounds
1105 26 35 0 1 0 10 361.29 0.002077 Basic nitrogen compounds
1106 26 35 1 1 0 10 377.29 7.1e-05 Basic nitrogen compounds
1107 26 35 2 1 0 10 393.29 3.7e-05 Basic nitrogen compounds
1108 27 37 0 1 0 10 375.306 0.001534 Basic nitrogen compounds
1109 27 37 1 1 0 10 391.306 5.6e-05 Basic nitrogen compounds
1110 27 37 2 1 0 10 407.306 2.8e-05 Basic nitrogen compounds
1111 28 39 0 1 0 10 389.322 0.001097 Basic nitrogen compounds
1112 28 39 1 1 0 10 405.322 3e-05 Basic nitrogen compounds
1113 28 39 2 1 0 10 421.322 1.9e-05 Basic nitrogen compounds
1114 29 41 0 1 0 10 403.338 0.000657 Basic nitrogen compounds
1115 29 41 1 1 0 10 419.338 2.4e-05 Basic nitrogen compounds
1116 29 41 2 1 0 10 435.338 1.4e-05 Basic nitrogen compounds
1117 30 43 0 1 0 10 417.354 0.000396 Basic nitrogen compounds
1118 30 43 1 1 0 10 433.354 1.5e-05 Basic nitrogen compounds
1119 31 45 0 1 0 10 431.37 0.000237 Basic nitrogen compounds
1120 32 47 0 1 0 10 445.386 0.000132 Basic nitrogen compounds
1121 33 49 0 1 0 10 459.402 7.3e-05 Basic nitrogen compounds
1122 34 51 0 1 0 10 473.418 3.6e-05 Basic nitrogen compounds
1123 35 53 0 1 0 10 487.434 1.3e-05 Basic nitrogen compounds
1124 36 55 0 1 0 10 501.45 1.5e-05 Basic nitrogen compounds
1125 15 11 0 1 0 11 205.098 5e-06 Basic nitrogen compounds
1126 16 13 0 1 0 11 219.114 1.1e-05 Basic nitrogen compounds
1127 16 13 1 1 0 11 235.114 9e-06 Basic nitrogen compounds
1128 17 15 0 1 0 11 233.13 2.5e-05 Basic nitrogen compounds
1129 17 15 1 1 0 11 249.13 1.6e-05 Basic nitrogen compounds
1130 18 17 0 1 0 11 247.146 9.3e-05 Basic nitrogen compounds
1131 18 17 1 1 0 11 263.146 5.6e-05 Basic nitrogen compounds
1132 18 17 2 1 0 11 279.146 1.5e-05 Basic nitrogen compounds
1133 19 19 0 1 0 11 261.162 0.000396 Basic nitrogen compounds
1134 19 19 1 1 0 11 277.162 7.7e-05 Basic nitrogen compounds
1135 19 19 2 1 0 11 293.162 1.3e-05 Basic nitrogen compounds
1136 20 21 0 1 0 11 275.178 0.000789 Basic nitrogen compounds
1137 20 21 1 1 0 11 291.178 9.2e-05 Basic nitrogen compounds
1138 20 21 2 1 0 11 307.178 2.4e-05 Basic nitrogen compounds
1139 21 23 0 1 0 11 289.194 0.001442 Basic nitrogen compounds
1140 21 23 1 1 0 11 305.194 8.5e-05 Basic nitrogen compounds
1141 21 23 2 1 0 11 321.194 2.7e-05 Basic nitrogen compounds
1142 22 25 0 1 0 11 303.21 0.001693 Basic nitrogen compounds
1143 22 25 1 1 0 11 319.21 9.1e-05 Basic nitrogen compounds
1144 22 25 2 1 0 11 335.21 3.3e-05 Basic nitrogen compounds
1145 23 27 0 1 0 11 317.226 0.001834 Basic nitrogen compounds
1146 23 27 1 1 0 11 333.226 8.8e-05 Basic nitrogen compounds
1147 23 27 2 1 0 11 349.226 3.1e-05 Basic nitrogen compounds
1148 24 29 0 1 0 11 331.242 0.001693 Basic nitrogen compounds
1149 24 29 1 1 0 11 347.242 8e-05 Basic nitrogen compounds
1150 24 29 2 1 0 11 363.242 1.9e-05 Basic nitrogen compounds
1151 25 31 0 1 0 11 345.258 0.001371 Basic nitrogen compounds
1152 25 31 1 1 0 11 361.258 6.2e-05 Basic nitrogen compounds
1153 25 31 2 1 0 11 377.258 2.1e-05 Basic nitrogen compounds
1154 26 33 0 1 0 11 359.274 0.001115 Basic nitrogen compounds
1155 26 33 1 1 0 11 375.274 4e-05 Basic nitrogen compounds
1156 26 33 2 1 0 11 391.274 2.8e-05 Basic nitrogen compounds
1157 27 35 0 1 0 11 373.29 0.000803 Basic nitrogen compounds
1158 27 35 1 1 0 11 389.29 3.9e-05 Basic nitrogen compounds
1159 27 35 2 1 0 11 405.29 1.6e-05 Basic nitrogen compounds
1160 28 37 0 1 0 11 387.306 0.000548 Basic nitrogen compounds
1161 28 37 1 1 0 11 403.306 2.1e-05 Basic nitrogen compounds
1162 28 37 2 1 0 11 419.306 1.6e-05 Basic nitrogen compounds
1163 29 39 0 1 0 11 401.322 0.000353 Basic nitrogen compounds
1164 29 39 1 1 0 11 417.322 1.8e-05 Basic nitrogen compounds
1165 30 41 0 1 0 11 415.338 0.000221 Basic nitrogen compounds
1166 30 41 1 1 0 11 431.338 1.3e-05 Basic nitrogen compounds
1167 31 43 0 1 0 11 429.354 0.000145 Basic nitrogen compounds
1168 31 43 1 1 0 11 445.354 1.4e-05 Basic nitrogen compounds
1169 32 45 0 1 0 11 443.37 7.5e-05 Basic nitrogen compounds
1170 33 47 0 1 0 11 457.386 4.9e-05 Basic nitrogen compounds
1171 34 49 0 1 0 11 471.402 3.1e-05 Basic nitrogen compounds
1172 16 11 0 1 0 12 217.098 0.000281 Basic nitrogen compounds
1173 17 13 0 1 0 12 231.114 0.001384 Basic nitrogen compounds
1174 17 13 1 1 0 12 247.114 6e-06 Basic nitrogen compounds
1175 18 15 0 1 0 12 245.13 0.003077 Basic nitrogen compounds
1176 18 15 1 1 0 12 261.13 1.5e-05 Basic nitrogen compounds
1177 19 17 0 1 0 12 259.146 0.00487 Basic nitrogen compounds
1178 19 17 1 1 0 12 275.146 1.6e-05 Basic nitrogen compounds
1179 20 19 0 1 0 12 273.162 0.004871 Basic nitrogen compounds
1180 20 19 1 1 0 12 289.162 3.5e-05 Basic nitrogen compounds
1181 20 19 2 1 0 12 305.162 1.2e-05 Basic nitrogen compounds
1182 21 21 0 1 0 12 287.178 0.003895 Basic nitrogen compounds
1183 21 21 1 1 0 12 303.178 3.2e-05 Basic nitrogen compounds
1184 21 21 2 1 0 12 319.178 1.5e-05 Basic nitrogen compounds
1185 22 23 0 1 0 12 301.194 0.002671 Basic nitrogen compounds
1186 22 23 1 1 0 12 317.194 4.4e-05 Basic nitrogen compounds
1187 23 25 0 1 0 12 315.21 0.002135 Basic nitrogen compounds
1188 23 25 1 1 0 12 331.21 4.6e-05 Basic nitrogen compounds
1189 24 27 0 1 0 12 329.226 0.001709 Basic nitrogen compounds
1190 24 27 1 1 0 12 345.226 4.9e-05 Basic nitrogen compounds
1191 24 27 2 1 0 12 361.226 1.8e-05 Basic nitrogen compounds
1192 25 29 0 1 0 12 343.242 0.001299 Basic nitrogen compounds
1193 25 29 1 1 0 12 359.242 3.7e-05 Basic nitrogen compounds
1194 25 29 2 1 0 12 375.242 1.8e-05 Basic nitrogen compounds
1195 26 31 0 1 0 12 357.258 0.000984 Basic nitrogen compounds
1196 26 31 1 1 0 12 373.258 3.2e-05 Basic nitrogen compounds
1197 26 31 2 1 0 12 389.258 1.7e-05 Basic nitrogen compounds
1198 27 33 0 1 0 12 371.274 0.000664 Basic nitrogen compounds
1199 27 33 1 1 0 12 387.274 2.6e-05 Basic nitrogen compounds
1200 28 35 0 1 0 12 385.29 0.000426 Basic nitrogen compounds
1201 28 35 1 1 0 12 401.29 1.7e-05 Basic nitrogen compounds
1202 29 37 0 1 0 12 399.306 0.000269 Basic nitrogen compounds
1203 29 37 1 1 0 12 415.306 1.6e-05 Basic nitrogen compounds
1204 30 39 0 1 0 12 413.322 0.000162 Basic nitrogen compounds
1205 31 41 0 1 0 12 427.338 9.2e-05 Basic nitrogen compounds
1206 32 43 0 1 0 12 441.354 5e-05 Basic nitrogen compounds
1207 33 45 0 1 0 12 455.37 3e-05 Basic nitrogen compounds
1208 34 47 0 1 0 12 469.386 1.8e-05 Basic nitrogen compounds
1209 17 11 0 1 0 13 229.098 7e-06 Basic nitrogen compounds
1210 18 13 0 1 0 13 243.114 7.4e-05 Basic nitrogen compounds
1211 18 13 1 1 0 13 259.114 1e-05 Basic nitrogen compounds
1212 19 15 0 1 0 13 257.13 0.000389 Basic nitrogen compounds
1213 19 15 1 1 0 13 273.13 2.2e-05 Basic nitrogen compounds
1214 20 17 0 1 0 13 271.146 0.000804 Basic nitrogen compounds
1215 20 17 1 1 0 13 287.146 3.7e-05 Basic nitrogen compounds
1216 21 19 0 1 0 13 285.162 0.001137 Basic nitrogen compounds
1217 21 19 1 1 0 13 301.162 3.1e-05 Basic nitrogen compounds
1218 22 21 0 1 0 13 299.178 0.001207 Basic nitrogen compounds
1219 22 21 1 1 0 13 315.178 3.5e-05 Basic nitrogen compounds
1220 23 23 0 1 0 13 313.194 0.001117 Basic nitrogen compounds
1221 23 23 1 1 0 13 329.194 3.6e-05 Basic nitrogen compounds
1222 24 25 0 1 0 13 327.21 0.000944 Basic nitrogen compounds
1223 24 25 1 1 0 13 343.21 3.3e-05 Basic nitrogen compounds
1224 25 27 0 1 0 13 341.226 0.00071 Basic nitrogen compounds
1225 25 27 1 1 0 13 357.226 3.2e-05 Basic nitrogen compounds
1226 26 29 0 1 0 13 355.242 0.000533 Basic nitrogen compounds
1227 26 29 1 1 0 13 371.242 2.7e-05 Basic nitrogen compounds
1228 27 31 0 1 0 13 369.258 0.000382 Basic nitrogen compounds
1229 27 31 1 1 0 13 385.258 2.3e-05 Basic nitrogen compounds
1230 28 33 0 1 0 13 383.274 0.000262 Basic nitrogen compounds
1231 28 33 1 1 0 13 399.274 1.7e-05 Basic nitrogen compounds
1232 29 35 0 1 0 13 397.29 0.000185 Basic nitrogen compounds
1233 30 37 0 1 0 13 411.306 3.8e-05 Basic nitrogen compounds
1234 31 39 0 1 0 13 425.322 5.8e-05 Basic nitrogen compounds
1235 32 41 0 1 0 13 439.338 3.7e-05 Basic nitrogen compounds
1236 33 43 0 1 0 13 453.354 2.2e-05 Basic nitrogen compounds
1237 18 11 0 1 0 14 241.098 9e-06 Basic nitrogen compounds
1238 19 13 0 1 0 14 255.114 1.5e-05 Basic nitrogen compounds
1239 19 13 1 1 0 14 271.114 1.7e-05 Basic nitrogen compounds
1240 20 15 0 1 0 14 269.13 6.8e-05 Basic nitrogen compounds
1241 20 15 1 1 0 14 285.13 2.8e-05 Basic nitrogen compounds
1242 21 17 0 1 0 14 283.146 0.000121 Basic nitrogen compounds
1243 21 17 1 1 0 14 299.146 4.5e-05 Basic nitrogen compounds
1244 22 19 0 1 0 14 297.162 0.000183 Basic nitrogen compounds
1245 22 19 1 1 0 14 313.162 4.9e-05 Basic nitrogen compounds
1246 23 21 0 1 0 14 311.178 0.000241 Basic nitrogen compounds
1247 23 21 1 1 0 14 327.178 3e-05 Basic nitrogen compounds
1248 24 23 0 1 0 14 325.194 0.000296 Basic nitrogen compounds
1249 24 23 1 1 0 14 341.194 2.4e-05 Basic nitrogen compounds
1250 25 25 0 1 0 14 339.21 0.000289 Basic nitrogen compounds
1251 25 25 1 1 0 14 355.21 1.8e-05 Basic nitrogen compounds
1252 26 27 0 1 0 14 353.226 0.000263 Basic nitrogen compounds
1253 26 27 1 1 0 14 369.226 1.7e-05 Basic nitrogen compounds
1254 27 29 0 1 0 14 367.242 0.000209 Basic nitrogen compounds
1255 27 29 1 1 0 14 383.242 1.5e-05 Basic nitrogen compounds
1256 28 31 0 1 0 14 381.258 0.000172 Basic nitrogen compounds
1257 29 33 0 1 0 14 395.274 0.000104 Basic nitrogen compounds
1258 30 35 0 1 0 14 409.29 5.4e-05 Basic nitrogen compounds
1259 31 37 0 1 0 14 423.306 4.3e-05 Basic nitrogen compounds
1260 32 39 0 1 0 14 437.322 2.7e-05 Basic nitrogen compounds
1261 33 41 0 1 0 14 451.338 1.3e-05 Basic nitrogen compounds
1262 20 13 0 1 0 15 267.114 0.000119 Basic nitrogen compounds
1263 21 15 0 1 0 15 281.13 0.000272 Basic nitrogen compounds
1264 22 17 0 1 0 15 295.146 0.000301 Basic nitrogen compounds
1265 23 19 0 1 0 15 309.162 0.000228 Basic nitrogen compounds
1266 24 21 0 1 0 15 323.178 0.000151 Basic nitrogen compounds
1267 25 23 0 1 0 15 337.194 0.0001 Basic nitrogen compounds
1268 26 25 0 1 0 15 351.21 8.5e-05 Basic nitrogen compounds
1269 27 27 0 1 0 15 365.226 6.7e-05 Basic nitrogen compounds
1270 28 29 0 1 0 15 379.242 4.5e-05 Basic nitrogen compounds
1271 29 31 0 1 0 15 393.258 3.1e-05 Basic nitrogen compounds
1272 30 33 0 1 0 15 407.274 2.6e-05 Basic nitrogen compounds
1273 31 35 0 1 0 15 421.29 1.5e-05 Basic nitrogen compounds
1274 32 37 0 1 0 15 435.306 2.2e-05 Basic nitrogen compounds
1275 22 15 0 1 0 16 293.13 2.7e-05 Basic nitrogen compounds
1276 23 17 0 1 0 16 307.146 6.1e-05 Basic nitrogen compounds
1277 24 19 0 1 0 16 321.162 8.5e-05 Basic nitrogen compounds
1278 25 21 0 1 0 16 335.178 7.7e-05 Basic nitrogen compounds
1279 26 23 0 1 0 16 349.194 5.4e-05 Basic nitrogen compounds
1280 27 25 0 1 0 16 363.21 5e-05 Basic nitrogen compounds
1281 28 27 0 1 0 16 377.226 3.2e-05 Basic nitrogen compounds
1282 30 62 1 0 0 0 438.496 3.3e-05 Acidic fraction
1283 24 50 1 0 0 0 354.4 3.5e-05 Acidic fraction
1284 24 50 2 0 0 0 370.4 3.5e-05 Acidic fraction
1285 23 48 2 0 0 0 356.384 3.9e-05 Acidic fraction
1286 22 46 2 0 0 0 342.368 5.2e-05 Acidic fraction
1287 21 44 2 0 0 0 328.352 5.3e-05 Acidic fraction
1288 20 42 2 0 0 0 314.336 7.9e-05 Acidic fraction
1289 19 40 2 0 0 0 300.32 3.3e-05 Acidic fraction
1290 18 38 2 0 0 0 286.304 4.5e-05 Acidic fraction
1291 17 36 2 0 0 0 272.288 2.2e-05 Acidic fraction
1292 16 34 2 0 0 0 258.272 2.7e-05 Acidic fraction
1293 14 30 2 0 0 0 230.24 1.9e-05 Acidic fraction
1294 34 68 2 0 0 1 508.544 0.000154 Acidic fraction
1295 33 66 2 0 0 1 494.528 0.000177 Acidic fraction
1296 32 64 2 0 0 1 480.512 0.000529 Acidic fraction
1297 31 62 2 0 0 1 466.496 0.000794 Acidic fraction
1298 30 60 2 0 0 1 452.48 0.002244 Acidic fraction
1299 29 58 2 0 0 1 438.464 0.003012 Acidic fraction
1300 28 56 1 0 0 1 408.448 3.9e-05 Acidic fraction
1301 28 56 2 0 0 1 424.448 0.005334 Acidic fraction
1302 27 54 1 0 0 1 394.432 3.7e-05 Acidic fraction
1303 27 54 2 0 0 1 410.432 0.002966 Acidic fraction
1304 26 52 1 0 0 1 380.416 6.5e-05 Acidic fraction
1305 26 52 2 0 0 1 396.416 0.017194 Acidic fraction
1306 25 50 1 0 0 1 366.4 5.3e-05 Acidic fraction
1307 25 50 2 0 0 1 382.4 0.029092 Acidic fraction
1308 24 48 1 0 0 1 352.384 5.7e-05 Acidic fraction
1309 24 48 2 0 0 1 368.384 0.038225 Acidic fraction
1310 23 46 1 0 0 1 338.368 4e-05 Acidic fraction
1311 23 46 2 0 0 1 354.368 0.036131 Acidic fraction
1312 22 44 1 0 0 1 324.352 7.9e-05 Acidic fraction
1313 22 44 2 0 0 1 340.352 0.058149 Acidic fraction
1314 21 42 1 0 0 1 310.336 6.6e-05 Acidic fraction
1315 21 42 2 0 0 1 326.336 0.05287 Acidic fraction
1316 20 40 1 0 0 1 296.32 8.6e-05 Acidic fraction
1317 20 40 2 0 0 1 312.32 0.119192 Acidic fraction
1318 19 38 1 0 0 1 282.304 5.8e-05 Acidic fraction
1319 19 38 2 0 0 1 298.304 0.047852 Acidic fraction
1320 18 36 1 0 0 1 268.288 7e-05 Acidic fraction
1321 18 36 2 0 0 1 284.288 0.058848 Acidic fraction
1322 17 34 1 0 0 1 254.272 4.4e-05 Acidic fraction
1323 17 34 2 0 0 1 270.272 0.019055 Acidic fraction
1324 16 32 1 0 0 1 240.256 4.5e-05 Acidic fraction
1325 16 32 2 0 0 1 256.256 0.059817 Acidic fraction
1326 15 30 1 0 0 1 226.24 3.5e-05 Acidic fraction
1327 15 30 2 0 0 1 242.24 0.007782 Acidic fraction
1328 14 28 2 0 0 1 228.224 0.004583 Acidic fraction
1329 13 26 1 0 0 1 198.208 1.4e-05 Acidic fraction
1330 13 26 2 0 0 1 214.208 0.000805 Acidic fraction
1331 12 24 2 0 0 1 200.192 0.000514 Acidic fraction
1332 11 22 2 0 0 1 186.176 0.000124 Acidic fraction
1333 10 20 2 0 0 1 172.16 0.000127 Acidic fraction
1334 9 18 2 0 0 1 158.144 0.000232 Acidic fraction
1335 6 12 2 0 0 1 116.096 7e-06 Acidic fraction
1336 34 66 2 0 0 2 506.528 5.5e-05 Acidic fraction
1337 33 64 2 0 0 2 492.512 0.000123 Acidic fraction
1338 32 62 2 0 0 2 478.496 0.000235 Acidic fraction
1339 31 60 2 0 0 2 464.48 0.000537 Acidic fraction
1340 30 58 2 0 0 2 450.464 0.00115 Acidic fraction
1341 29 56 1 0 0 2 420.448 3.4e-05 Acidic fraction
1342 29 56 2 0 0 2 436.448 0.001925 Acidic fraction
1343 28 54 2 0 0 2 422.432 0.003069 Acidic fraction
1344 27 52 2 0 0 2 408.416 0.005098 Acidic fraction
1345 26 50 2 0 0 2 394.4 0.007636 Acidic fraction
1346 25 48 2 0 0 2 380.384 0.010276 Acidic fraction
1347 24 46 1 0 0 2 350.368 3.9e-05 Acidic fraction
1348 24 46 2 0 0 2 366.368 0.011717 Acidic fraction
1349 23 44 1 0 0 2 336.352 3.2e-05 Acidic fraction
1350 23 44 2 0 0 2 352.352 0.012186 Acidic fraction
1351 22 42 1 0 0 2 322.336 2.9e-05 Acidic fraction
1352 22 42 2 0 0 2 338.336 0.011636 Acidic fraction
1353 21 40 2 0 0 2 324.32 0.011465 Acidic fraction
1354 20 38 2 0 0 2 310.304 0.012485 Acidic fraction
1355 19 36 2 0 0 2 296.288 0.008969 Acidic fraction
1356 18 34 2 0 0 2 282.272 0.010541 Acidic fraction
1357 17 32 2 0 0 2 268.256 0.006402 Acidic fraction
1358 16 30 1 0 0 2 238.24 2.1e-05 Acidic fraction
1359 16 30 2 0 0 2 254.24 0.005897 Acidic fraction
1360 15 28 1 0 0 2 224.224 1.8e-05 Acidic fraction
1361 15 28 2 0 0 2 240.224 0.002392 Acidic fraction
1362 14 26 2 0 0 2 226.208 0.001629 Acidic fraction
1363 13 24 2 0 0 2 212.192 0.000585 Acidic fraction
1364 12 22 2 0 0 2 198.176 0.0002 Acidic fraction
1365 11 20 2 0 0 2 184.16 9.2e-05 Acidic fraction
1366 10 18 2 0 0 2 170.144 3e-05 Acidic fraction
1367 9 16 2 0 0 2 156.128 1.2e-05 Acidic fraction
1368 8 14 2 0 0 2 142.112 8e-06 Acidic fraction
1369 34 64 2 0 0 3 504.512 3.9e-05 Acidic fraction
1370 33 62 2 0 0 3 490.496 5.8e-05 Acidic fraction
1371 32 60 2 0 0 3 476.48 0.000146 Acidic fraction
1372 31 58 2 0 0 3 462.464 0.0003 Acidic fraction
1373 30 56 2 0 0 3 448.448 0.000619 Acidic fraction
1374 29 54 2 0 0 3 434.432 0.00096 Acidic fraction
1375 28 52 2 0 0 3 420.416 0.001565 Acidic fraction
1376 27 50 1 0 0 3 390.4 3.6e-05 Acidic fraction
1377 27 50 2 0 0 3 406.4 0.002473 Acidic fraction
1378 26 48 2 0 0 3 392.384 0.003554 Acidic fraction
1379 25 46 1 0 0 3 362.368 3.9e-05 Acidic fraction
1380 25 46 2 0 0 3 378.368 0.004379 Acidic fraction
1381 24 44 1 0 0 3 348.352 3.5e-05 Acidic fraction
1382 24 44 2 0 0 3 364.352 0.005125 Acidic fraction
1383 23 42 2 0 0 3 350.336 0.005599 Acidic fraction
1384 22 40 2 0 0 3 336.32 0.005974 Acidic fraction
1385 21 38 2 0 0 3 322.304 0.006624 Acidic fraction
1386 20 36 2 0 0 3 308.288 0.007008 Acidic fraction
1387 19 34 1 0 0 3 278.272 2.6e-05 Acidic fraction
1388 19 34 2 0 0 3 294.272 0.005669 Acidic fraction
1389 18 32 2 0 0 3 280.256 0.005825 Acidic fraction
1390 17 30 1 0 0 3 250.24 2.2e-05 Acidic fraction
1391 17 30 2 0 0 3 266.24 0.004748 Acidic fraction
1392 16 28 2 0 0 3 252.224 0.004964 Acidic fraction
1393 15 26 1 0 0 3 222.208 1.4e-05 Acidic fraction
1394 15 26 2 0 0 3 238.208 0.004277 Acidic fraction
1395 14 24 2 0 0 3 224.192 0.002532 Acidic fraction
1396 13 22 2 0 0 3 210.176 0.001009 Acidic fraction
1397 12 20 2 0 0 3 196.16 0.000192 Acidic fraction
1398 11 18 2 0 0 3 182.144 4e-05 Acidic fraction
1399 10 16 2 0 0 3 168.128 3.7e-05 Acidic fraction
1400 35 64 1 0 0 4 500.512 6.9e-05 Acidic fraction
1401 34 62 1 0 0 4 486.496 0.000199 Acidic fraction
1402 33 60 1 0 0 4 472.48 0.000356 Acidic fraction
1403 33 60 2 0 0 4 488.48 3.9e-05 Acidic fraction
1404 32 58 1 0 0 4 458.464 0.000703 Acidic fraction
1405 32 58 2 0 0 4 474.464 7.6e-05 Acidic fraction
1406 31 56 1 0 0 4 444.448 0.001356 Acidic fraction
1407 31 56 2 0 0 4 460.448 0.00016 Acidic fraction
1408 30 54 1 0 0 4 430.432 0.002504 Acidic fraction
1409 30 54 2 0 0 4 446.432 0.000332 Acidic fraction
1410 29 52 1 0 0 4 416.416 0.005123 Acidic fraction
1411 29 52 2 0 0 4 432.416 0.000722 Acidic fraction
1412 28 50 1 0 0 4 402.4 0.013057 Acidic fraction
1413 28 50 2 0 0 4 418.4 0.001098 Acidic fraction
1414 27 48 1 0 0 4 388.384 0.01889 Acidic fraction
1415 27 48 2 0 0 4 404.384 0.001641 Acidic fraction
1416 26 46 1 0 0 4 374.368 0.011445 Acidic fraction
1417 26 46 2 0 0 4 390.368 0.002295 Acidic fraction
1418 25 44 1 0 0 4 360.352 0.011913 Acidic fraction
1419 25 44 2 0 0 4 376.352 0.002481 Acidic fraction
1420 24 42 1 0 0 4 346.336 0.012821 Acidic fraction
1421 24 42 2 0 0 4 362.336 0.002792 Acidic fraction
1422 23 40 1 0 0 4 332.32 0.013369 Acidic fraction
1423 23 40 2 0 0 4 348.32 0.002657 Acidic fraction
1424 22 38 1 0 0 4 318.304 0.011785 Acidic fraction
1425 22 38 2 0 0 4 334.304 0.002753 Acidic fraction
1426 21 36 1 0 0 4 304.288 0.008968 Acidic fraction
1427 21 36 2 0 0 4 320.288 0.003474 Acidic fraction
1428 20 34 1 0 0 4 290.272 0.007609 Acidic fraction
1429 20 34 2 0 0 4 306.272 0.003618 Acidic fraction
1430 19 32 1 0 0 4 276.256 0.005524 Acidic fraction
1431 19 32 2 0 0 4 292.256 0.003073 Acidic fraction
1432 18 30 1 0 0 4 262.24 0.004532 Acidic fraction
1433 18 30 2 0 0 4 278.24 0.003147 Acidic fraction
1434 17 28 1 0 0 4 248.224 0.002787 Acidic fraction
1435 17 28 2 0 0 4 264.224 0.003696 Acidic fraction
1436 16 26 1 0 0 4 234.208 0.001427 Acidic fraction
1437 16 26 2 0 0 4 250.208 0.004019 Acidic fraction
1438 15 24 1 0 0 4 220.192 0.000892 Acidic fraction
1439 15 24 2 0 0 4 236.192 0.003077 Acidic fraction
1440 14 22 1 0 0 4 206.176 0.00108 Acidic fraction
1441 14 22 2 0 0 4 222.176 0.00338 Acidic fraction
1442 13 20 1 0 0 4 192.16 0.000103 Acidic fraction
1443 13 20 2 0 0 4 208.16 0.000439 Acidic fraction
1444 12 18 1 0 0 4 178.144 2e-05 Acidic fraction
1445 12 18 2 0 0 4 194.144 4.3e-05 Acidic fraction
1446 11 16 1 0 0 4 164.128 1e-05 Acidic fraction
1447 11 16 2 0 0 4 180.128 2.6e-05 Acidic fraction
1448 10 14 2 0 0 4 166.112 1.8e-05 Acidic fraction
1449 9 12 2 0 0 4 152.096 1.3e-05 Acidic fraction
1450 36 64 1 0 0 5 512.512 4.5e-05 Acidic fraction
1451 35 62 1 0 0 5 498.496 6.3e-05 Acidic fraction
1452 34 60 1 0 0 5 484.48 0.000153 Acidic fraction
1453 33 58 1 0 0 5 470.464 0.000272 Acidic fraction
1454 33 58 2 0 0 5 486.464 5.8e-05 Acidic fraction
1455 32 56 1 0 0 5 456.448 0.000522 Acidic fraction
1456 32 56 2 0 0 5 472.448 9.5e-05 Acidic fraction
1457 31 54 1 0 0 5 442.432 0.000964 Acidic fraction
1458 31 54 2 0 0 5 458.432 0.000267 Acidic fraction
1459 30 52 1 0 0 5 428.416 0.001448 Acidic fraction
1460 30 52 2 0 0 5 444.416 0.000725 Acidic fraction
1461 29 50 1 0 0 5 414.4 0.002425 Acidic fraction
1462 29 50 2 0 0 5 430.4 0.002078 Acidic fraction
1463 28 48 1 0 0 5 400.384 0.004682 Acidic fraction
1464 28 48 2 0 0 5 416.384 0.007699 Acidic fraction
1465 27 46 1 0 0 5 386.368 0.008858 Acidic fraction
1466 27 46 2 0 0 5 402.368 0.004065 Acidic fraction
1467 26 44 1 0 0 5 372.352 0.005506 Acidic fraction
1468 26 44 2 0 0 5 388.352 0.00187 Acidic fraction
1469 25 42 1 0 0 5 358.336 0.006137 Acidic fraction
1470 25 42 2 0 0 5 374.336 0.002093 Acidic fraction
1471 24 40 1 0 0 5 344.32 0.006356 Acidic fraction
1472 24 40 2 0 0 5 360.32 0.002428 Acidic fraction
1473 23 38 1 0 0 5 330.304 0.00666 Acidic fraction
1474 23 38 2 0 0 5 346.304 0.002752 Acidic fraction
1475 22 36 1 0 0 5 316.288 0.006405 Acidic fraction
1476 22 36 2 0 0 5 332.288 0.002973 Acidic fraction
1477 21 34 1 0 0 5 302.272 0.005789 Acidic fraction
1478 21 34 2 0 0 5 318.272 0.002492 Acidic fraction
1479 20 32 1 0 0 5 288.256 0.005592 Acidic fraction
1480 20 32 2 0 0 5 304.256 0.002827 Acidic fraction
1481 19 30 1 0 0 5 274.24 0.0027 Acidic fraction
1482 19 30 2 0 0 5 290.24 0.002063 Acidic fraction
1483 18 28 1 0 0 5 260.224 0.003978 Acidic fraction
1484 18 28 2 0 0 5 276.224 0.001713 Acidic fraction
1485 17 26 1 0 0 5 246.208 0.002361 Acidic fraction
1486 17 26 2 0 0 5 262.208 0.001849 Acidic fraction
1487 16 24 1 0 0 5 232.192 0.001538 Acidic fraction
1488 16 24 2 0 0 5 248.192 0.001751 Acidic fraction
1489 15 22 1 0 0 5 218.176 0.001103 Acidic fraction
1490 15 22 2 0 0 5 234.176 0.000904 Acidic fraction
1491 14 20 1 0 0 5 204.16 0.000501 Acidic fraction
1492 14 20 2 0 0 5 220.16 0.000299 Acidic fraction
1493 13 18 1 0 0 5 190.144 0.000186 Acidic fraction
1494 13 18 2 0 0 5 206.144 0.000163 Acidic fraction
1495 12 16 1 0 0 5 176.128 3.4e-05 Acidic fraction
1496 12 16 2 0 0 5 192.128 5.4e-05 Acidic fraction
1497 11 14 2 0 0 5 178.112 6.4e-05 Acidic fraction
1498 10 12 2 0 0 5 164.096 1.9e-05 Acidic fraction
1499 35 60 1 0 0 6 496.48 4.1e-05 Acidic fraction
1500 34 58 1 0 0 6 482.464 7.3e-05 Acidic fraction
1501 33 56 1 0 0 6 468.448 0.000151 Acidic fraction
1502 32 54 1 0 0 6 454.432 0.000314 Acidic fraction
1503 32 54 2 0 0 6 470.432 8.1e-05 Acidic fraction
1504 31 52 1 0 0 6 440.416 0.000513 Acidic fraction
1505 31 52 2 0 0 6 456.416 0.000181 Acidic fraction
1506 30 50 1 0 0 6 426.4 0.000829 Acidic fraction
1507 30 50 2 0 0 6 442.4 0.000349 Acidic fraction
1508 29 48 1 0 0 6 412.384 0.001279 Acidic fraction
1509 29 48 2 0 0 6 428.384 0.000521 Acidic fraction
1510 28 46 1 0 0 6 398.368 0.001992 Acidic fraction
1511 28 46 2 0 0 6 414.368 0.000936 Acidic fraction
1512 27 44 1 0 0 6 384.352 0.002928 Acidic fraction
1513 27 44 2 0 0 6 400.352 0.001116 Acidic fraction
1514 26 42 1 0 0 6 370.336 0.003628 Acidic fraction
1515 26 42 2 0 0 6 386.336 0.001206 Acidic fraction
1516 25 40 1 0 0 6 356.32 0.004341 Acidic fraction
1517 25 40 2 0 0 6 372.32 0.001445 Acidic fraction
1518 24 38 1 0 0 6 342.304 0.004203 Acidic fraction
1519 24 38 2 0 0 6 358.304 0.001716 Acidic fraction
1520 23 36 1 0 0 6 328.288 0.004314 Acidic fraction
1521 23 36 2 0 0 6 344.288 0.001584 Acidic fraction
1522 22 34 1 0 0 6 314.272 0.004023 Acidic fraction
1523 22 34 2 0 0 6 330.272 0.001787 Acidic fraction
1524 21 32 1 0 0 6 300.256 0.003807 Acidic fraction
1525 21 32 2 0 0 6 316.256 0.001695 Acidic fraction
1526 20 30 1 0 0 6 286.24 0.005524 Acidic fraction
1527 20 30 2 0 0 6 302.24 0.002064 Acidic fraction
1528 19 28 1 0 0 6 272.224 0.003974 Acidic fraction
1529 19 28 2 0 0 6 288.224 0.001682 Acidic fraction
1530 18 26 1 0 0 6 258.208 0.003029 Acidic fraction
1531 18 26 2 0 0 6 274.208 0.000874 Acidic fraction
1532 17 24 1 0 0 6 244.192 0.001693 Acidic fraction
1533 17 24 2 0 0 6 260.192 0.001281 Acidic fraction
1534 16 22 1 0 0 6 230.176 0.001045 Acidic fraction
1535 16 22 2 0 0 6 246.176 0.000682 Acidic fraction
1536 15 20 1 0 0 6 216.16 0.00043 Acidic fraction
1537 15 20 2 0 0 6 232.16 0.000317 Acidic fraction
1538 14 18 1 0 0 6 202.144 0.000117 Acidic fraction
1539 14 18 2 0 0 6 218.144 0.000132 Acidic fraction
1540 13 16 1 0 0 6 188.128 2.9e-05 Acidic fraction
1541 13 16 2 0 0 6 204.128 0.000102 Acidic fraction
1542 12 14 1 0 0 6 174.112 1.5e-05 Acidic fraction
1543 12 14 2 0 0 6 190.112 3.4e-05 Acidic fraction
1544 11 12 2 0 0 6 176.096 1.8e-05 Acidic fraction
1545 34 56 1 0 0 7 480.448 4e-05 Acidic fraction
1546 33 54 1 0 0 7 466.432 9.7e-05 Acidic fraction
1547 32 52 1 0 0 7 452.416 0.000171 Acidic fraction
1548 32 52 2 0 0 7 468.416 4.4e-05 Acidic fraction
1549 31 50 1 0 0 7 438.4 0.000301 Acidic fraction
1550 31 50 2 0 0 7 454.4 8.2e-05 Acidic fraction
1551 30 48 1 0 0 7 424.384 0.0005 Acidic fraction
1552 30 48 2 0 0 7 440.384 0.000187 Acidic fraction
1553 29 46 1 0 0 7 410.368 0.000386 Acidic fraction
1554 29 46 2 0 0 7 426.368 0.000348 Acidic fraction
1555 28 44 1 0 0 7 396.352 0.001252 Acidic fraction
1556 28 44 2 0 0 7 412.352 0.000519 Acidic fraction
1557 27 42 1 0 0 7 382.336 0.001609 Acidic fraction
1558 27 42 2 0 0 7 398.336 0.000786 Acidic fraction
1559 26 40 1 0 0 7 368.32 0.001973 Acidic fraction
1560 26 40 2 0 0 7 384.32 0.000926 Acidic fraction
1561 25 38 1 0 0 7 354.304 0.002348 Acidic fraction
1562 25 38 2 0 0 7 370.304 0.001017 Acidic fraction
1563 24 36 1 0 0 7 340.288 0.002478 Acidic fraction
1564 24 36 2 0 0 7 356.288 0.001153 Acidic fraction
1565 23 34 1 0 0 7 326.272 0.002616 Acidic fraction
1566 23 34 2 0 0 7 342.272 0.00118 Acidic fraction
1567 22 32 1 0 0 7 312.256 0.002489 Acidic fraction
1568 22 32 2 0 0 7 328.256 0.001277 Acidic fraction
1569 21 30 1 0 0 7 298.24 0.002336 Acidic fraction
1570 21 30 2 0 0 7 314.24 0.001702 Acidic fraction
1571 20 28 1 0 0 7 284.224 0.002378 Acidic fraction
1572 20 28 2 0 0 7 300.224 0.002115 Acidic fraction
1573 19 26 1 0 0 7 270.208 0.001499 Acidic fraction
1574 19 26 2 0 0 7 286.208 0.001206 Acidic fraction
1575 18 24 1 0 0 7 256.192 0.000886 Acidic fraction
1576 18 24 2 0 0 7 272.192 0.001124 Acidic fraction
1577 17 22 1 0 0 7 242.176 0.000362 Acidic fraction
1578 17 22 2 0 0 7 258.176 0.000908 Acidic fraction
1579 16 20 1 0 0 7 228.16 0.000158 Acidic fraction
1580 16 20 2 0 0 7 244.16 0.000398 Acidic fraction
1581 15 18 1 0 0 7 214.144 9.1e-05 Acidic fraction
1582 15 18 2 0 0 7 230.144 0.00014 Acidic fraction
1583 14 16 1 0 0 7 200.128 4.5e-05 Acidic fraction
1584 14 16 2 0 0 7 216.128 4.3e-05 Acidic fraction
1585 13 14 1 0 0 7 186.112 3.1e-05 Acidic fraction
1586 13 14 2 0 0 7 202.112 2.8e-05 Acidic fraction
1587 12 12 1 0 0 7 172.096 1.3e-05 Acidic fraction
1588 35 56 1 0 0 8 492.448 4.8e-05 Acidic fraction
1589 34 54 1 0 0 8 478.432 6.7e-05 Acidic fraction
1590 33 52 1 0 0 8 464.416 0.000128 Acidic fraction
1591 32 50 1 0 0 8 450.4 0.000187 Acidic fraction
1592 32 50 2 0 0 8 466.4 3.8e-05 Acidic fraction
1593 31 48 1 0 0 8 436.384 0.000318 Acidic fraction
1594 31 48 2 0 0 8 452.384 7.9e-05 Acidic fraction
1595 30 46 1 0 0 8 422.368 0.000536 Acidic fraction
1596 30 46 2 0 0 8 438.368 0.000256 Acidic fraction
1597 29 44 1 0 0 8 408.352 0.000865 Acidic fraction
1598 29 44 2 0 0 8 424.352 0.000343 Acidic fraction
1599 28 42 1 0 0 8 394.336 0.001264 Acidic fraction
1600 28 42 2 0 0 8 410.336 0.000441 Acidic fraction
1601 27 40 1 0 0 8 380.32 0.001685 Acidic fraction
1602 27 40 2 0 0 8 396.32 0.000485 Acidic fraction
1603 26 38 1 0 0 8 366.304 0.00194 Acidic fraction
1604 26 38 2 0 0 8 382.304 0.000565 Acidic fraction
1605 25 36 1 0 0 8 352.288 0.002263 Acidic fraction
1606 25 36 2 0 0 8 368.288 0.000701 Acidic fraction
1607 24 34 1 0 0 8 338.272 0.002246 Acidic fraction
1608 24 34 2 0 0 8 354.272 0.000781 Acidic fraction
1609 23 32 1 0 0 8 324.256 0.002395 Acidic fraction
1610 23 32 2 0 0 8 340.256 0.000823 Acidic fraction
1611 22 30 1 0 0 8 310.24 0.002247 Acidic fraction
1612 22 30 2 0 0 8 326.24 0.000833 Acidic fraction
1613 21 28 1 0 0 8 296.224 0.001811 Acidic fraction
1614 21 28 2 0 0 8 312.224 0.000681 Acidic fraction
1615 20 26 1 0 0 8 282.208 0.001519 Acidic fraction
1616 20 26 2 0 0 8 298.208 0.000546 Acidic fraction
1617 19 24 1 0 0 8 268.192 0.001884 Acidic fraction
1618 19 24 2 0 0 8 284.192 0.000457 Acidic fraction
1619 18 22 1 0 0 8 254.176 0.000905 Acidic fraction
1620 18 22 2 0 0 8 270.176 0.000429 Acidic fraction
1621 17 20 1 0 0 8 240.16 0.000637 Acidic fraction
1622 17 20 2 0 0 8 256.16 0.00029 Acidic fraction
1623 16 18 1 0 0 8 226.144 0.000522 Acidic fraction
1624 16 18 2 0 0 8 242.144 0.000252 Acidic fraction
1625 15 16 1 0 0 8 212.128 0.000254 Acidic fraction
1626 15 16 2 0 0 8 228.128 9.3e-05 Acidic fraction
1627 14 14 1 0 0 8 198.112 9.2e-05 Acidic fraction
1628 14 14 2 0 0 8 214.112 5.4e-05 Acidic fraction
1629 13 12 1 0 0 8 184.096 2.9e-05 Acidic fraction
1630 13 12 2 0 0 8 200.096 1.5e-05 Acidic fraction
1631 34 52 1 0 0 9 476.416 3.8e-05 Acidic fraction
1632 33 50 1 0 0 9 462.4 7.7e-05 Acidic fraction
1633 32 48 1 0 0 9 448.384 0.000141 Acidic fraction
1634 31 46 1 0 0 9 434.368 0.000288 Acidic fraction
1635 30 44 1 0 0 9 420.352 0.00041 Acidic fraction
1636 29 42 1 0 0 9 406.336 0.000702 Acidic fraction
1637 28 40 1 0 0 9 392.32 0.001 Acidic fraction
1638 27 38 1 0 0 9 378.304 0.001253 Acidic fraction
1639 26 36 1 0 0 9 364.288 0.001602 Acidic fraction
1640 26 36 2 0 0 9 380.288 0.000377 Acidic fraction
1641 25 34 1 0 0 9 350.272 0.001614 Acidic fraction
1642 25 34 2 0 0 9 366.272 0.000481 Acidic fraction
1643 24 32 1 0 0 9 336.256 0.001704 Acidic fraction
1644 24 32 2 0 0 9 352.256 0.002819 Acidic fraction
1645 23 30 1 0 0 9 322.24 0.001827 Acidic fraction
1646 23 30 2 0 0 9 338.24 0.000503 Acidic fraction
1647 22 28 1 0 0 9 308.224 0.001778 Acidic fraction
1648 22 28 2 0 0 9 324.224 0.000537 Acidic fraction
1649 21 26 1 0 0 9 294.208 0.001713 Acidic fraction
1650 21 26 2 0 0 9 310.208 0.000485 Acidic fraction
1651 20 24 1 0 0 9 280.192 0.001611 Acidic fraction
1652 20 24 2 0 0 9 296.192 0.000396 Acidic fraction
1653 19 22 1 0 0 9 266.176 0.001245 Acidic fraction
1654 19 22 2 0 0 9 282.176 0.000339 Acidic fraction
1655 18 20 1 0 0 9 252.16 0.000806 Acidic fraction
1656 18 20 2 0 0 9 268.16 0.000303 Acidic fraction
1657 17 18 1 0 0 9 238.144 0.000414 Acidic fraction
1658 17 18 2 0 0 9 254.144 0.000224 Acidic fraction
1659 16 16 1 0 0 9 224.128 0.000263 Acidic fraction
1660 16 16 2 0 0 9 240.128 0.000161 Acidic fraction
1661 15 14 1 0 0 9 210.112 0.000107 Acidic fraction
1662 15 14 2 0 0 9 226.112 0.000102 Acidic fraction
1663 14 12 1 0 0 9 196.096 2.8e-05 Acidic fraction
1664 14 12 2 0 0 9 212.096 3.1e-05 Acidic fraction
1665 34 50 1 0 0 10 474.4 4.1e-05 Acidic fraction
1666 33 48 1 0 0 10 460.384 9.6e-05 Acidic fraction
1667 32 46 1 0 0 10 446.368 0.000139 Acidic fraction
1668 31 44 1 0 0 10 432.352 0.000253 Acidic fraction
1669 30 42 1 0 0 10 418.336 0.000321 Acidic fraction
1670 29 40 1 0 0 10 404.32 0.000474 Acidic fraction
1671 28 38 1 0 0 10 390.304 0.000615 Acidic fraction
1672 27 36 1 0 0 10 376.288 0.000838 Acidic fraction
1673 26 34 1 0 0 10 362.272 0.000938 Acidic fraction
1674 26 34 2 0 0 10 378.272 0.000255 Acidic fraction
1675 25 32 1 0 0 10 348.256 0.000981 Acidic fraction
1676 25 32 2 0 0 10 364.256 0.000285 Acidic fraction
1677 24 30 1 0 0 10 334.24 0.001014 Acidic fraction
1678 24 30 2 0 0 10 350.24 0.000317 Acidic fraction
1679 23 28 1 0 0 10 320.224 0.001136 Acidic fraction
1680 23 28 2 0 0 10 336.224 0.000353 Acidic fraction
1681 22 26 1 0 0 10 306.208 0.000988 Acidic fraction
1682 21 24 1 0 0 10 292.192 0.000866 Acidic fraction
1683 21 24 2 0 0 10 308.192 0.000307 Acidic fraction
1684 20 22 1 0 0 10 278.176 0.000686 Acidic fraction
1685 20 22 2 0 0 10 294.176 0.00025 Acidic fraction
1686 19 20 1 0 0 10 264.16 0.000527 Acidic fraction
1687 19 20 2 0 0 10 280.16 0.000225 Acidic fraction
1688 18 18 1 0 0 10 250.144 0.000227 Acidic fraction
1689 18 18 2 0 0 10 266.144 0.000174 Acidic fraction
1690 17 16 1 0 0 10 236.128 7.8e-05 Acidic fraction
1691 17 16 2 0 0 10 252.128 7.3e-05 Acidic fraction
1692 16 14 1 0 0 10 222.112 8.3e-05 Acidic fraction
1693 16 14 2 0 0 10 238.112 2.6e-05 Acidic fraction
1694 15 12 1 0 0 10 208.096 2.6e-05 Acidic fraction
1695 34 48 1 0 0 11 472.384 3.9e-05 Acidic fraction
1696 33 46 1 0 0 11 458.368 3.7e-05 Acidic fraction
1697 32 44 1 0 0 11 444.352 0.000108 Acidic fraction
1698 31 42 1 0 0 11 430.336 0.000133 Acidic fraction
1699 30 40 1 0 0 11 416.32 0.000199 Acidic fraction
1700 29 38 1 0 0 11 402.304 0.000242 Acidic fraction
1701 28 36 1 0 0 11 388.288 0.000369 Acidic fraction
1702 27 34 1 0 0 11 374.272 0.000502 Acidic fraction
1703 26 32 1 0 0 11 360.256 0.000636 Acidic fraction
1704 26 32 2 0 0 11 376.256 0.000112 Acidic fraction
1705 25 30 1 0 0 11 346.24 0.000687 Acidic fraction
1706 25 30 2 0 0 11 362.24 0.000143 Acidic fraction
1707 24 28 1 0 0 11 332.224 0.000735 Acidic fraction
1708 24 28 2 0 0 11 348.224 0.000158 Acidic fraction
1709 23 26 1 0 0 11 318.208 0.000729 Acidic fraction
1710 23 26 2 0 0 11 334.208 0.00015 Acidic fraction
1711 22 24 1 0 0 11 304.192 0.000653 Acidic fraction
1712 22 24 2 0 0 11 320.192 0.000134 Acidic fraction
1713 21 22 1 0 0 11 290.176 0.000677 Acidic fraction
1714 21 22 2 0 0 11 306.176 0.000118 Acidic fraction
1715 20 20 1 0 0 11 276.16 0.000586 Acidic fraction
1716 20 20 2 0 0 11 292.16 0.000104 Acidic fraction
1717 19 18 1 0 0 11 262.144 0.000496 Acidic fraction
1718 19 18 2 0 0 11 278.144 7.1e-05 Acidic fraction
1719 18 16 1 0 0 11 248.128 0.000276 Acidic fraction
1720 18 16 2 0 0 11 264.128 4.8e-05 Acidic fraction
1721 17 14 1 0 0 11 234.112 8.7e-05 Acidic fraction
1722 17 14 2 0 0 11 250.112 2.4e-05 Acidic fraction
1723 16 12 1 0 0 11 220.096 2.8e-05 Acidic fraction
1724 16 12 2 0 0 11 236.096 1.6e-05 Acidic fraction
1725 33 44 1 0 0 12 456.352 4.3e-05 Acidic fraction
1726 32 42 1 0 0 12 442.336 4e-05 Acidic fraction
1727 31 40 1 0 0 12 428.32 0.000101 Acidic fraction
1728 30 38 1 0 0 12 414.304 0.000115 Acidic fraction
1729 29 36 1 0 0 12 400.288 0.000175 Acidic fraction
1730 28 34 1 0 0 12 386.272 0.000227 Acidic fraction
1731 27 32 1 0 0 12 372.256 0.000311 Acidic fraction
1732 26 30 1 0 0 12 358.24 0.000379 Acidic fraction
1733 25 28 1 0 0 12 344.224 0.000403 Acidic fraction
1734 25 28 2 0 0 12 360.224 8.6e-05 Acidic fraction
1735 24 26 1 0 0 12 330.208 0.000424 Acidic fraction
1736 24 26 2 0 0 12 346.208 7.6e-05 Acidic fraction
1737 23 24 1 0 0 12 316.192 0.000399 Acidic fraction
1738 23 24 2 0 0 12 332.192 8.7e-05 Acidic fraction
1739 22 22 1 0 0 12 302.176 0.000391 Acidic fraction
1740 22 22 2 0 0 12 318.176 7.7e-05 Acidic fraction
1741 21 20 1 0 0 12 288.16 0.00033 Acidic fraction
1742 21 20 2 0 0 12 304.16 7.9e-05 Acidic fraction
1743 20 18 1 0 0 12 274.144 0.000146 Acidic fraction
1744 20 18 2 0 0 12 290.144 7e-05 Acidic fraction
1745 19 16 1 0 0 12 260.128 0.000154 Acidic fraction
1746 19 16 2 0 0 12 276.128 5.4e-05 Acidic fraction
1747 18 14 1 0 0 12 246.112 6.4e-05 Acidic fraction
1748 18 14 2 0 0 12 262.112 4.7e-05 Acidic fraction
1749 17 12 2 0 0 12 248.096 2.1e-05 Acidic fraction
1750 32 40 1 0 0 13 440.32 3.6e-05 Acidic fraction
1751 29 34 1 0 0 13 398.272 0.000112 Acidic fraction
1752 28 32 1 0 0 13 384.256 0.000163 Acidic fraction
1753 27 30 1 0 0 13 370.24 0.000183 Acidic fraction
1754 26 28 1 0 0 13 356.224 0.000225 Acidic fraction
1755 26 28 2 0 0 13 372.224 0.000165 Acidic fraction
1756 25 26 1 0 0 13 342.208 0.000213 Acidic fraction
1757 25 26 2 0 0 13 358.208 0.000189 Acidic fraction
1758 24 24 1 0 0 13 328.192 0.000233 Acidic fraction
1759 24 24 2 0 0 13 344.192 0.00026 Acidic fraction
1760 23 22 1 0 0 13 314.176 0.000221 Acidic fraction
1761 23 22 2 0 0 13 330.176 0.000322 Acidic fraction
1762 22 20 1 0 0 13 300.16 0.000164 Acidic fraction
1763 22 20 2 0 0 13 316.16 0.000331 Acidic fraction
1764 21 18 1 0 0 13 286.144 0.000114 Acidic fraction
1765 21 18 2 0 0 13 302.144 0.000252 Acidic fraction
1766 20 16 1 0 0 13 272.128 9.1e-05 Acidic fraction
1767 20 16 2 0 0 13 288.128 0.000171 Acidic fraction
1768 19 14 1 0 0 13 258.112 4.1e-05 Acidic fraction
1769 19 14 2 0 0 13 274.112 4.1e-05 Acidic fraction
1770 18 12 1 0 0 13 244.096 1.8e-05 Acidic fraction
1771 18 12 2 0 0 13 260.096 2.3e-05 Acidic fraction
1772 27 28 1 0 0 14 368.224 8.1e-05 Acidic fraction
1773 26 26 1 0 0 14 354.208 9.9e-05 Acidic fraction
1774 25 24 1 0 0 14 340.192 8.8e-05 Acidic fraction
1775 24 22 1 0 0 14 326.176 9.2e-05 Acidic fraction
1776 23 20 1 0 0 14 312.16 0.000104 Acidic fraction
1777 22 18 1 0 0 14 298.144 8.2e-05 Acidic fraction
1778 21 16 1 0 0 14 284.128 7.9e-05 Acidic fraction
1779 20 14 1 0 0 14 270.112 4.5e-05 Acidic fraction
1780 38 72 0 0 1 3 560.636 1.9e-05 Thiophenic compounds
1781 34 64 0 0 1 3 504.572 3.5e-05 Thiophenic compounds
1782 31 58 0 0 1 3 462.524 2.8e-05 Thiophenic compounds
1783 30 56 0 0 1 3 448.508 0.000107 Thiophenic compounds
1784 29 54 0 0 1 3 434.492 6e-05 Thiophenic compounds
1785 28 52 0 0 1 3 420.476 1.3e-05 Thiophenic compounds
1786 27 50 0 0 1 3 406.46 1.5e-05 Thiophenic compounds
1787 26 48 0 0 1 3 392.444 8.1e-05 Thiophenic compounds
1788 25 46 0 0 1 3 378.428 0.000108 Thiophenic compounds
1789 24 44 0 0 1 3 364.412 0.000129 Thiophenic compounds
1790 23 42 0 0 1 3 350.396 4.3e-05 Thiophenic compounds
1791 22 40 0 0 1 3 336.38 0.000198 Thiophenic compounds
1792 21 38 0 0 1 3 322.364 0.000155 Thiophenic compounds
1793 20 36 0 0 1 3 308.348 0.000338 Thiophenic compounds
1794 19 34 0 0 1 3 294.332 0.000332 Thiophenic compounds
1795 18 32 0 0 1 3 280.316 0.000327 Thiophenic compounds
1796 17 30 0 0 1 3 266.3 0.000288 Thiophenic compounds
1797 16 28 0 0 1 3 252.284 0.000344 Thiophenic compounds
1798 15 26 0 0 1 3 238.268 0.000337 Thiophenic compounds
1799 14 24 0 0 1 3 224.252 0.000408 Thiophenic compounds
1800 13 22 0 0 1 3 210.236 0.000461 Thiophenic compounds
1801 12 20 0 0 1 3 196.22 0.000298 Thiophenic compounds
1802 11 18 0 0 1 3 182.204 0.000162 Thiophenic compounds
1803 10 16 0 0 1 3 168.188 6e-06 Thiophenic compounds
1804 44 82 0 0 1 4 642.716 2.1e-05 Thiophenic compounds
1805 36 66 0 0 1 4 530.588 3.5e-05 Thiophenic compounds
1806 35 64 0 0 1 4 516.572 2.7e-05 Thiophenic compounds
1807 34 62 0 0 1 4 502.556 1.8e-05 Thiophenic compounds
1808 31 56 0 0 1 4 460.508 4.9e-05 Thiophenic compounds
1809 30 54 0 0 1 4 446.492 5.9e-05 Thiophenic compounds
1810 29 52 0 0 1 4 432.476 0.000129 Thiophenic compounds
1811 28 50 0 0 1 4 418.46 2.2e-05 Thiophenic compounds
1812 27 48 0 0 1 4 404.444 5.1e-05 Thiophenic compounds
1813 26 46 0 0 1 4 390.428 0.000141 Thiophenic compounds
1814 25 44 0 0 1 4 376.412 0.000167 Thiophenic compounds
1815 24 42 0 0 1 4 362.396 0.000148 Thiophenic compounds
1816 23 40 0 0 1 4 348.38 0.000248 Thiophenic compounds
1817 22 38 0 0 1 4 334.364 0.00027 Thiophenic compounds
1818 21 36 0 0 1 4 320.348 0.000307 Thiophenic compounds
1819 20 34 0 0 1 4 306.332 0.000412 Thiophenic compounds
1820 19 32 0 0 1 4 292.316 0.000614 Thiophenic compounds
1821 18 30 0 0 1 4 278.3 0.000565 Thiophenic compounds
1822 17 28 0 0 1 4 264.284 0.000578 Thiophenic compounds
1823 16 26 0 0 1 4 250.268 0.000664 Thiophenic compounds
1824 15 24 0 0 1 4 236.252 0.000679 Thiophenic compounds
1825 14 22 0 0 1 4 222.236 0.000458 Thiophenic compounds
1826 13 20 0 0 1 4 208.22 0.000555 Thiophenic compounds
1827 12 18 0 0 1 4 194.204 0.000898 Thiophenic compounds
1828 11 16 0 0 1 4 180.188 0.000138 Thiophenic compounds
1829 10 14 0 0 1 4 166.172 2.8e-05 Thiophenic compounds
1830 6 6 0 0 1 4 110.108 6e-06 Thiophenic compounds
1831 42 76 0 0 1 5 612.668 1.8e-05 Thiophenic compounds
1832 40 72 0 0 1 5 584.636 2e-05 Thiophenic compounds
1833 38 68 0 0 1 5 556.604 9.5e-05 Thiophenic compounds
1834 37 66 0 0 1 5 542.588 4e-05 Thiophenic compounds
1835 36 64 0 0 1 5 528.572 6.3e-05 Thiophenic compounds
1836 35 62 0 0 1 5 514.556 5e-05 Thiophenic compounds
1837 34 60 0 0 1 5 500.54 0.000103 Thiophenic compounds
1838 33 58 0 0 1 5 486.524 0.000202 Thiophenic compounds
1839 32 56 0 0 1 5 472.508 0.000295 Thiophenic compounds
1840 31 54 0 0 1 5 458.492 0.000179 Thiophenic compounds
1841 30 52 0 0 1 5 444.476 0.00026 Thiophenic compounds
1842 29 50 0 0 1 5 430.46 0.000296 Thiophenic compounds
1843 28 48 0 0 1 5 416.444 0.000376 Thiophenic compounds
1844 27 46 0 0 1 5 402.428 0.000479 Thiophenic compounds
1845 26 44 0 0 1 5 388.412 0.000573 Thiophenic compounds
1846 25 42 0 0 1 5 374.396 0.000495 Thiophenic compounds
1847 24 40 0 0 1 5 360.38 0.000847 Thiophenic compounds
1848 23 38 0 0 1 5 346.364 0.000675 Thiophenic compounds
1849 22 36 0 0 1 5 332.348 0.000835 Thiophenic compounds
1850 21 34 0 0 1 5 318.332 0.000952 Thiophenic compounds
1851 20 32 0 0 1 5 304.316 0.000883 Thiophenic compounds
1852 19 30 0 0 1 5 290.3 0.001033 Thiophenic compounds
1853 18 28 0 0 1 5 276.284 0.000966 Thiophenic compounds
1854 17 26 0 0 1 5 262.268 0.000959 Thiophenic compounds
1855 16 24 0 0 1 5 248.252 0.000828 Thiophenic compounds
1856 15 22 0 0 1 5 234.236 0.000576 Thiophenic compounds
1857 14 20 0 0 1 5 220.22 0.000219 Thiophenic compounds
1858 13 18 0 0 1 5 206.204 0.000104 Thiophenic compounds
1859 12 16 0 0 1 5 192.188 6e-06 Thiophenic compounds
1860 46 82 0 0 1 6 666.716 3.7e-05 Thiophenic compounds
1861 44 78 0 0 1 6 638.684 4.2e-05 Thiophenic compounds
1862 43 76 0 0 1 6 624.668 3.8e-05 Thiophenic compounds
1863 41 72 0 0 1 6 596.636 5.4e-05 Thiophenic compounds
1864 40 70 0 0 1 6 582.62 4.6e-05 Thiophenic compounds
1865 39 68 0 0 1 6 568.604 4.9e-05 Thiophenic compounds
1866 38 66 0 0 1 6 554.588 0.000334 Thiophenic compounds
1867 37 64 0 0 1 6 540.572 0.000345 Thiophenic compounds
1868 36 62 0 0 1 6 526.556 0.000528 Thiophenic compounds
1869 35 60 0 0 1 6 512.54 0.000274 Thiophenic compounds
1870 34 58 0 0 1 6 498.524 0.000642 Thiophenic compounds
1871 33 56 0 0 1 6 484.508 0.000844 Thiophenic compounds
1872 32 54 0 0 1 6 470.492 0.001307 Thiophenic compounds
1873 31 52 0 0 1 6 456.476 0.001137 Thiophenic compounds
1874 30 50 0 0 1 6 442.46 0.001793 Thiophenic compounds
1875 29 48 0 0 1 6 428.444 0.001988 Thiophenic compounds
1876 28 46 0 0 1 6 414.428 0.00209 Thiophenic compounds
1877 27 44 0 0 1 6 400.412 0.002396 Thiophenic compounds
1878 26 42 0 0 1 6 386.396 0.003257 Thiophenic compounds
1879 25 40 0 0 1 6 372.38 0.004121 Thiophenic compounds
1880 24 38 0 0 1 6 358.364 0.005355 Thiophenic compounds
1881 23 36 0 0 1 6 344.348 0.005952 Thiophenic compounds
1882 22 34 0 0 1 6 330.332 0.006988 Thiophenic compounds
1883 21 32 0 0 1 6 316.316 0.00898 Thiophenic compounds
1884 20 30 0 0 1 6 302.3 0.011965 Thiophenic compounds
1885 19 28 0 0 1 6 288.284 0.012359 Thiophenic compounds
1886 18 26 0 0 1 6 274.268 0.016035 Thiophenic compounds
1887 17 24 0 0 1 6 260.252 0.017039 Thiophenic compounds
1888 16 22 0 0 1 6 246.236 0.017938 Thiophenic compounds
1889 15 20 0 0 1 6 232.22 0.017138 Thiophenic compounds
1890 14 18 0 0 1 6 218.204 0.013424 Thiophenic compounds
1891 13 16 0 0 1 6 204.188 0.010591 Thiophenic compounds
1892 12 14 0 0 1 6 190.172 0.008199 Thiophenic compounds
1893 11 12 0 0 1 6 176.156 0.005043 Thiophenic compounds
1894 10 10 0 0 1 6 162.14 0.000551 Thiophenic compounds
1895 9 8 0 0 1 6 148.124 4e-06 Thiophenic compounds
1896 46 80 0 0 1 7 664.7 2.9e-05 Thiophenic compounds
1897 45 78 0 0 1 7 650.684 3e-05 Thiophenic compounds
1898 42 72 0 0 1 7 608.636 2.4e-05 Thiophenic compounds
1899 41 70 0 0 1 7 594.62 6.2e-05 Thiophenic compounds
1900 40 68 0 0 1 7 580.604 1.3e-05 Thiophenic compounds
1901 39 66 0 0 1 7 566.588 6.9e-05 Thiophenic compounds
1902 38 64 0 0 1 7 552.572 2.7e-05 Thiophenic compounds
1903 37 62 0 0 1 7 538.556 6.3e-05 Thiophenic compounds
1904 36 60 0 0 1 7 524.54 0.000316 Thiophenic compounds
1905 35 58 0 0 1 7 510.524 0.000412 Thiophenic compounds
1906 34 56 0 0 1 7 496.508 0.000379 Thiophenic compounds
1907 33 54 0 0 1 7 482.492 0.000367 Thiophenic compounds
1908 32 52 0 0 1 7 468.476 0.000565 Thiophenic compounds
1909 31 50 0 0 1 7 454.46 0.000716 Thiophenic compounds
1910 30 48 0 0 1 7 440.444 0.00091 Thiophenic compounds
1911 29 46 0 0 1 7 426.428 0.00137 Thiophenic compounds
1912 28 44 0 0 1 7 412.412 0.001225 Thiophenic compounds
1913 27 42 0 0 1 7 398.396 0.001486 Thiophenic compounds
1914 26 40 0 0 1 7 384.38 0.001588 Thiophenic compounds
1915 25 38 0 0 1 7 370.364 0.002295 Thiophenic compounds
1916 24 36 0 0 1 7 356.348 0.002837 Thiophenic compounds
1917 23 34 0 0 1 7 342.332 0.00339 Thiophenic compounds
1918 22 32 0 0 1 7 328.316 0.004438 Thiophenic compounds
1919 21 30 0 0 1 7 314.3 0.00556 Thiophenic compounds
1920 20 28 0 0 1 7 300.284 0.008888 Thiophenic compounds
1921 19 26 0 0 1 7 286.268 0.008741 Thiophenic compounds
1922 18 24 0 0 1 7 272.252 0.010038 Thiophenic compounds
1923 17 22 0 0 1 7 258.236 0.011147 Thiophenic compounds
1924 16 20 0 0 1 7 244.22 0.009874 Thiophenic compounds
1925 15 18 0 0 1 7 230.204 0.007554 Thiophenic compounds
1926 14 16 0 0 1 7 216.188 0.002466 Thiophenic compounds
1927 13 14 0 0 1 7 202.172 0.001471 Thiophenic compounds
1928 12 12 0 0 1 7 188.156 0.000205 Thiophenic compounds
1929 11 10 0 0 1 7 174.14 0.000168 Thiophenic compounds
1930 10 8 0 0 1 7 160.124 0.000209 Thiophenic compounds
1931 9 6 0 0 1 7 146.108 3.9e-05 Thiophenic compounds
1932 44 74 0 0 1 8 634.652 2.2e-05 Thiophenic compounds
1933 43 72 0 0 1 8 620.636 6.7e-05 Thiophenic compounds
1934 41 68 0 0 1 8 592.604 8.5e-05 Thiophenic compounds
1935 39 64 0 0 1 8 564.572 2.7e-05 Thiophenic compounds
1936 38 62 0 0 1 8 550.556 9.9e-05 Thiophenic compounds
1937 37 60 0 0 1 8 536.54 0.000106 Thiophenic compounds
1938 36 58 0 0 1 8 522.524 8.3e-05 Thiophenic compounds
1939 35 56 0 0 1 8 508.508 0.000153 Thiophenic compounds
1940 34 54 0 0 1 8 494.492 0.000286 Thiophenic compounds
1941 33 52 0 0 1 8 480.476 0.000418 Thiophenic compounds
1942 32 50 0 0 1 8 466.46 0.000375 Thiophenic compounds
1943 31 48 0 0 1 8 452.444 0.000575 Thiophenic compounds
1944 30 46 0 0 1 8 438.428 0.000698 Thiophenic compounds
1945 29 44 0 0 1 8 424.412 0.001032 Thiophenic compounds
1946 28 42 0 0 1 8 410.396 0.001139 Thiophenic compounds
1947 27 40 0 0 1 8 396.38 0.001189 Thiophenic compounds
1948 26 38 0 0 1 8 382.364 0.001205 Thiophenic compounds
1949 25 36 0 0 1 8 368.348 0.001571 Thiophenic compounds
1950 24 34 0 0 1 8 354.332 0.001834 Thiophenic compounds
1951 23 32 0 0 1 8 340.316 0.001971 Thiophenic compounds
1952 22 30 0 0 1 8 326.3 0.003042 Thiophenic compounds
1953 21 28 0 0 1 8 312.284 0.003157 Thiophenic compounds
1954 20 26 0 0 1 8 298.268 0.00434 Thiophenic compounds
1955 19 24 0 0 1 8 284.252 0.004254 Thiophenic compounds
1956 18 22 0 0 1 8 270.236 0.004367 Thiophenic compounds
1957 17 20 0 0 1 8 256.22 0.003635 Thiophenic compounds
1958 16 18 0 0 1 8 242.204 0.002631 Thiophenic compounds
1959 15 16 0 0 1 8 228.188 0.001597 Thiophenic compounds
1960 14 14 0 0 1 8 214.172 0.000673 Thiophenic compounds
1961 13 12 0 0 1 8 200.156 0.000175 Thiophenic compounds
1962 12 10 0 0 1 8 186.14 0.000267 Thiophenic compounds
1963 11 8 0 0 1 8 172.124 0.000242 Thiophenic compounds
1964 10 6 0 0 1 8 158.108 8.9e-05 Thiophenic compounds
1965 45 74 0 0 1 9 646.652 5.3e-05 Thiophenic compounds
1966 44 72 0 0 1 9 632.636 7.6e-05 Thiophenic compounds
1967 43 70 0 0 1 9 618.62 3.9e-05 Thiophenic compounds
1968 42 68 0 0 1 9 604.604 8.7e-05 Thiophenic compounds
1969 41 66 0 0 1 9 590.588 0.000253 Thiophenic compounds
1970 40 64 0 0 1 9 576.572 0.000188 Thiophenic compounds
1971 39 62 0 0 1 9 562.556 0.000418 Thiophenic compounds
1972 38 60 0 0 1 9 548.54 0.000467 Thiophenic compounds
1973 37 58 0 0 1 9 534.524 0.000411 Thiophenic compounds
1974 36 56 0 0 1 9 520.508 0.000544 Thiophenic compounds
1975 35 54 0 0 1 9 506.492 0.000757 Thiophenic compounds
1976 34 52 0 0 1 9 492.476 0.000665 Thiophenic compounds
1977 33 50 0 0 1 9 478.46 0.001053 Thiophenic compounds
1978 32 48 0 0 1 9 464.444 0.001183 Thiophenic compounds
1979 31 46 0 0 1 9 450.428 0.001091 Thiophenic compounds
1980 30 44 0 0 1 9 436.412 0.001613 Thiophenic compounds
1981 29 42 0 0 1 9 422.396 0.001719 Thiophenic compounds
1982 28 40 0 0 1 9 408.38 0.001902 Thiophenic compounds
1983 27 38 0 0 1 9 394.364 0.002257 Thiophenic compounds
1984 26 36 0 0 1 9 380.348 0.003005 Thiophenic compounds
1985 25 34 0 0 1 9 366.332 0.003616 Thiophenic compounds
1986 24 32 0 0 1 9 352.316 0.005483 Thiophenic compounds
1987 23 30 0 0 1 9 338.3 0.006875 Thiophenic compounds
1988 22 28 0 0 1 9 324.284 0.008027 Thiophenic compounds
1989 21 26 0 0 1 9 310.268 0.010313 Thiophenic compounds
1990 20 24 0 0 1 9 296.252 0.013881 Thiophenic compounds
1991 19 22 0 0 1 9 282.236 0.018676 Thiophenic compounds
1992 18 20 0 0 1 9 268.22 0.028095 Thiophenic compounds
1993 17 18 0 0 1 9 254.204 0.050419 Thiophenic compounds
1994 16 16 0 0 1 9 240.188 0.075084 Thiophenic compounds
1995 15 14 0 0 1 9 226.172 0.109881 Thiophenic compounds
1996 14 12 0 0 1 9 212.156 0.101165 Thiophenic compounds
1997 13 10 0 0 1 9 198.14 0.045382 Thiophenic compounds
1998 12 8 0 0 1 9 184.124 0.006855 Thiophenic compounds
1999 11 6 0 0 1 9 170.108 0.000323 Thiophenic compounds
2000 48 78 0 0 1 10 686.684 1.9e-05 Thiophenic compounds
2001 46 74 0 0 1 10 658.652 4.1e-05 Thiophenic compounds
2002 44 70 0 0 1 10 630.62 0.000116 Thiophenic compounds
2003 43 68 0 0 1 10 616.604 3.6e-05 Thiophenic compounds
2004 42 66 0 0 1 10 602.588 0.000452 Thiophenic compounds
2005 42 66 0 0 2 10 634.648 1.8e-05 Thiophenic compounds
2006 41 64 0 0 1 10 588.572 0.000175 Thiophenic compounds
2007 40 62 0 0 1 10 574.556 0.000307 Thiophenic compounds
2008 39 60 0 0 1 10 560.54 0.000398 Thiophenic compounds
2009 38 58 0 0 1 10 546.524 0.000182 Thiophenic compounds
2010 37 56 0 0 1 10 532.508 0.000389 Thiophenic compounds
2011 36 54 0 0 1 10 518.492 0.00065 Thiophenic compounds
2012 35 52 0 0 1 10 504.476 0.000581 Thiophenic compounds
2013 35 52 0 0 2 10 536.536 3.2e-05 Thiophenic compounds
2014 34 50 0 0 1 10 490.46 0.000664 Thiophenic compounds
2015 33 48 0 0 1 10 476.444 0.000685 Thiophenic compounds
2016 33 48 0 0 2 10 508.504 2.9e-05 Thiophenic compounds
2017 32 46 0 0 1 10 462.428 0.000607 Thiophenic compounds
2018 31 44 0 0 1 10 448.412 0.001212 Thiophenic compounds
2019 31 44 0 0 2 10 480.472 1e-05 Thiophenic compounds
2020 30 42 0 0 1 10 434.396 0.001283 Thiophenic compounds
2021 29 40 0 0 1 10 420.38 0.001223 Thiophenic compounds
2022 28 38 0 0 1 10 406.364 0.001398 Thiophenic compounds
2023 27 36 0 0 1 10 392.348 0.001734 Thiophenic compounds
2024 26 34 0 0 1 10 378.332 0.001895 Thiophenic compounds
2025 25 32 0 0 1 10 364.316 0.002735 Thiophenic compounds
2026 24 30 0 0 1 10 350.3 0.002703 Thiophenic compounds
2027 23 28 0 0 1 10 336.284 0.004684 Thiophenic compounds
2028 22 26 0 0 1 10 322.268 0.006168 Thiophenic compounds
2029 21 24 0 0 1 10 308.252 0.008601 Thiophenic compounds
2030 20 22 0 0 1 10 294.236 0.013473 Thiophenic compounds
2031 19 20 0 0 1 10 280.22 0.018443 Thiophenic compounds
2032 18 18 0 0 1 10 266.204 0.018035 Thiophenic compounds
2033 18 18 0 0 2 10 298.264 1.7e-05 Thiophenic compounds
2034 17 16 0 0 1 10 252.188 0.018793 Thiophenic compounds
2035 16 14 0 0 1 10 238.172 0.009729 Thiophenic compounds
2036 15 12 0 0 1 10 224.156 0.003188 Thiophenic compounds
2037 14 10 0 0 1 10 210.14 0.000918 Thiophenic compounds
2038 14 10 0 0 2 10 242.2 5e-06 Thiophenic compounds
2039 13 8 0 0 1 10 196.124 0.001077 Thiophenic compounds
2040 12 6 0 0 1 10 182.108 0.000393 Thiophenic compounds
2041 51 82 0 0 1 11 726.716 2e-05 Thiophenic compounds
2042 50 80 0 0 1 11 712.7 1.7e-05 Thiophenic compounds
2043 47 74 0 0 1 11 670.652 2.2e-05 Thiophenic compounds
2044 44 68 0 0 1 11 628.604 7.7e-05 Thiophenic compounds
2045 42 64 0 0 2 11 632.632 2.4e-05 Thiophenic compounds
2046 41 62 0 0 1 11 586.556 2.6e-05 Thiophenic compounds
2047 40 60 0 0 1 11 572.54 0.000183 Thiophenic compounds
2048 39 58 0 0 1 11 558.524 0.000209 Thiophenic compounds
2049 38 56 0 0 1 11 544.508 0.000283 Thiophenic compounds
2050 37 54 0 0 1 11 530.492 0.000332 Thiophenic compounds
2051 36 52 0 0 1 11 516.476 0.000368 Thiophenic compounds
2052 35 50 0 0 1 11 502.46 0.000377 Thiophenic compounds
2053 35 50 0 0 2 11 534.52 7.8e-05 Thiophenic compounds
2054 34 48 0 0 1 11 488.444 0.000348 Thiophenic compounds
2055 33 46 0 0 1 11 474.428 0.000988 Thiophenic compounds
2056 33 46 0 0 2 11 506.488 5.5e-05 Thiophenic compounds
2057 32 44 0 0 1 11 460.412 0.000839 Thiophenic compounds
2058 31 42 0 0 1 11 446.396 0.000788 Thiophenic compounds
2059 31 42 0 0 2 11 478.456 0.00014 Thiophenic compounds
2060 30 40 0 0 1 11 432.38 0.000911 Thiophenic compounds
2061 30 40 0 0 2 11 464.44 2.9e-05 Thiophenic compounds
2062 29 38 0 0 1 11 418.364 0.00107 Thiophenic compounds
2063 29 38 0 0 2 11 450.424 7e-05 Thiophenic compounds
2064 28 36 0 0 1 11 404.348 0.001051 Thiophenic compounds
2065 28 36 0 0 2 11 436.408 0.000174 Thiophenic compounds
2066 27 34 0 0 1 11 390.332 0.001282 Thiophenic compounds
2067 26 32 0 0 1 11 376.316 0.001622 Thiophenic compounds
2068 26 32 0 0 2 11 408.376 0.000208 Thiophenic compounds
2069 25 30 0 0 1 11 362.3 0.001809 Thiophenic compounds
2070 25 30 0 0 2 11 394.36 0.000333 Thiophenic compounds
2071 24 28 0 0 1 11 348.284 0.002763 Thiophenic compounds
2072 24 28 0 0 2 11 380.344 0.000417 Thiophenic compounds
2073 23 26 0 0 1 11 334.268 0.003374 Thiophenic compounds
2074 23 26 0 0 2 11 366.328 0.00064 Thiophenic compounds
2075 22 24 0 0 1 11 320.252 0.004723 Thiophenic compounds
2076 22 24 0 0 2 11 352.312 0.001039 Thiophenic compounds
2077 21 22 0 0 1 11 306.236 0.005621 Thiophenic compounds
2078 21 22 0 0 2 11 338.296 0.001356 Thiophenic compounds
2079 20 20 0 0 1 11 292.22 0.006489 Thiophenic compounds
2080 20 20 0 0 2 11 324.28 0.001887 Thiophenic compounds
2081 19 18 0 0 1 11 278.204 0.009574 Thiophenic compounds
2082 19 18 0 0 2 11 310.264 0.002611 Thiophenic compounds
2083 18 16 0 0 1 11 264.188 0.013523 Thiophenic compounds
2084 18 16 0 0 2 11 296.248 0.003343 Thiophenic compounds
2085 17 14 0 0 1 11 250.172 0.013152 Thiophenic compounds
2086 17 14 0 0 2 11 282.232 0.002655 Thiophenic compounds
2087 16 12 0 0 1 11 236.156 0.0056 Thiophenic compounds
2088 16 12 0 0 2 11 268.216 0.001564 Thiophenic compounds
2089 15 10 0 0 1 11 222.14 0.001425 Thiophenic compounds
2090 15 10 0 0 2 11 254.2 0.000282 Thiophenic compounds
2091 14 8 0 0 1 11 208.124 0.000109 Thiophenic compounds
2092 14 8 0 0 2 11 240.184 8e-06 Thiophenic compounds
2093 13 6 0 0 1 11 194.108 2e-05 Thiophenic compounds
2094 47 72 0 0 1 12 668.636 9.6e-05 Thiophenic compounds
2095 46 70 0 0 1 12 654.62 2.9e-05 Thiophenic compounds
2096 45 68 0 0 1 12 640.604 1.6e-05 Thiophenic compounds
2097 44 66 0 0 1 12 626.588 4.8e-05 Thiophenic compounds
2098 43 64 0 0 1 12 612.572 1.7e-05 Thiophenic compounds
2099 42 62 0 0 2 12 630.616 1.5e-05 Thiophenic compounds
2100 41 60 0 0 1 12 584.54 5.7e-05 Thiophenic compounds
2101 41 60 0 0 2 12 616.6 9.1e-05 Thiophenic compounds
2102 40 58 0 0 1 12 570.524 3.5e-05 Thiophenic compounds
2103 40 58 0 0 2 12 602.584 8.4e-05 Thiophenic compounds
2104 39 56 0 0 1 12 556.508 8.9e-05 Thiophenic compounds
2105 39 56 0 0 2 12 588.568 0.000219 Thiophenic compounds
2106 38 54 0 0 1 12 542.492 0.000101 Thiophenic compounds
2107 38 54 0 0 2 12 574.552 3.5e-05 Thiophenic compounds
2108 37 52 0 0 1 12 528.476 0.000135 Thiophenic compounds
2109 37 52 0 0 2 12 560.536 0.000295 Thiophenic compounds
2110 36 50 0 0 1 12 514.46 0.000214 Thiophenic compounds
2111 36 50 0 0 2 12 546.52 0.000247 Thiophenic compounds
2112 35 48 0 0 1 12 500.444 0.000315 Thiophenic compounds
2113 35 48 0 0 2 12 532.504 0.000189 Thiophenic compounds
2114 34 46 0 0 1 12 486.428 0.000461 Thiophenic compounds
2115 34 46 0 0 2 12 518.488 0.000318 Thiophenic compounds
2116 33 44 0 0 1 12 472.412 0.000416 Thiophenic compounds
2117 33 44 0 0 2 12 504.472 0.000565 Thiophenic compounds
2118 32 42 0 0 1 12 458.396 0.000451 Thiophenic compounds
2119 32 42 0 0 2 12 490.456 0.000813 Thiophenic compounds
2120 31 40 0 0 1 12 444.38 0.000876 Thiophenic compounds
2121 31 40 0 0 2 12 476.44 0.000799 Thiophenic compounds
2122 30 38 0 0 1 12 430.364 0.001004 Thiophenic compounds
2123 30 38 0 0 2 12 462.424 0.000418 Thiophenic compounds
2124 29 36 0 0 1 12 416.348 0.000962 Thiophenic compounds
2125 29 36 0 0 2 12 448.408 0.000496 Thiophenic compounds
2126 28 34 0 0 1 12 402.332 0.00112 Thiophenic compounds
2127 28 34 0 0 2 12 434.392 0.00058 Thiophenic compounds
2128 27 32 0 0 1 12 388.316 0.00138 Thiophenic compounds
2129 27 32 0 0 2 12 420.376 0.000404 Thiophenic compounds
2130 26 30 0 0 1 12 374.3 0.001514 Thiophenic compounds
2131 26 30 0 0 2 12 406.36 0.000338 Thiophenic compounds
2132 25 28 0 0 1 12 360.284 0.002106 Thiophenic compounds
2133 25 28 0 0 2 12 392.344 0.000189 Thiophenic compounds
2134 24 26 0 0 1 12 346.268 0.002723 Thiophenic compounds
2135 24 26 0 0 2 12 378.328 0.000221 Thiophenic compounds
2136 23 24 0 0 1 12 332.252 0.005162 Thiophenic compounds
2137 23 24 0 0 2 12 364.312 0.000248 Thiophenic compounds
2138 22 22 0 0 1 12 318.236 0.008505 Thiophenic compounds
2139 22 22 0 0 2 12 350.296 0.000437 Thiophenic compounds
2140 21 20 0 0 1 12 304.22 0.015245 Thiophenic compounds
2141 21 20 0 0 2 12 336.28 0.000289 Thiophenic compounds
2142 20 18 0 0 1 12 290.204 0.023092 Thiophenic compounds
2143 20 18 0 0 2 12 322.264 0.000338 Thiophenic compounds
2144 19 16 0 0 1 12 276.188 0.027013 Thiophenic compounds
2145 19 16 0 0 2 12 308.248 0.000156 Thiophenic compounds
2146 18 14 0 0 1 12 262.172 0.01971 Thiophenic compounds
2147 18 14 0 0 2 12 294.232 4.4e-05 Thiophenic compounds
2148 17 12 0 0 1 12 248.156 0.008012 Thiophenic compounds
2149 17 12 0 0 2 12 280.216 2e-05 Thiophenic compounds
2150 16 10 0 0 1 12 234.14 0.000986 Thiophenic compounds
2151 16 10 0 0 2 12 266.2 9e-06 Thiophenic compounds
2152 15 8 0 0 1 12 220.124 1.1e-05 Thiophenic compounds
2153 14 6 0 0 1 12 206.108 2.3e-05 Thiophenic compounds
2154 52 80 0 0 2 13 768.76 2.2e-05 Thiophenic compounds
2155 51 78 0 0 1 13 722.684 2e-05 Thiophenic compounds
2156 48 72 0 0 1 13 680.636 1.8e-05 Thiophenic compounds
2157 45 66 0 0 1 13 638.588 7.6e-05 Thiophenic compounds
2158 44 64 0 0 1 13 624.572 3.7e-05 Thiophenic compounds
2159 43 62 0 0 1 13 610.556 5.5e-05 Thiophenic compounds
2160 43 62 0 0 2 13 642.616 1.9e-05 Thiophenic compounds
2161 42 60 0 0 2 13 628.6 1.4e-05 Thiophenic compounds
2162 41 58 0 0 1 13 582.524 8.9e-05 Thiophenic compounds
2163 41 58 0 0 2 13 614.584 1.4e-05 Thiophenic compounds
2164 40 56 0 0 1 13 568.508 5.2e-05 Thiophenic compounds
2165 40 56 0 0 2 13 600.568 3.3e-05 Thiophenic compounds
2166 39 54 0 0 1 13 554.492 8.1e-05 Thiophenic compounds
2167 38 52 0 0 1 13 540.476 3.3e-05 Thiophenic compounds
2168 38 52 0 0 2 13 572.536 1.9e-05 Thiophenic compounds
2169 37 50 0 0 1 13 526.46 0.000139 Thiophenic compounds
2170 37 50 0 0 2 13 558.52 0.000119 Thiophenic compounds
2171 36 48 0 0 1 13 512.444 0.000149 Thiophenic compounds
2172 35 46 0 0 1 13 498.428 0.00029 Thiophenic compounds
2173 35 46 0 0 2 13 530.488 0.000423 Thiophenic compounds
2174 34 44 0 0 1 13 484.412 0.000597 Thiophenic compounds
2175 34 44 0 0 2 13 516.472 0.000167 Thiophenic compounds
2176 33 42 0 0 1 13 470.396 0.000638 Thiophenic compounds
2177 33 42 0 0 2 13 502.456 7.2e-05 Thiophenic compounds
2178 32 40 0 0 1 13 456.38 0.00039 Thiophenic compounds
2179 32 40 0 0 2 13 488.44 0.000142 Thiophenic compounds
2180 31 38 0 0 1 13 442.364 0.00068 Thiophenic compounds
2181 31 38 0 0 2 13 474.424 9.9e-05 Thiophenic compounds
2182 30 36 0 0 1 13 428.348 0.000612 Thiophenic compounds
2183 30 36 0 0 2 13 460.408 8e-05 Thiophenic compounds
2184 29 34 0 0 1 13 414.332 0.000969 Thiophenic compounds
2185 29 34 0 0 2 13 446.392 0.000162 Thiophenic compounds
2186 28 32 0 0 1 13 400.316 0.00075 Thiophenic compounds
2187 28 32 0 0 2 13 432.376 9.2e-05 Thiophenic compounds
2188 27 30 0 0 1 13 386.3 0.000944 Thiophenic compounds
2189 27 30 0 0 2 13 418.36 0.000133 Thiophenic compounds
2190 26 28 0 0 1 13 372.284 0.001284 Thiophenic compounds
2191 26 28 0 0 2 13 404.344 0.000192 Thiophenic compounds
2192 25 26 0 0 1 13 358.268 0.001736 Thiophenic compounds
2193 25 26 0 0 2 13 390.328 2e-05 Thiophenic compounds
2194 24 24 0 0 1 13 344.252 0.002326 Thiophenic compounds
2195 24 24 0 0 2 13 376.312 0.000235 Thiophenic compounds
2196 23 22 0 0 1 13 330.236 0.002722 Thiophenic compounds
2197 23 22 0 0 2 13 362.296 0.000307 Thiophenic compounds
2198 22 20 0 0 1 13 316.22 0.003397 Thiophenic compounds
2199 22 20 0 0 2 13 348.28 0.000254 Thiophenic compounds
2200 21 18 0 0 1 13 302.204 0.002525 Thiophenic compounds
2201 21 18 0 0 2 13 334.264 0.000576 Thiophenic compounds
2202 20 16 0 0 1 13 288.188 0.001219 Thiophenic compounds
2203 20 16 0 0 2 13 320.248 0.000767 Thiophenic compounds
2204 19 14 0 0 1 13 274.172 0.000435 Thiophenic compounds
2205 19 14 0 0 2 13 306.232 0.000656 Thiophenic compounds
2206 18 12 0 0 1 13 260.156 6e-05 Thiophenic compounds
2207 18 12 0 0 2 13 292.216 0.000286 Thiophenic compounds
2208 17 10 0 0 1 13 246.14 1.1e-05 Thiophenic compounds
2209 17 10 0 0 2 13 278.2 5.4e-05 Thiophenic compounds
2210 15 6 0 0 1 13 218.108 9e-06 Thiophenic compounds
2211 48 70 0 0 1 14 678.62 2.3e-05 Thiophenic compounds
2212 47 68 0 0 1 14 664.604 1.9e-05 Thiophenic compounds
2213 45 64 0 0 1 14 636.572 5.2e-05 Thiophenic compounds
2214 44 62 0 0 1 14 622.556 1.8e-05 Thiophenic compounds
2215 43 60 0 0 1 14 608.54 1.5e-05 Thiophenic compounds
2216 42 58 0 0 1 14 594.524 2.4e-05 Thiophenic compounds
2217 41 56 0 0 1 14 580.508 7.9e-05 Thiophenic compounds
2218 40 54 0 0 1 14 566.492 6e-05 Thiophenic compounds
2219 39 52 0 0 2 14 584.536 1.9e-05 Thiophenic compounds
2220 38 50 0 0 1 14 538.46 0.000173 Thiophenic compounds
2221 38 50 0 0 2 14 570.52 3.6e-05 Thiophenic compounds
2222 37 48 0 0 1 14 524.444 0.000149 Thiophenic compounds
2223 37 48 0 0 2 14 556.504 2e-05 Thiophenic compounds
2224 36 46 0 0 1 14 510.428 5.7e-05 Thiophenic compounds
2225 36 46 0 0 2 14 542.488 9.4e-05 Thiophenic compounds
2226 35 44 0 0 1 14 496.412 0.000226 Thiophenic compounds
2227 35 44 0 0 2 14 528.472 5.4e-05 Thiophenic compounds
2228 34 42 0 0 1 14 482.396 0.000184 Thiophenic compounds
2229 34 42 0 0 2 14 514.456 5.4e-05 Thiophenic compounds
2230 33 40 0 0 1 14 468.38 0.000342 Thiophenic compounds
2231 33 40 0 0 2 14 500.44 9.5e-05 Thiophenic compounds
2232 32 38 0 0 1 14 454.364 0.000614 Thiophenic compounds
2233 32 38 0 0 2 14 486.424 9.5e-05 Thiophenic compounds
2234 31 36 0 0 1 14 440.348 0.00053 Thiophenic compounds
2235 31 36 0 0 2 14 472.408 0.000125 Thiophenic compounds
2236 30 34 0 0 1 14 426.332 0.000605 Thiophenic compounds
2237 29 32 0 0 1 14 412.316 0.00094 Thiophenic compounds
2238 29 32 0 0 2 14 444.376 0.000163 Thiophenic compounds
2239 28 30 0 0 1 14 398.3 0.000892 Thiophenic compounds
2240 28 30 0 0 2 14 430.36 0.000179 Thiophenic compounds
2241 27 28 0 0 1 14 384.284 0.001626 Thiophenic compounds
2242 27 28 0 0 2 14 416.344 0.000367 Thiophenic compounds
2243 26 26 0 0 1 14 370.268 0.002115 Thiophenic compounds
2244 26 26 0 0 2 14 402.328 0.000512 Thiophenic compounds
2245 25 24 0 0 1 14 356.252 0.003203 Thiophenic compounds
2246 25 24 0 0 2 14 388.312 0.000987 Thiophenic compounds
2247 24 22 0 0 1 14 342.236 0.003506 Thiophenic compounds
2248 24 22 0 0 2 14 374.296 0.001174 Thiophenic compounds
2249 23 20 0 0 1 14 328.22 0.004601 Thiophenic compounds
2250 23 20 0 0 2 14 360.28 0.001754 Thiophenic compounds
2251 22 18 0 0 1 14 314.204 0.005197 Thiophenic compounds
2252 22 18 0 0 2 14 346.264 0.002251 Thiophenic compounds
2253 21 16 0 0 1 14 300.188 0.006443 Thiophenic compounds
2254 21 16 0 0 2 14 332.248 0.002247 Thiophenic compounds
2255 20 14 0 0 1 14 286.172 0.003505 Thiophenic compounds
2256 20 14 0 0 2 14 318.232 0.001346 Thiophenic compounds
2257 19 12 0 0 1 14 272.156 0.002548 Thiophenic compounds
2258 19 12 0 0 2 14 304.216 0.000509 Thiophenic compounds
2259 18 10 0 0 1 14 258.14 0.000579 Thiophenic compounds
2260 18 10 0 0 2 14 290.2 7.9e-05 Thiophenic compounds
2261 17 8 0 0 1 14 244.124 7e-06 Thiophenic compounds
2262 16 6 0 0 1 14 230.108 3.6e-05 Thiophenic compounds
2263 55 82 0 0 1 15 774.716 6.5e-05 Thiophenic compounds
2264 45 62 0 0 1 15 634.556 1.8e-05 Thiophenic compounds
2265 44 60 0 0 1 15 620.54 2.1e-05 Thiophenic compounds
2266 43 58 0 0 1 15 606.524 7e-05 Thiophenic compounds
2267 43 58 0 0 2 15 638.584 4.1e-05 Thiophenic compounds
2268 42 56 0 0 1 15 592.508 1.6e-05 Thiophenic compounds
2269 42 56 0 0 2 15 624.568 3.2e-05 Thiophenic compounds
2270 41 54 0 0 1 15 578.492 7.8e-05 Thiophenic compounds
2271 41 54 0 0 2 15 610.552 0.000104 Thiophenic compounds
2272 40 52 0 0 1 15 564.476 0.000243 Thiophenic compounds
2273 39 50 0 0 1 15 550.46 3.8e-05 Thiophenic compounds
2274 39 50 0 0 2 15 582.52 6.6e-05 Thiophenic compounds
2275 38 48 0 0 1 15 536.444 9.3e-05 Thiophenic compounds
2276 38 48 0 0 2 15 568.504 1.7e-05 Thiophenic compounds
2277 37 46 0 0 1 15 522.428 0.00016 Thiophenic compounds
2278 37 46 0 0 2 15 554.488 5.8e-05 Thiophenic compounds
2279 36 44 0 0 1 15 508.412 0.00013 Thiophenic compounds
2280 36 44 0 0 2 15 540.472 0.000147 Thiophenic compounds
2281 35 42 0 0 1 15 494.396 0.00026 Thiophenic compounds
2282 35 42 0 0 2 15 526.456 0.00032 Thiophenic compounds
2283 34 40 0 0 1 15 480.38 0.000197 Thiophenic compounds
2284 34 40 0 0 2 15 512.44 0.000127 Thiophenic compounds
2285 33 38 0 0 1 15 466.364 0.000338 Thiophenic compounds
2286 33 38 0 0 2 15 498.424 0.000801 Thiophenic compounds
2287 32 36 0 0 1 15 452.348 0.000333 Thiophenic compounds
2288 31 34 0 0 1 15 438.332 0.000219 Thiophenic compounds
2289 31 34 0 0 2 15 470.392 0.000124 Thiophenic compounds
2290 30 32 0 0 1 15 424.316 0.000559 Thiophenic compounds
2291 30 32 0 0 2 15 456.376 8.3e-05 Thiophenic compounds
2292 29 30 0 0 1 15 410.3 0.000813 Thiophenic compounds
2293 29 30 0 0 2 15 442.36 0.000166 Thiophenic compounds
2294 28 28 0 0 1 15 396.284 0.000976 Thiophenic compounds
2295 28 28 0 0 2 15 428.344 0.000281 Thiophenic compounds
2296 27 26 0 0 1 15 382.268 0.001173 Thiophenic compounds
2297 27 26 0 0 2 15 414.328 0.000137 Thiophenic compounds
2298 26 24 0 0 1 15 368.252 0.001062 Thiophenic compounds
2299 26 24 0 0 2 15 400.312 0.000174 Thiophenic compounds
2300 25 22 0 0 1 15 354.236 0.002269 Thiophenic compounds
2301 25 22 0 0 2 15 386.296 0.000283 Thiophenic compounds
2302 24 20 0 0 1 15 340.22 0.002123 Thiophenic compounds
2303 24 20 0 0 2 15 372.28 0.000355 Thiophenic compounds
2304 23 18 0 0 1 15 326.204 0.002047 Thiophenic compounds
2305 23 18 0 0 2 15 358.264 0.000199 Thiophenic compounds
2306 22 16 0 0 1 15 312.188 0.00117 Thiophenic compounds
2307 22 16 0 0 2 15 344.248 2.6e-05 Thiophenic compounds
2308 21 14 0 0 1 15 298.172 0.000554 Thiophenic compounds
2309 20 12 0 0 1 15 284.156 8.6e-05 Thiophenic compounds
2310 19 10 0 0 1 15 270.14 2e-05 Thiophenic compounds
2311 17 6 0 0 1 15 242.108 7e-06 Thiophenic compounds
2312 53 76 0 0 1 16 744.668 2.1e-05 Thiophenic compounds
2313 52 74 0 0 1 16 730.652 2.2e-05 Thiophenic compounds
2314 47 64 0 0 1 16 660.572 6.8e-05 Thiophenic compounds
2315 46 62 0 0 1 16 646.556 3.5e-05 Thiophenic compounds
2316 44 58 0 0 1 16 618.524 2.7e-05 Thiophenic compounds
2317 43 56 0 0 1 16 604.508 3.6e-05 Thiophenic compounds
2318 43 56 0 0 2 16 636.568 2.1e-05 Thiophenic compounds
2319 42 54 0 0 1 16 590.492 9.5e-05 Thiophenic compounds
2320 42 54 0 0 2 16 622.552 5.2e-05 Thiophenic compounds
2321 41 52 0 0 1 16 576.476 1.3e-05 Thiophenic compounds
2322 40 50 0 0 1 16 562.46 0.000111 Thiophenic compounds
2323 39 48 0 0 1 16 548.444 7.3e-05 Thiophenic compounds
2324 38 46 0 0 2 16 566.488 3.2e-05 Thiophenic compounds
2325 37 44 0 0 1 16 520.412 9.9e-05 Thiophenic compounds
2326 37 44 0 0 2 16 552.472 6.5e-05 Thiophenic compounds
2327 36 42 0 0 1 16 506.396 0.000139 Thiophenic compounds
2328 36 42 0 0 2 16 538.456 6.4e-05 Thiophenic compounds
2329 35 40 0 0 1 16 492.38 0.000151 Thiophenic compounds
2330 35 40 0 0 2 16 524.44 0.000211 Thiophenic compounds
2331 34 38 0 0 1 16 478.364 0.000117 Thiophenic compounds
2332 34 38 0 0 2 16 510.424 0.000183 Thiophenic compounds
2333 33 36 0 0 1 16 464.348 0.000282 Thiophenic compounds
2334 33 36 0 0 2 16 496.408 8.1e-05 Thiophenic compounds
2335 32 34 0 0 1 16 450.332 0.000486 Thiophenic compounds
2336 32 34 0 0 2 16 482.392 1.8e-05 Thiophenic compounds
2337 31 32 0 0 1 16 436.316 0.00028 Thiophenic compounds
2338 31 32 0 0 2 16 468.376 4.6e-05 Thiophenic compounds
2339 30 30 0 0 1 16 422.3 0.000557 Thiophenic compounds
2340 29 28 0 0 1 16 408.284 0.0007 Thiophenic compounds
2341 29 28 0 0 2 16 440.344 0.000103 Thiophenic compounds
2342 28 26 0 0 1 16 394.268 0.000544 Thiophenic compounds
2343 28 26 0 0 2 16 426.328 0.000228 Thiophenic compounds
2344 27 24 0 0 1 16 380.252 0.000828 Thiophenic compounds
2345 27 24 0 0 2 16 412.312 0.000159 Thiophenic compounds
2346 26 22 0 0 1 16 366.236 0.000618 Thiophenic compounds
2347 26 22 0 0 2 16 398.296 0.000219 Thiophenic compounds
2348 25 20 0 0 1 16 352.22 0.000699 Thiophenic compounds
2349 25 20 0 0 2 16 384.28 0.000427 Thiophenic compounds
2350 24 18 0 0 1 16 338.204 0.000611 Thiophenic compounds
2351 24 18 0 0 2 16 370.264 0.00032 Thiophenic compounds
2352 23 16 0 0 1 16 324.188 0.000479 Thiophenic compounds
2353 23 16 0 0 2 16 356.248 0.000654 Thiophenic compounds
2354 22 14 0 0 1 16 310.172 0.000322 Thiophenic compounds
2355 22 14 0 0 2 16 342.232 0.000247 Thiophenic compounds
2356 21 12 0 0 1 16 296.156 4.9e-05 Thiophenic compounds
2357 21 12 0 0 2 16 328.216 9.1e-05 Thiophenic compounds
2358 20 10 0 0 1 16 282.14 9e-06 Thiophenic compounds
2359 19 8 0 0 1 16 268.124 9e-06 Thiophenic compounds
2360 19 8 0 0 2 16 300.184 1.9e-05 Thiophenic compounds
2361 18 6 0 0 1 16 254.108 4.2e-05 Thiophenic compounds
2362 45 58 0 0 1 17 630.524 1.7e-05 Thiophenic compounds
2363 43 54 0 0 1 17 602.492 2.5e-05 Thiophenic compounds
2364 42 52 0 0 1 17 588.476 0.000218 Thiophenic compounds
2365 41 50 0 0 1 17 574.46 0.000163 Thiophenic compounds
2366 40 48 0 0 2 17 592.504 1.3e-05 Thiophenic compounds
2367 38 44 0 0 2 17 564.472 2e-05 Thiophenic compounds
2368 37 42 0 0 1 17 518.396 6.2e-05 Thiophenic compounds
2369 37 42 0 0 2 17 550.456 2.6e-05 Thiophenic compounds
2370 36 40 0 0 1 17 504.38 0.000141 Thiophenic compounds
2371 35 38 0 0 1 17 490.364 9.2e-05 Thiophenic compounds
2372 34 36 0 0 1 17 476.348 0.000117 Thiophenic compounds
2373 33 34 0 0 1 17 462.332 0.000365 Thiophenic compounds
2374 33 34 0 0 2 17 494.392 0.000251 Thiophenic compounds
2375 32 32 0 0 1 17 448.316 0.000885 Thiophenic compounds
2376 32 32 0 0 2 17 480.376 0.000268 Thiophenic compounds
2377 31 30 0 0 1 17 434.3 0.000101 Thiophenic compounds
2378 31 30 0 0 2 17 466.36 6.6e-05 Thiophenic compounds
2379 30 28 0 0 1 17 420.284 0.000225 Thiophenic compounds
2380 30 28 0 0 2 17 452.344 0.000141 Thiophenic compounds
2381 29 26 0 0 1 17 406.268 0.000152 Thiophenic compounds
2382 29 26 0 0 2 17 438.328 0.000127 Thiophenic compounds
2383 28 24 0 0 1 17 392.252 0.000244 Thiophenic compounds
2384 28 24 0 0 2 17 424.312 0.000219 Thiophenic compounds
2385 27 22 0 0 1 17 378.236 0.000365 Thiophenic compounds
2386 27 22 0 0 2 17 410.296 0.000131 Thiophenic compounds
2387 26 20 0 0 1 17 364.22 0.00027 Thiophenic compounds
2388 25 18 0 0 1 17 350.204 0.000372 Thiophenic compounds
2389 25 18 0 0 2 17 382.264 2e-05 Thiophenic compounds
2390 24 16 0 0 1 17 336.188 9.6e-05 Thiophenic compounds
2391 24 16 0 0 2 17 368.248 2.5e-05 Thiophenic compounds
2392 23 14 0 0 1 17 322.172 0.000198 Thiophenic compounds
2393 23 14 0 0 2 17 354.232 1.6e-05 Thiophenic compounds
2394 22 12 0 0 1 17 308.156 6e-06 Thiophenic compounds
2395 20 8 0 0 1 17 280.124 2.1e-05 Thiophenic compounds
2396 50 66 0 0 1 18 698.588 1.9e-05 Thiophenic compounds
2397 46 58 0 0 1 18 642.524 1.9e-05 Thiophenic compounds
2398 44 54 0 0 1 18 614.492 1.4e-05 Thiophenic compounds
2399 43 52 0 0 1 18 600.476 3.3e-05 Thiophenic compounds
2400 42 50 0 0 1 18 586.46 5.2e-05 Thiophenic compounds
2401 38 42 0 0 2 18 562.456 6.1e-05 Thiophenic compounds
2402 37 40 0 0 2 18 548.44 2.7e-05 Thiophenic compounds
2403 36 38 0 0 1 18 502.364 6.1e-05 Thiophenic compounds
2404 36 38 0 0 2 18 534.424 4e-05 Thiophenic compounds
2405 35 36 0 0 2 18 520.408 0.000122 Thiophenic compounds
2406 33 32 0 0 1 18 460.316 0.000147 Thiophenic compounds
2407 33 32 0 0 2 18 492.376 3.5e-05 Thiophenic compounds
2408 32 30 0 0 1 18 446.3 5.9e-05 Thiophenic compounds
2409 31 28 0 0 1 18 432.284 1.6e-05 Thiophenic compounds
2410 31 28 0 0 2 18 464.344 4.5e-05 Thiophenic compounds
2411 30 26 0 0 1 18 418.268 5e-05 Thiophenic compounds
2412 30 26 0 0 2 18 450.328 3e-05 Thiophenic compounds
2413 29 24 0 0 1 18 404.252 1.1e-05 Thiophenic compounds
2414 29 24 0 0 2 18 436.312 9e-05 Thiophenic compounds
2415 28 22 0 0 1 18 390.236 5.1e-05 Thiophenic compounds
2416 25 16 0 0 1 18 348.188 8e-06 Thiophenic compounds
2417 53 70 0 0 1 19 738.62 2.1e-05 Thiophenic compounds
2418 50 64 0 0 1 19 696.572 1.7e-05 Thiophenic compounds
2419 42 48 0 0 1 19 584.444 2.9e-05 Thiophenic compounds
2420 42 48 0 0 2 19 616.504 2.2e-05 Thiophenic compounds
2421 41 46 0 0 1 19 570.428 7.7e-05 Thiophenic compounds
2422 41 46 0 0 2 19 602.488 1.3e-05 Thiophenic compounds
2423 40 44 0 0 2 19 588.472 2.1e-05 Thiophenic compounds
2424 36 36 0 0 1 19 500.348 1.4e-05 Thiophenic compounds
2425 35 34 0 0 1 19 486.332 5e-05 Thiophenic compounds
2426 34 32 0 0 1 19 472.316 3.4e-05 Thiophenic compounds
2427 34 32 0 0 2 19 504.376 6.6e-05 Thiophenic compounds
2428 33 30 0 0 1 19 458.3 1e-05 Thiophenic compounds
2429 33 30 0 0 2 19 490.36 3.4e-05 Thiophenic compounds
2430 51 64 0 0 1 20 708.572 2e-05 Thiophenic compounds
2431 47 56 0 0 1 20 652.508 2.4e-05 Thiophenic compounds
2432 46 54 0 0 1 20 638.492 4.1e-05 Thiophenic compounds
2433 42 46 0 0 1 20 582.428 2.1e-05 Thiophenic compounds
2434 38 38 0 0 1 20 526.364 2.4e-05 Thiophenic compounds
2435 28 18 0 0 1 20 386.204 8e-06 Thiophenic compounds
2436 26 14 0 0 1 20 358.172 1e-05 Thiophenic compounds
2437 25 12 0 0 1 20 344.156 1.2e-05 Thiophenic compounds
2438 24 10 0 0 1 20 330.14 7e-06 Thiophenic compounds
2439 37 74 0 0 1 1 550.652 1e-05 Sulfidic compounds
2440 36 72 0 0 1 1 536.636 6.3e-05 Sulfidic compounds
2441 35 70 0 0 1 1 522.62 0.000186 Sulfidic compounds
2442 34 68 0 0 1 1 508.604 0.000255 Sulfidic compounds
2443 33 66 0 0 1 1 494.588 0.000402 Sulfidic compounds
2444 32 64 0 0 1 1 480.572 0.000373 Sulfidic compounds
2445 31 62 0 0 1 1 466.556 0.001189 Sulfidic compounds
2446 30 60 0 0 1 1 452.54 0.004115 Sulfidic compounds
2447 29 58 0 0 1 1 438.524 0.003635 Sulfidic compounds
2448 28 56 0 0 1 1 424.508 0.004938 Sulfidic compounds
2449 27 54 0 0 1 1 410.492 0.005965 Sulfidic compounds
2450 26 52 0 0 1 1 396.476 0.009971 Sulfidic compounds
2451 25 50 0 0 1 1 382.46 0.03344 Sulfidic compounds
2452 24 48 0 0 1 1 368.444 0.017331 Sulfidic compounds
2453 23 46 0 0 1 1 354.428 0.018491 Sulfidic compounds
2454 22 44 0 0 1 1 340.412 0.021192 Sulfidic compounds
2455 21 42 0 0 1 1 326.396 0.025048 Sulfidic compounds
2456 20 40 0 0 1 1 312.38 0.051872 Sulfidic compounds
2457 19 38 0 0 1 1 298.364 0.034784 Sulfidic compounds
2458 18 36 0 0 1 1 284.348 0.036707 Sulfidic compounds
2459 17 34 0 0 1 1 270.332 0.016101 Sulfidic compounds
2460 16 32 0 0 1 1 256.316 0.009057 Sulfidic compounds
2461 15 30 0 0 1 1 242.3 0.004033 Sulfidic compounds
2462 14 28 0 0 1 1 228.284 0.000614 Sulfidic compounds
2463 13 26 0 0 1 1 214.268 7.1e-05 Sulfidic compounds
2464 11 22 0 0 1 1 186.236 1e-06 Sulfidic compounds
2465 38 74 0 0 1 2 562.652 5e-06 Sulfidic compounds
2466 37 72 0 0 1 2 548.636 1.5e-05 Sulfidic compounds
2467 36 70 0 0 1 2 534.62 3.5e-05 Sulfidic compounds
2468 35 68 0 0 1 2 520.604 0.000143 Sulfidic compounds
2469 34 66 0 0 1 2 506.588 0.000253 Sulfidic compounds
2470 33 64 0 0 1 2 492.572 0.000406 Sulfidic compounds
2471 32 62 0 0 1 2 478.556 0.00064 Sulfidic compounds
2472 31 60 0 0 1 2 464.54 0.002217 Sulfidic compounds
2473 30 58 0 0 1 2 450.524 0.00434 Sulfidic compounds
2474 29 56 0 0 1 2 436.508 0.005343 Sulfidic compounds
2475 28 54 0 0 1 2 422.492 0.005704 Sulfidic compounds
2476 27 52 0 0 1 2 408.476 0.010386 Sulfidic compounds
2477 26 50 0 0 1 2 394.46 0.012616 Sulfidic compounds
2478 25 48 0 0 1 2 380.444 0.01756 Sulfidic compounds
2479 24 46 0 0 1 2 366.428 0.018962 Sulfidic compounds
2480 23 44 0 0 1 2 352.412 0.014182 Sulfidic compounds
2481 22 42 0 0 1 2 338.396 0.019794 Sulfidic compounds
2482 21 40 0 0 1 2 324.38 0.022147 Sulfidic compounds
2483 20 38 0 0 1 2 310.364 0.024637 Sulfidic compounds
2484 19 36 0 0 1 2 296.348 0.023895 Sulfidic compounds
2485 18 34 0 0 1 2 282.332 0.020585 Sulfidic compounds
2486 17 32 0 0 1 2 268.316 0.008451 Sulfidic compounds
2487 16 30 0 0 1 2 254.3 0.005114 Sulfidic compounds
2488 15 28 0 0 1 2 240.284 0.002233 Sulfidic compounds
2489 14 26 0 0 1 2 226.268 0.000422 Sulfidic compounds
2490 13 24 0 0 1 2 212.252 0.0001 Sulfidic compounds
2491 12 22 0 0 1 2 198.236 4e-06 Sulfidic compounds
2492 11 20 0 0 1 2 184.22 4e-06 Sulfidic compounds
2493 10 18 0 0 1 2 170.204 2e-06 Sulfidic compounds
2494 38 72 0 0 1 3 560.636 2e-06 Sulfidic compounds
2495 37 70 0 0 1 3 546.62 1.5e-05 Sulfidic compounds
2496 36 68 0 0 1 3 532.604 3.4e-05 Sulfidic compounds
2497 35 66 0 0 1 3 518.588 0.000144 Sulfidic compounds
2498 34 64 0 0 1 3 504.572 0.000205 Sulfidic compounds
2499 33 62 0 0 1 3 490.556 0.000521 Sulfidic compounds
2500 32 60 0 0 1 3 476.54 0.000709 Sulfidic compounds
2501 31 58 0 0 1 3 462.524 0.002176 Sulfidic compounds
2502 30 56 0 0 1 3 448.508 0.003944 Sulfidic compounds
2503 29 54 0 0 1 3 434.492 0.005055 Sulfidic compounds
2504 28 52 0 0 1 3 420.476 0.004814 Sulfidic compounds
2505 27 50 0 0 1 3 406.46 0.009601 Sulfidic compounds
2506 26 48 0 0 1 3 392.444 0.012629 Sulfidic compounds
2507 25 46 0 0 1 3 378.428 0.015275 Sulfidic compounds
2508 24 44 0 0 1 3 364.412 0.017771 Sulfidic compounds
2509 23 42 0 0 1 3 350.396 0.013242 Sulfidic compounds
2510 22 40 0 0 1 3 336.38 0.020654 Sulfidic compounds
2511 21 38 0 0 1 3 322.364 0.022574 Sulfidic compounds
2512 20 36 0 0 1 3 308.348 0.022427 Sulfidic compounds
2513 19 34 0 0 1 3 294.332 0.019527 Sulfidic compounds
2514 18 32 0 0 1 3 280.316 0.016053 Sulfidic compounds
2515 17 30 0 0 1 3 266.3 0.006867 Sulfidic compounds
2516 16 28 0 0 1 3 252.284 0.005925 Sulfidic compounds
2517 15 26 0 0 1 3 238.268 0.001851 Sulfidic compounds
2518 14 24 0 0 1 3 224.252 0.000294 Sulfidic compounds
2519 13 22 0 0 1 3 210.236 5.9e-05 Sulfidic compounds
2520 12 20 0 0 1 3 196.22 6e-06 Sulfidic compounds
2521 11 18 0 0 1 3 182.204 2e-06 Sulfidic compounds
2522 40 74 0 0 1 4 586.652 2e-06 Sulfidic compounds
2523 39 72 0 0 1 4 572.636 6e-06 Sulfidic compounds
2524 38 70 0 0 1 4 558.62 5e-06 Sulfidic compounds
2525 37 68 0 0 1 4 544.604 3e-06 Sulfidic compounds
2526 36 66 0 0 1 4 530.588 3.2e-05 Sulfidic compounds
2527 35 64 0 0 1 4 516.572 0.00014 Sulfidic compounds
2528 34 62 0 0 1 4 502.556 0.000185 Sulfidic compounds
2529 33 60 0 0 1 4 488.54 0.000388 Sulfidic compounds
2530 32 58 0 0 1 4 474.524 0.00061 Sulfidic compounds
2531 31 56 0 0 1 4 460.508 0.001674 Sulfidic compounds
2532 30 54 0 0 1 4 446.492 0.002801 Sulfidic compounds
2533 29 52 0 0 1 4 432.476 0.003999 Sulfidic compounds
2534 28 50 0 0 1 4 418.46 0.004678 Sulfidic compounds
2535 27 48 0 0 1 4 404.444 0.008024 Sulfidic compounds
2536 26 46 0 0 1 4 390.428 0.009538 Sulfidic compounds
2537 25 44 0 0 1 4 376.412 0.00996 Sulfidic compounds
2538 24 42 0 0 1 4 362.396 0.011928 Sulfidic compounds
2539 23 40 0 0 1 4 348.38 0.011582 Sulfidic compounds
2540 22 38 0 0 1 4 334.364 0.013052 Sulfidic compounds
2541 21 36 0 0 1 4 320.348 0.013614 Sulfidic compounds
2542 20 34 0 0 1 4 306.332 0.013161 Sulfidic compounds
2543 19 32 0 0 1 4 292.316 0.010769 Sulfidic compounds
2544 18 30 0 0 1 4 278.3 0.008813 Sulfidic compounds
2545 17 28 0 0 1 4 264.284 0.004122 Sulfidic compounds
2546 16 26 0 0 1 4 250.268 0.002062 Sulfidic compounds
2547 15 24 0 0 1 4 236.252 0.000597 Sulfidic compounds
2548 14 22 0 0 1 4 222.236 9.4e-05 Sulfidic compounds
2549 13 20 0 0 1 4 208.22 1.1e-05 Sulfidic compounds
2550 12 18 0 0 1 4 194.204 1e-06 Sulfidic compounds
2551 11 16 0 0 1 4 180.188 1e-06 Sulfidic compounds
2552 40 72 0 0 1 5 584.636 6e-06 Sulfidic compounds
2553 39 70 0 0 1 5 570.62 4e-06 Sulfidic compounds
2554 37 66 0 0 1 5 542.588 4e-06 Sulfidic compounds
2555 36 64 0 0 1 5 528.572 2.4e-05 Sulfidic compounds
2556 35 62 0 0 1 5 514.556 4.9e-05 Sulfidic compounds
2557 34 60 0 0 1 5 500.54 0.000105 Sulfidic compounds
2558 33 58 0 0 1 5 486.524 0.000212 Sulfidic compounds
2559 32 56 0 0 1 5 472.508 0.000315 Sulfidic compounds
2560 31 54 0 0 1 5 458.492 0.000963 Sulfidic compounds
2561 30 52 0 0 1 5 444.476 0.002171 Sulfidic compounds
2562 29 50 0 0 1 5 430.46 0.003747 Sulfidic compounds
2563 28 48 0 0 1 5 416.444 0.004026 Sulfidic compounds
2564 27 46 0 0 1 5 402.428 0.005261 Sulfidic compounds
2565 26 44 0 0 1 5 388.412 0.005733 Sulfidic compounds
2566 25 42 0 0 1 5 374.396 0.006811 Sulfidic compounds
2567 24 40 0 0 1 5 360.38 0.007765 Sulfidic compounds
2568 23 38 0 0 1 5 346.364 0.007649 Sulfidic compounds
2569 22 36 0 0 1 5 332.348 0.009316 Sulfidic compounds
2570 21 34 0 0 1 5 318.332 0.009482 Sulfidic compounds
2571 20 32 0 0 1 5 304.316 0.009125 Sulfidic compounds
2572 19 30 0 0 1 5 290.3 0.007656 Sulfidic compounds
2573 18 28 0 0 1 5 276.284 0.005762 Sulfidic compounds
2574 17 26 0 0 1 5 262.268 0.002694 Sulfidic compounds
2575 16 24 0 0 1 5 248.252 0.001124 Sulfidic compounds
2576 15 22 0 0 1 5 234.236 0.000384 Sulfidic compounds
2577 14 20 0 0 1 5 220.22 9.5e-05 Sulfidic compounds
2578 13 18 0 0 1 5 206.204 9e-06 Sulfidic compounds
2579 35 60 0 0 1 6 512.54 1e-05 Sulfidic compounds
2580 34 58 0 0 1 6 498.524 4.1e-05 Sulfidic compounds
2581 33 56 0 0 1 6 484.508 0.000129 Sulfidic compounds
2582 32 54 0 0 1 6 470.492 0.000189 Sulfidic compounds
2583 31 52 0 0 1 6 456.476 0.000458 Sulfidic compounds
2584 30 50 0 0 1 6 442.46 0.000687 Sulfidic compounds
2585 29 48 0 0 1 6 428.444 0.001137 Sulfidic compounds
2586 28 46 0 0 1 6 414.428 0.001209 Sulfidic compounds
2587 27 44 0 0 1 6 400.412 0.002468 Sulfidic compounds
2588 26 42 0 0 1 6 386.396 0.002809 Sulfidic compounds
2589 25 40 0 0 1 6 372.38 0.00344 Sulfidic compounds
2590 24 38 0 0 1 6 358.364 0.00485 Sulfidic compounds
2591 23 36 0 0 1 6 344.348 0.00418 Sulfidic compounds
2592 22 34 0 0 1 6 330.332 0.006584 Sulfidic compounds
2593 21 32 0 0 1 6 316.316 0.005062 Sulfidic compounds
2594 20 30 0 0 1 6 302.3 0.004289 Sulfidic compounds
2595 19 28 0 0 1 6 288.284 0.003624 Sulfidic compounds
2596 18 26 0 0 1 6 274.268 0.003033 Sulfidic compounds
2597 17 24 0 0 1 6 260.252 0.001885 Sulfidic compounds
2598 16 22 0 0 1 6 246.236 0.000967 Sulfidic compounds
2599 15 20 0 0 1 6 232.22 0.000272 Sulfidic compounds
2600 14 18 0 0 1 6 218.204 5.4e-05 Sulfidic compounds
2601 13 16 0 0 1 6 204.188 1e-06 Sulfidic compounds
2602 38 64 0 0 1 7 552.572 2e-06 Sulfidic compounds
2603 35 58 0 0 1 7 510.524 2.2e-05 Sulfidic compounds
2604 34 56 0 0 1 7 496.508 1.1e-05 Sulfidic compounds
2605 33 54 0 0 1 7 482.492 5.2e-05 Sulfidic compounds
2606 32 52 0 0 1 7 468.476 9.3e-05 Sulfidic compounds
2607 31 50 0 0 1 7 454.46 0.000211 Sulfidic compounds
2608 30 48 0 0 1 7 440.444 0.000307 Sulfidic compounds
2609 29 46 0 0 1 7 426.428 0.000476 Sulfidic compounds
2610 28 44 0 0 1 7 412.412 0.000577 Sulfidic compounds
2611 27 42 0 0 1 7 398.396 0.000974 Sulfidic compounds
2612 26 40 0 0 1 7 384.38 0.001174 Sulfidic compounds
2613 25 38 0 0 1 7 370.364 0.001516 Sulfidic compounds
2614 24 36 0 0 1 7 356.348 0.001864 Sulfidic compounds
2615 23 34 0 0 1 7 342.332 0.002124 Sulfidic compounds
2616 22 32 0 0 1 7 328.316 0.002788 Sulfidic compounds
2617 21 30 0 0 1 7 314.3 0.003378 Sulfidic compounds
2618 20 28 0 0 1 7 300.284 0.003623 Sulfidic compounds
2619 19 26 0 0 1 7 286.268 0.002013 Sulfidic compounds
2620 18 24 0 0 1 7 272.252 0.001257 Sulfidic compounds
2621 17 22 0 0 1 7 258.236 0.00053 Sulfidic compounds
2622 16 20 0 0 1 7 244.22 0.000122 Sulfidic compounds
2623 15 18 0 0 1 7 230.204 2.2e-05 Sulfidic compounds
2624 14 16 0 0 1 7 216.188 1e-06 Sulfidic compounds
2625 13 14 0 0 1 7 202.172 4e-06 Sulfidic compounds
2626 38 62 0 0 1 8 550.556 2e-06 Sulfidic compounds
2627 35 56 0 0 1 8 508.508 2e-06 Sulfidic compounds
2628 34 54 0 0 1 8 494.492 1e-05 Sulfidic compounds
2629 33 52 0 0 1 8 480.476 2.6e-05 Sulfidic compounds
2630 32 50 0 0 1 8 466.46 6.8e-05 Sulfidic compounds
2631 31 48 0 0 1 8 452.444 9.2e-05 Sulfidic compounds
2632 30 46 0 0 1 8 438.428 0.000148 Sulfidic compounds
2633 29 44 0 0 1 8 424.412 0.000241 Sulfidic compounds
2634 28 42 0 0 1 8 410.396 0.000267 Sulfidic compounds
2635 27 40 0 0 1 8 396.38 0.000465 Sulfidic compounds
2636 26 38 0 0 1 8 382.364 0.000559 Sulfidic compounds
2637 25 36 0 0 1 8 368.348 0.000667 Sulfidic compounds
2638 24 34 0 0 1 8 354.332 0.000837 Sulfidic compounds
2639 23 32 0 0 1 8 340.316 0.000953 Sulfidic compounds
2640 22 30 0 0 1 8 326.3 0.001056 Sulfidic compounds
2641 21 28 0 0 1 8 312.284 0.000809 Sulfidic compounds
2642 20 26 0 0 1 8 298.268 0.00065 Sulfidic compounds
2643 19 24 0 0 1 8 284.252 0.000332 Sulfidic compounds
2644 18 22 0 0 1 8 270.236 0.000153 Sulfidic compounds
2645 17 20 0 0 1 8 256.22 6.4e-05 Sulfidic compounds
2646 16 18 0 0 1 8 242.204 9e-06 Sulfidic compounds
2647 15 16 0 0 1 8 228.188 2.6e-05 Sulfidic compounds
2648 14 14 0 0 1 8 214.172 3e-06 Sulfidic compounds
2649 13 12 0 0 1 8 200.156 2e-06 Sulfidic compounds
2650 36 56 0 0 1 9 520.508 3e-06 Sulfidic compounds
2651 34 52 0 0 1 9 492.476 2e-06 Sulfidic compounds
2652 33 50 0 0 1 9 478.46 1.3e-05 Sulfidic compounds
2653 32 48 0 0 1 9 464.444 2.1e-05 Sulfidic compounds
2654 31 46 0 0 1 9 450.428 2.9e-05 Sulfidic compounds
2655 30 44 0 0 1 9 436.412 7.8e-05 Sulfidic compounds
2656 29 42 0 0 1 9 422.396 0.000109 Sulfidic compounds
2657 28 40 0 0 1 9 408.38 0.000109 Sulfidic compounds
2658 27 38 0 0 1 9 394.364 0.00021 Sulfidic compounds
2659 26 36 0 0 1 9 380.348 0.000217 Sulfidic compounds
2660 25 34 0 0 1 9 366.332 0.000243 Sulfidic compounds
2661 24 32 0 0 1 9 352.316 0.000228 Sulfidic compounds
2662 23 30 0 0 1 9 338.3 0.000245 Sulfidic compounds
2663 22 28 0 0 1 9 324.284 0.000221 Sulfidic compounds
2664 21 26 0 0 1 9 310.268 0.000165 Sulfidic compounds
2665 20 24 0 0 1 9 296.252 0.000122 Sulfidic compounds
2666 19 22 0 0 1 9 282.236 5.4e-05 Sulfidic compounds
2667 18 20 0 0 1 9 268.22 6.1e-05 Sulfidic compounds
2668 17 18 0 0 1 9 254.204 9.8e-05 Sulfidic compounds
2669 16 16 0 0 1 9 240.188 5.2e-05 Sulfidic compounds
2670 15 14 0 0 1 9 226.172 4.1e-05 Sulfidic compounds
2671 14 12 0 0 1 9 212.156 2.2e-05 Sulfidic compounds
2672 13 10 0 0 1 9 198.14 3e-06 Sulfidic compounds
2673 35 52 0 0 1 10 504.476 3e-06 Sulfidic compounds
2674 32 46 0 0 1 10 462.428 2e-06 Sulfidic compounds
2675 31 44 0 0 1 10 448.412 1.5e-05 Sulfidic compounds
2676 30 42 0 0 1 10 434.396 1.1e-05 Sulfidic compounds
2677 29 40 0 0 1 10 420.38 5.7e-05 Sulfidic compounds
2678 28 38 0 0 1 10 406.364 7.2e-05 Sulfidic compounds
2679 27 36 0 0 1 10 392.348 5.5e-05 Sulfidic compounds
2680 26 34 0 0 1 10 378.332 7e-05 Sulfidic compounds
2681 25 32 0 0 1 10 364.316 6.5e-05 Sulfidic compounds
2682 24 30 0 0 1 10 350.3 6.6e-05 Sulfidic compounds
2683 23 28 0 0 1 10 336.284 8.1e-05 Sulfidic compounds
2684 22 26 0 0 1 10 322.268 7.6e-05 Sulfidic compounds
2685 21 24 0 0 1 10 308.252 4.6e-05 Sulfidic compounds
2686 20 22 0 0 1 10 294.236 3.5e-05 Sulfidic compounds
2687 19 20 0 0 1 10 280.22 5.5e-05 Sulfidic compounds
2688 18 18 0 0 1 10 266.204 2.7e-05 Sulfidic compounds
2689 17 16 0 0 1 10 252.188 0.000109 Sulfidic compounds
2690 16 14 0 0 1 10 238.172 5.4e-05 Sulfidic compounds
2691 15 12 0 0 1 10 224.156 3.6e-05 Sulfidic compounds
2692 14 10 0 0 1 10 210.14 2.6e-05 Sulfidic compounds
2693 31 42 0 0 1 11 446.396 5e-06 Sulfidic compounds
2694 30 40 0 0 1 11 432.38 3e-06 Sulfidic compounds
2695 29 38 0 0 1 11 418.364 9e-06 Sulfidic compounds
2696 28 36 0 0 1 11 404.348 1e-05 Sulfidic compounds
2697 27 34 0 0 1 11 390.332 5e-06 Sulfidic compounds
2698 26 32 0 0 1 11 376.316 1.1e-05 Sulfidic compounds
2699 25 30 0 0 1 11 362.3 1.7e-05 Sulfidic compounds
2700 24 28 0 0 1 11 348.284 7e-06 Sulfidic compounds
2701 23 26 0 0 1 11 334.268 3e-06 Sulfidic compounds
2702 22 24 0 0 1 11 320.252 1.3e-05 Sulfidic compounds
2703 21 22 0 0 1 11 306.236 1.6e-05 Sulfidic compounds
2704 20 20 0 0 1 11 292.22 2.3e-05 Sulfidic compounds
2705 19 18 0 0 1 11 278.204 1.9e-05 Sulfidic compounds
2706 18 16 0 0 1 11 264.188 2.1e-05 Sulfidic compounds
2707 17 14 0 0 1 11 250.172 2.9e-05 Sulfidic compounds