vgo_37_formula

id
C
H
O
N
S
DBE
molecular_weight
mass fraction_wtpct
compound type
1 16 34 0 0 0 0 226.272 0.783552 Saturates
2 17 36 0 0 0 0 240.288 2.88936 Saturates
3 18 38 0 0 0 0 254.304 5.43843 Saturates
4 19 40 0 0 0 0 268.32 6.46802 Saturates
5 20 42 0 0 0 0 282.336 4.00155 Saturates
6 21 44 0 0 0 0 296.352 2.39071 Saturates
7 22 46 0 0 0 0 310.368 2.65294 Saturates
8 23 48 0 0 0 0 324.384 3.33739 Saturates
9 24 50 0 0 0 0 338.4 4.33119 Saturates
10 25 52 0 0 0 0 352.416 3.23622 Saturates
11 26 54 0 0 0 0 366.432 3.89534 Saturates
12 27 56 0 0 0 0 380.448 3.38814 Saturates
13 28 58 0 0 0 0 394.464 2.82894 Saturates
14 29 60 0 0 0 0 408.48 1.76447 Saturates
15 30 62 0 0 0 0 422.496 1.31273 Saturates
16 31 64 0 0 0 0 436.512 1.28074 Saturates
17 32 66 0 0 0 0 450.528 1.32186 Saturates
18 33 68 0 0 0 0 464.544 1.16114 Saturates
19 34 70 0 0 0 0 478.56 1.19617 Saturates
20 35 72 0 0 0 0 492.576 1.27045 Saturates
21 36 74 0 0 0 0 506.592 1.42875 Saturates
22 16 32 0 0 0 1 224.256 0.192852 Saturates
23 17 34 0 0 0 1 238.272 0.624762 Saturates
24 18 36 0 0 0 1 252.288 0.945315 Saturates
25 19 38 0 0 0 1 266.304 0.992296 Saturates
26 20 40 0 0 0 1 280.32 0.823412 Saturates
27 21 42 0 0 0 1 294.336 0.378784 Saturates
28 22 44 0 0 0 1 308.352 0.320355 Saturates
29 23 46 0 0 0 1 322.368 0.426333 Saturates
30 24 48 0 0 0 1 336.384 0.478018 Saturates
31 25 50 0 0 0 1 350.4 0.450817 Saturates
32 26 52 0 0 0 1 364.416 0.502579 Saturates
33 27 54 0 0 0 1 378.432 0.328963 Saturates
34 28 56 0 0 0 1 392.448 0.341147 Saturates
35 29 58 0 0 0 1 406.464 0.363876 Saturates
36 17 32 0 0 0 2 236.256 1.1183 Saturates
37 18 34 0 0 0 2 250.272 1.56777 Saturates
38 19 36 0 0 0 2 264.288 1.55129 Saturates
39 20 38 0 0 0 2 278.304 1.11129 Saturates
40 21 40 0 0 0 2 292.32 1.16726 Saturates
41 22 42 0 0 0 2 306.336 0.430733 Saturates
42 18 32 0 0 0 3 248.256 1.19659 Saturates
43 19 34 0 0 0 3 262.272 0.758287 Saturates
44 15 24 0 0 0 4 204.192 0.294398 Aromatics
45 16 26 0 0 0 4 218.208 0.841477 Aromatics
46 17 28 0 0 0 4 232.224 1.34585 Aromatics
47 18 30 0 0 0 4 246.24 1.50012 Aromatics
48 19 32 0 0 0 4 260.256 1.01061 Aromatics
49 20 34 0 0 0 4 274.272 0.49606 Aromatics
50 21 36 0 0 0 4 288.288 0.21153 Aromatics
51 22 38 0 0 0 4 302.304 0.284697 Aromatics
52 23 40 0 0 0 4 316.32 0.207635 Aromatics
53 24 42 0 0 0 4 330.336 0.271039 Aromatics
54 25 44 0 0 0 4 344.352 0.282539 Aromatics
55 26 46 0 0 0 4 358.368 0.262068 Aromatics
56 15 22 0 0 0 5 202.176 0.257915 Aromatics
57 16 24 0 0 0 5 216.192 0.946018 Aromatics
58 17 26 0 0 0 5 230.208 1.82665 Aromatics
59 18 28 0 0 0 5 244.224 1.54411 Aromatics
60 19 30 0 0 0 5 258.24 0.820886 Aromatics
61 20 32 0 0 0 5 272.256 0.370008 Aromatics
62 21 34 0 0 0 5 286.272 0.183773 Aromatics
63 15 20 0 0 0 6 200.16 0.194834 Aromatics
64 16 22 0 0 0 6 214.176 0.40538 Aromatics
65 17 24 0 0 0 6 228.192 0.602165 Aromatics
66 18 26 0 0 0 6 242.208 0.899777 Aromatics
67 19 28 0 0 0 6 256.224 0.521386 Aromatics
68 20 30 0 0 0 6 270.24 0.31817 Aromatics
69 21 32 0 0 0 6 284.256 0.240929 Aromatics
70 22 34 0 0 0 6 298.272 0.279531 Aromatics
71 14 16 0 0 0 7 184.128 0.112723 Aromatics
72 15 18 0 0 0 7 198.144 1.54424 Aromatics
73 16 20 0 0 0 7 212.16 3.28163 Aromatics
74 17 22 0 0 0 7 226.176 1.49748 Aromatics
75 18 24 0 0 0 7 240.192 0.367099 Aromatics
76 19 26 0 0 0 7 254.208 0.183257 Aromatics
77 20 28 0 0 0 7 268.224 0.105409 Aromatics
78 21 30 0 0 0 7 282.24 0.110917 Aromatics
79 22 32 0 0 0 7 296.256 0.076706 Aromatics
80 23 34 0 0 0 7 310.272 0.147115 Aromatics
81 16 18 0 0 0 8 210.144 0.139362 Aromatics
82 17 20 0 0 0 8 224.16 0.235319 Aromatics
83 18 22 0 0 0 8 238.176 0.14913 Aromatics
84 19 24 0 0 0 8 252.192 0.123225 Aromatics
85 20 26 0 0 0 8 266.208 0.078458 Aromatics
86 21 28 0 0 0 8 280.224 0.06241 Aromatics
87 18 20 0 0 0 9 236.16 0.074815 Aromatics
88 19 22 0 0 0 9 250.176 0.079255 Aromatics
89 20 24 0 0 0 9 264.192 0.07354 Aromatics
90 21 26 0 0 0 9 278.208 0.067084 Aromatics
91 14 25 0 1 0 3 207.21 1e-05 Neutral nitrogen compounds
92 15 27 0 1 0 3 221.226 1.1e-05 Neutral nitrogen compounds
93 16 29 0 1 0 3 235.242 1.1e-05 Neutral nitrogen compounds
94 17 31 0 1 0 3 249.258 8e-06 Neutral nitrogen compounds
95 10 15 0 1 0 4 149.13 3e-06 Neutral nitrogen compounds
96 12 19 0 1 0 4 177.162 8e-06 Neutral nitrogen compounds
97 13 21 0 1 0 4 191.178 1.3e-05 Neutral nitrogen compounds
98 14 23 0 1 0 4 205.194 0.002507 Neutral nitrogen compounds
99 15 25 0 1 0 4 219.21 0.004296 Neutral nitrogen compounds
100 16 27 0 1 0 4 233.226 0.002153 Neutral nitrogen compounds
101 17 29 0 1 0 4 247.242 0.000918 Neutral nitrogen compounds
102 18 31 0 1 0 4 261.258 0.000823 Neutral nitrogen compounds
103 19 33 0 1 0 4 275.274 0.000978 Neutral nitrogen compounds
104 20 35 0 1 0 4 289.29 0.001261 Neutral nitrogen compounds
105 21 37 0 1 0 4 303.306 0.001045 Neutral nitrogen compounds
106 22 39 0 1 0 4 317.322 0.000802 Neutral nitrogen compounds
107 23 41 0 1 0 4 331.338 0.000777 Neutral nitrogen compounds
108 24 43 0 1 0 4 345.354 0.000723 Neutral nitrogen compounds
109 25 45 0 1 0 4 359.37 0.0008 Neutral nitrogen compounds
110 26 47 0 1 0 4 373.386 0.000371 Neutral nitrogen compounds
111 27 49 0 1 0 4 387.402 0.000204 Neutral nitrogen compounds
112 28 51 0 1 0 4 401.418 0.000119 Neutral nitrogen compounds
113 29 53 0 1 0 4 415.434 6e-05 Neutral nitrogen compounds
114 12 17 0 1 0 5 175.146 8e-06 Neutral nitrogen compounds
115 13 19 0 1 0 5 189.162 3.9e-05 Neutral nitrogen compounds
116 14 21 0 1 0 5 203.178 0.004566 Neutral nitrogen compounds
117 15 23 0 1 0 5 217.194 0.00853 Neutral nitrogen compounds
118 16 25 0 1 0 5 231.21 0.031659 Neutral nitrogen compounds
119 17 27 0 1 0 5 245.226 0.004827 Neutral nitrogen compounds
120 18 29 0 1 0 5 259.242 0.003296 Neutral nitrogen compounds
121 19 31 0 1 0 5 273.258 0.002744 Neutral nitrogen compounds
122 20 33 0 1 0 5 287.274 0.002665 Neutral nitrogen compounds
123 21 35 0 1 0 5 301.29 0.002444 Neutral nitrogen compounds
124 22 37 0 1 0 5 315.306 0.001961 Neutral nitrogen compounds
125 23 39 0 1 0 5 329.322 0.001622 Neutral nitrogen compounds
126 24 41 0 1 0 5 343.338 0.001508 Neutral nitrogen compounds
127 25 43 0 1 0 5 357.354 0.001272 Neutral nitrogen compounds
128 26 45 0 1 0 5 371.37 0.000732 Neutral nitrogen compounds
129 27 47 0 1 0 5 385.386 0.000424 Neutral nitrogen compounds
130 28 49 0 1 0 5 399.402 0.000207 Neutral nitrogen compounds
131 29 51 0 1 0 5 413.418 9.9e-05 Neutral nitrogen compounds
132 30 53 0 1 0 5 427.434 4.7e-05 Neutral nitrogen compounds
133 12 15 0 1 0 6 173.13 4e-06 Neutral nitrogen compounds
134 13 17 0 1 0 6 187.146 7e-06 Neutral nitrogen compounds
135 14 19 0 1 0 6 201.162 0.000527 Neutral nitrogen compounds
136 15 21 0 1 0 6 215.178 0.001228 Neutral nitrogen compounds
137 15 22 0 2 0 6 230.196 1e-05 Neutral nitrogen compounds
138 16 23 0 1 0 6 229.194 0.003074 Neutral nitrogen compounds
139 16 24 0 2 0 6 244.212 1e-05 Neutral nitrogen compounds
140 17 25 0 1 0 6 243.21 0.0021 Neutral nitrogen compounds
141 17 26 0 2 0 6 258.228 1.3e-05 Neutral nitrogen compounds
142 18 27 0 1 0 6 257.226 0.002902 Neutral nitrogen compounds
143 19 29 0 1 0 6 271.242 0.002842 Neutral nitrogen compounds
144 20 31 0 1 0 6 285.258 0.002792 Neutral nitrogen compounds
145 21 33 0 1 0 6 299.274 0.002701 Neutral nitrogen compounds
146 22 35 0 1 0 6 313.29 0.002285 Neutral nitrogen compounds
147 23 37 0 1 0 6 327.306 0.001758 Neutral nitrogen compounds
148 24 39 0 1 0 6 341.322 0.001446 Neutral nitrogen compounds
149 25 41 0 1 0 6 355.338 0.001107 Neutral nitrogen compounds
150 26 43 0 1 0 6 369.354 0.000681 Neutral nitrogen compounds
151 27 45 0 1 0 6 383.37 0.000417 Neutral nitrogen compounds
152 28 47 0 1 0 6 397.386 0.000182 Neutral nitrogen compounds
153 29 49 0 1 0 6 411.402 9e-05 Neutral nitrogen compounds
154 30 51 0 1 0 6 425.418 3.3e-05 Neutral nitrogen compounds
155 13 15 0 1 0 7 185.13 5e-06 Neutral nitrogen compounds
156 14 17 0 1 0 7 199.146 0.000651 Neutral nitrogen compounds
157 14 18 0 2 0 7 214.164 9e-06 Neutral nitrogen compounds
158 15 19 0 1 0 7 213.162 0.001064 Neutral nitrogen compounds
159 15 20 0 2 0 7 228.18 9e-06 Neutral nitrogen compounds
160 16 21 0 1 0 7 227.178 0.001137 Neutral nitrogen compounds
161 16 22 0 2 0 7 242.196 1.3e-05 Neutral nitrogen compounds
162 17 23 0 1 0 7 241.194 0.001198 Neutral nitrogen compounds
163 17 24 0 2 0 7 256.212 1.4e-05 Neutral nitrogen compounds
164 18 25 0 1 0 7 255.21 0.001455 Neutral nitrogen compounds
165 18 26 0 2 0 7 270.228 1.2e-05 Neutral nitrogen compounds
166 19 27 0 1 0 7 269.226 0.001821 Neutral nitrogen compounds
167 19 28 0 2 0 7 284.244 8e-06 Neutral nitrogen compounds
168 20 29 0 1 0 7 283.242 0.002127 Neutral nitrogen compounds
169 20 30 0 2 0 7 298.26 1e-05 Neutral nitrogen compounds
170 21 31 0 1 0 7 297.258 0.002066 Neutral nitrogen compounds
171 21 32 0 2 0 7 312.276 1e-05 Neutral nitrogen compounds
172 22 33 0 1 0 7 311.274 0.001785 Neutral nitrogen compounds
173 22 34 0 2 0 7 326.292 1.1e-05 Neutral nitrogen compounds
174 23 35 0 1 0 7 325.29 0.001476 Neutral nitrogen compounds
175 24 37 0 1 0 7 339.306 0.001076 Neutral nitrogen compounds
176 25 39 0 1 0 7 353.322 0.000783 Neutral nitrogen compounds
177 26 41 0 1 0 7 367.338 0.000493 Neutral nitrogen compounds
178 27 43 0 1 0 7 381.354 0.000272 Neutral nitrogen compounds
179 28 45 0 1 0 7 395.37 0.000126 Neutral nitrogen compounds
180 29 47 0 1 0 7 409.386 6e-05 Neutral nitrogen compounds
181 30 49 0 1 0 7 423.402 3.2e-05 Neutral nitrogen compounds
182 14 15 0 1 0 8 197.13 0.000101 Neutral nitrogen compounds
183 14 16 0 2 0 8 212.148 1.8e-05 Neutral nitrogen compounds
184 15 17 0 1 0 8 211.146 0.000343 Neutral nitrogen compounds
185 15 18 0 2 0 8 226.164 6.2e-05 Neutral nitrogen compounds
186 16 19 0 1 0 8 225.162 0.000773 Neutral nitrogen compounds
187 16 20 0 2 0 8 240.18 2.8e-05 Neutral nitrogen compounds
188 17 21 0 1 0 8 239.178 0.001267 Neutral nitrogen compounds
189 17 22 0 2 0 8 254.196 3.5e-05 Neutral nitrogen compounds
190 18 23 0 1 0 8 253.194 0.001457 Neutral nitrogen compounds
191 18 24 0 2 0 8 268.212 3.6e-05 Neutral nitrogen compounds
192 19 25 0 1 0 8 267.21 0.001397 Neutral nitrogen compounds
193 19 26 0 2 0 8 282.228 3.7e-05 Neutral nitrogen compounds
194 20 27 0 1 0 8 281.226 0.001453 Neutral nitrogen compounds
195 20 28 0 2 0 8 296.244 3.1e-05 Neutral nitrogen compounds
196 21 29 0 1 0 8 295.242 0.001344 Neutral nitrogen compounds
197 21 30 0 2 0 8 310.26 1.7e-05 Neutral nitrogen compounds
198 22 31 0 1 0 8 309.258 0.001206 Neutral nitrogen compounds
199 22 32 0 2 0 8 324.276 1.4e-05 Neutral nitrogen compounds
200 23 33 0 1 0 8 323.274 0.000893 Neutral nitrogen compounds
201 24 35 0 1 0 8 337.29 0.000653 Neutral nitrogen compounds
202 25 37 0 1 0 8 351.306 0.000481 Neutral nitrogen compounds
203 26 39 0 1 0 8 365.322 0.000294 Neutral nitrogen compounds
204 27 41 0 1 0 8 379.338 0.00016 Neutral nitrogen compounds
205 28 43 0 1 0 8 393.354 7.9e-05 Neutral nitrogen compounds
206 29 45 0 1 0 8 407.37 5.2e-05 Neutral nitrogen compounds
207 30 47 0 1 0 8 421.386 1.6e-05 Neutral nitrogen compounds
208 31 49 0 1 0 8 435.402 1.3e-05 Neutral nitrogen compounds
209 15 15 0 1 0 9 209.13 7e-05 Neutral nitrogen compounds
210 15 16 0 2 0 9 224.148 1.4e-05 Neutral nitrogen compounds
211 16 17 0 1 0 9 223.146 0.000188 Neutral nitrogen compounds
212 16 18 0 2 0 9 238.164 1.6e-05 Neutral nitrogen compounds
213 17 19 0 1 0 9 237.162 0.000436 Neutral nitrogen compounds
214 17 20 0 2 0 9 252.18 2.1e-05 Neutral nitrogen compounds
215 18 21 0 1 0 9 251.178 0.000832 Neutral nitrogen compounds
216 18 22 0 2 0 9 266.196 3e-05 Neutral nitrogen compounds
217 19 23 0 1 0 9 265.194 0.001087 Neutral nitrogen compounds
218 19 24 0 2 0 9 280.212 2.4e-05 Neutral nitrogen compounds
219 20 25 0 1 0 9 279.21 0.00121 Neutral nitrogen compounds
220 20 26 0 2 0 9 294.228 2.8e-05 Neutral nitrogen compounds
221 21 27 0 1 0 9 293.226 0.001079 Neutral nitrogen compounds
222 21 28 0 2 0 9 308.244 2.6e-05 Neutral nitrogen compounds
223 22 29 0 1 0 9 307.242 0.000902 Neutral nitrogen compounds
224 22 30 0 2 0 9 322.26 1.7e-05 Neutral nitrogen compounds
225 23 31 0 1 0 9 321.258 0.000623 Neutral nitrogen compounds
226 23 32 0 2 0 9 336.276 1.3e-05 Neutral nitrogen compounds
227 24 33 0 1 0 9 335.274 0.00046 Neutral nitrogen compounds
228 24 34 0 2 0 9 350.292 8e-06 Neutral nitrogen compounds
229 25 35 0 1 0 9 349.29 0.000288 Neutral nitrogen compounds
230 26 37 0 1 0 9 363.306 0.000194 Neutral nitrogen compounds
231 27 39 0 1 0 9 377.322 0.000105 Neutral nitrogen compounds
232 28 41 0 1 0 9 391.338 5.3e-05 Neutral nitrogen compounds
233 29 43 0 1 0 9 405.354 2.9e-05 Neutral nitrogen compounds
234 30 45 0 1 0 9 419.37 1.3e-05 Neutral nitrogen compounds
235 16 15 0 1 0 10 221.13 0.000632 Neutral nitrogen compounds
236 16 16 0 2 0 10 236.148 9e-06 Neutral nitrogen compounds
237 17 17 0 1 0 10 235.146 0.000577 Neutral nitrogen compounds
238 17 18 0 2 0 10 250.164 1.5e-05 Neutral nitrogen compounds
239 18 19 0 1 0 10 249.162 0.000379 Neutral nitrogen compounds
240 18 20 0 2 0 10 264.18 2.1e-05 Neutral nitrogen compounds
241 19 21 0 1 0 10 263.178 0.00045 Neutral nitrogen compounds
242 19 22 0 2 0 10 278.196 3e-05 Neutral nitrogen compounds
243 20 23 0 1 0 10 277.194 0.000507 Neutral nitrogen compounds
244 20 24 0 2 0 10 292.212 2.5e-05 Neutral nitrogen compounds
245 21 25 0 1 0 10 291.21 0.000536 Neutral nitrogen compounds
246 21 26 0 2 0 10 306.228 1.7e-05 Neutral nitrogen compounds
247 22 27 0 1 0 10 305.226 0.000498 Neutral nitrogen compounds
248 22 28 0 2 0 10 320.244 1.4e-05 Neutral nitrogen compounds
249 23 29 0 1 0 10 319.242 0.000393 Neutral nitrogen compounds
250 23 30 0 2 0 10 334.26 1.6e-05 Neutral nitrogen compounds
251 24 31 0 1 0 10 333.258 0.000276 Neutral nitrogen compounds
252 24 32 0 2 0 10 348.276 9e-06 Neutral nitrogen compounds
253 25 33 0 1 0 10 347.274 0.000184 Neutral nitrogen compounds
254 26 35 0 1 0 10 361.29 0.000132 Neutral nitrogen compounds
255 27 37 0 1 0 10 375.306 7.3e-05 Neutral nitrogen compounds
256 28 39 0 1 0 10 389.322 3.5e-05 Neutral nitrogen compounds
257 29 41 0 1 0 10 403.338 2.7e-05 Neutral nitrogen compounds
258 30 43 0 1 0 10 417.354 1.6e-05 Neutral nitrogen compounds
259 17 15 0 1 0 11 233.13 0.000158 Neutral nitrogen compounds
260 17 16 0 2 0 11 248.148 6e-06 Neutral nitrogen compounds
261 18 17 0 1 0 11 247.146 0.000233 Neutral nitrogen compounds
262 18 18 0 2 0 11 262.164 1e-05 Neutral nitrogen compounds
263 19 19 0 1 0 11 261.162 0.000302 Neutral nitrogen compounds
264 19 20 0 2 0 11 276.18 1.4e-05 Neutral nitrogen compounds
265 20 21 0 1 0 11 275.178 0.000281 Neutral nitrogen compounds
266 20 22 0 2 0 11 290.196 1.5e-05 Neutral nitrogen compounds
267 21 23 0 1 0 11 289.194 0.000233 Neutral nitrogen compounds
268 21 24 0 2 0 11 304.212 1.4e-05 Neutral nitrogen compounds
269 22 25 0 1 0 11 303.21 0.000186 Neutral nitrogen compounds
270 22 26 0 2 0 11 318.228 9e-06 Neutral nitrogen compounds
271 23 27 0 1 0 11 317.226 0.000144 Neutral nitrogen compounds
272 24 29 0 1 0 11 331.242 0.000123 Neutral nitrogen compounds
273 25 31 0 1 0 11 345.258 8.3e-05 Neutral nitrogen compounds
274 26 33 0 1 0 11 359.274 6.2e-05 Neutral nitrogen compounds
275 27 35 0 1 0 11 373.29 4.4e-05 Neutral nitrogen compounds
276 28 37 0 1 0 11 387.306 1.8e-05 Neutral nitrogen compounds
277 29 39 0 1 0 11 401.322 1.2e-05 Neutral nitrogen compounds
278 31 43 0 1 0 11 429.354 1.2e-05 Neutral nitrogen compounds
279 18 15 0 1 0 12 245.13 8e-05 Neutral nitrogen compounds
280 19 17 0 1 0 12 259.146 0.000104 Neutral nitrogen compounds
281 20 19 0 1 0 12 273.162 8.8e-05 Neutral nitrogen compounds
282 20 20 0 2 0 12 288.18 9e-06 Neutral nitrogen compounds
283 21 21 0 1 0 12 287.178 0.000104 Neutral nitrogen compounds
284 21 22 0 2 0 12 302.196 8e-06 Neutral nitrogen compounds
285 22 23 0 1 0 12 301.194 8.2e-05 Neutral nitrogen compounds
286 22 24 0 2 0 12 316.212 1.1e-05 Neutral nitrogen compounds
287 23 25 0 1 0 12 315.21 7.3e-05 Neutral nitrogen compounds
288 23 26 0 2 0 12 330.228 9e-06 Neutral nitrogen compounds
289 24 27 0 1 0 12 329.226 5.2e-05 Neutral nitrogen compounds
290 25 29 0 1 0 12 343.242 4.2e-05 Neutral nitrogen compounds
291 26 31 0 1 0 12 357.258 3.4e-05 Neutral nitrogen compounds
292 27 33 0 1 0 12 371.274 1.7e-05 Neutral nitrogen compounds
293 28 35 0 1 0 12 385.29 1.8e-05 Neutral nitrogen compounds
294 29 37 0 1 0 12 399.306 1.3e-05 Neutral nitrogen compounds
295 19 15 0 1 0 13 257.13 2.3e-05 Neutral nitrogen compounds
296 20 17 0 1 0 13 271.146 2e-05 Neutral nitrogen compounds
297 21 19 0 1 0 13 285.162 2.1e-05 Neutral nitrogen compounds
298 21 20 0 2 0 13 300.18 9e-06 Neutral nitrogen compounds
299 22 21 0 1 0 13 299.178 2.1e-05 Neutral nitrogen compounds
300 22 22 0 2 0 13 314.196 7e-06 Neutral nitrogen compounds
301 23 23 0 1 0 13 313.194 2.3e-05 Neutral nitrogen compounds
302 23 24 0 2 0 13 328.212 9e-06 Neutral nitrogen compounds
303 24 25 0 1 0 13 327.21 2.1e-05 Neutral nitrogen compounds
304 24 26 0 2 0 13 342.228 1.2e-05 Neutral nitrogen compounds
305 25 27 0 1 0 13 341.226 1.5e-05 Neutral nitrogen compounds
306 26 29 0 1 0 13 355.242 1.4e-05 Neutral nitrogen compounds
307 27 31 0 1 0 13 369.258 1.5e-05 Neutral nitrogen compounds
308 28 33 0 1 0 13 383.274 1.2e-05 Neutral nitrogen compounds
309 21 17 0 1 0 14 283.146 8e-06 Neutral nitrogen compounds
310 23 21 0 1 0 14 311.178 1.2e-05 Neutral nitrogen compounds
311 24 23 0 1 0 14 325.194 1e-05 Neutral nitrogen compounds
312 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
313 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
314 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
315 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
316 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
317 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
318 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
319 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
320 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
321 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
322 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
323 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
324 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
325 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
326 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
327 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
328 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
329 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
330 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
331 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
332 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
333 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
334 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
335 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
336 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
337 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
338 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
339 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
340 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
341 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
342 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
343 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
344 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
345 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
346 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
347 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
348 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
349 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
350 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
351 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
352 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
353 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
354 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
355 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
356 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
357 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
358 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
359 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
360 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
361 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
362 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
363 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
364 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
365 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
366 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
367 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
368 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
369 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
370 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
371 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
372 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
373 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
374 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
375 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
376 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
377 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
378 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
379 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
380 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
381 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
382 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
383 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
384 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
385 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
386 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
387 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
388 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
389 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
390 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
391 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
392 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
393 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
394 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
395 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
396 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
397 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
398 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
399 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
400 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
401 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
402 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
403 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
404 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
405 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
406 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
407 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
408 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
409 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
410 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
411 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
412 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
413 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
414 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
415 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
416 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
417 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
418 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
419 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
420 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
421 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
422 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
423 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
424 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
425 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
426 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
427 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
428 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
429 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
430 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
431 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
432 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
433 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
434 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
435 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
436 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
437 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
438 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
439 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
440 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
441 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
442 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
443 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
444 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
445 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
446 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
447 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
448 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
449 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
450 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
451 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
452 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
453 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
454 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
455 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
456 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
457 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
458 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
459 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
460 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
461 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
462 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
463 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
464 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
465 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
466 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
467 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
468 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
469 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
470 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
471 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
472 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
473 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
474 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
475 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
476 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
477 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
478 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
479 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
480 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
481 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
482 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
483 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
484 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
485 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
486 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
487 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
488 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
489 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
490 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
491 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
492 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
493 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
494 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
495 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
496 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
497 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
498 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
499 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
500 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
501 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
502 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
503 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
504 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
505 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
506 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
507 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
508 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
509 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
510 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
511 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
512 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
513 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
514 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
515 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
516 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
517 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
518 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
519 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
520 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
521 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
522 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
523 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
524 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
525 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
526 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
527 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
528 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
529 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
530 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
531 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
532 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
533 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
534 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
535 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
536 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
537 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
538 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
539 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
540 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
541 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
542 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
543 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
544 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
545 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
546 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
547 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
548 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
549 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
550 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
551 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
552 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
553 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
554 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
555 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
556 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
557 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
558 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
559 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
560 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
561 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
562 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
563 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
564 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
565 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
566 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
567 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
568 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
569 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
570 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
571 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
572 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
573 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
574 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
575 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
576 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
577 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
578 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
579 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
580 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
581 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
582 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
583 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
584 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
585 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
586 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
587 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
588 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
589 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
590 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
591 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
592 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
593 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
594 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
595 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
596 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
597 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
598 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
599 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
600 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
601 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
602 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
603 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
604 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
605 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
606 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
607 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
608 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
609 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
610 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
611 0 0 0 0 0 0 0.0 0.0 Neutral nitrogen compounds
612 22 39 1 1 0 4 333.322 6.2e-05 Basic nitrogen compounds
613 19 33 1 1 0 4 291.274 6.3e-05 Basic nitrogen compounds
614 18 31 1 1 0 4 277.258 0.000131 Basic nitrogen compounds
615 17 29 1 1 0 4 263.242 5.1e-05 Basic nitrogen compounds
616 15 25 1 1 0 4 235.21 6.8e-05 Basic nitrogen compounds
617 14 23 1 1 0 4 221.194 0.000122 Basic nitrogen compounds
618 13 21 1 1 0 4 207.178 0.000104 Basic nitrogen compounds
619 12 19 1 1 0 4 193.162 8.2e-05 Basic nitrogen compounds
620 11 17 1 1 0 4 179.146 7.7e-05 Basic nitrogen compounds
621 10 15 1 1 0 4 165.13 8.4e-05 Basic nitrogen compounds
622 9 13 1 1 0 4 151.114 2.7e-05 Basic nitrogen compounds
623 21 35 1 1 0 5 317.29 6.1e-05 Basic nitrogen compounds
624 20 33 1 1 0 5 303.274 7.6e-05 Basic nitrogen compounds
625 19 31 1 1 0 5 289.258 0.000193 Basic nitrogen compounds
626 18 29 1 1 0 5 275.242 0.00025 Basic nitrogen compounds
627 17 27 1 1 0 5 261.226 0.000155 Basic nitrogen compounds
628 16 25 1 1 0 5 247.21 0.00011 Basic nitrogen compounds
629 15 23 1 1 0 5 233.194 0.00022 Basic nitrogen compounds
630 14 21 1 1 0 5 219.178 0.000121 Basic nitrogen compounds
631 13 19 1 1 0 5 205.162 8e-05 Basic nitrogen compounds
632 12 17 1 1 0 5 191.146 8.1e-05 Basic nitrogen compounds
633 11 15 1 1 0 5 177.13 7.2e-05 Basic nitrogen compounds
634 10 13 1 1 0 5 163.114 3e-05 Basic nitrogen compounds
635 24 39 0 1 0 6 341.322 7.1e-05 Basic nitrogen compounds
636 23 37 0 1 0 6 327.306 7.3e-05 Basic nitrogen compounds
637 22 35 0 1 0 6 313.29 0.000118 Basic nitrogen compounds
638 21 33 0 1 0 6 299.274 0.000253 Basic nitrogen compounds
639 20 31 0 1 0 6 285.258 0.000358 Basic nitrogen compounds
640 20 31 1 1 0 6 301.258 8.6e-05 Basic nitrogen compounds
641 19 29 0 1 0 6 271.242 0.00039 Basic nitrogen compounds
642 19 29 1 1 0 6 287.242 0.000122 Basic nitrogen compounds
643 18 27 0 1 0 6 257.226 0.000474 Basic nitrogen compounds
644 18 27 1 1 0 6 273.226 0.000126 Basic nitrogen compounds
645 17 25 0 1 0 6 243.21 0.000344 Basic nitrogen compounds
646 17 25 1 1 0 6 259.21 0.000126 Basic nitrogen compounds
647 16 23 0 1 0 6 229.194 0.000421 Basic nitrogen compounds
648 16 23 1 1 0 6 245.194 7.3e-05 Basic nitrogen compounds
649 15 21 0 1 0 6 215.178 0.000329 Basic nitrogen compounds
650 15 21 1 1 0 6 231.178 8.3e-05 Basic nitrogen compounds
651 14 19 0 1 0 6 201.162 0.000245 Basic nitrogen compounds
652 14 19 1 1 0 6 217.162 0.000112 Basic nitrogen compounds
653 13 17 0 1 0 6 187.146 0.00022 Basic nitrogen compounds
654 13 17 1 1 0 6 203.146 7.3e-05 Basic nitrogen compounds
655 12 15 0 1 0 6 173.13 0.000266 Basic nitrogen compounds
656 12 15 1 1 0 6 189.13 6.4e-05 Basic nitrogen compounds
657 11 13 0 1 0 6 159.114 6.7e-05 Basic nitrogen compounds
658 11 13 1 1 0 6 175.114 3.8e-05 Basic nitrogen compounds
659 23 35 0 1 0 7 325.29 0.000116 Basic nitrogen compounds
660 22 33 0 1 0 7 311.274 0.00031 Basic nitrogen compounds
661 21 31 0 1 0 7 297.258 0.000511 Basic nitrogen compounds
662 20 29 0 1 0 7 283.242 0.000844 Basic nitrogen compounds
663 20 29 1 1 0 7 299.242 7.5e-05 Basic nitrogen compounds
664 19 27 0 1 0 7 269.226 0.001248 Basic nitrogen compounds
665 19 27 1 1 0 7 285.226 0.000128 Basic nitrogen compounds
666 18 25 0 1 0 7 255.21 0.001042 Basic nitrogen compounds
667 18 25 1 1 0 7 271.21 7.2e-05 Basic nitrogen compounds
668 17 23 0 1 0 7 241.194 0.000568 Basic nitrogen compounds
669 17 23 1 1 0 7 257.194 0.000139 Basic nitrogen compounds
670 16 21 0 1 0 7 227.178 0.000659 Basic nitrogen compounds
671 16 21 1 1 0 7 243.178 7.4e-05 Basic nitrogen compounds
672 15 19 0 1 0 7 213.162 0.000227 Basic nitrogen compounds
673 15 19 1 1 0 7 229.162 0.000139 Basic nitrogen compounds
674 14 17 0 1 0 7 199.146 3.5e-05 Basic nitrogen compounds
675 14 17 1 1 0 7 215.146 9.6e-05 Basic nitrogen compounds
676 13 15 0 1 0 7 185.13 3.6e-05 Basic nitrogen compounds
677 13 15 1 1 0 7 201.13 9.5e-05 Basic nitrogen compounds
678 12 13 0 1 0 7 171.114 3.6e-05 Basic nitrogen compounds
679 12 13 1 1 0 7 187.114 7.1e-05 Basic nitrogen compounds
680 11 11 1 1 0 7 173.098 6.2e-05 Basic nitrogen compounds
681 24 35 0 1 0 8 337.29 8.4e-05 Basic nitrogen compounds
682 23 33 0 1 0 8 323.274 0.000102 Basic nitrogen compounds
683 22 31 0 1 0 8 309.258 0.000166 Basic nitrogen compounds
684 21 29 0 1 0 8 295.242 0.000345 Basic nitrogen compounds
685 21 29 1 1 0 8 311.242 6.5e-05 Basic nitrogen compounds
686 20 27 0 1 0 8 281.226 0.00041 Basic nitrogen compounds
687 20 27 1 1 0 8 297.226 7e-05 Basic nitrogen compounds
688 19 25 0 1 0 8 267.21 0.000501 Basic nitrogen compounds
689 19 25 1 1 0 8 283.21 0.00011 Basic nitrogen compounds
690 18 23 0 1 0 8 253.194 0.000249 Basic nitrogen compounds
691 18 23 1 1 0 8 269.194 0.000126 Basic nitrogen compounds
692 17 21 0 1 0 8 239.178 0.000126 Basic nitrogen compounds
693 17 21 1 1 0 8 255.178 9.7e-05 Basic nitrogen compounds
694 16 19 1 1 0 8 241.162 0.00014 Basic nitrogen compounds
695 15 17 1 1 0 8 227.146 0.00014 Basic nitrogen compounds
696 14 15 1 1 0 8 213.13 7.1e-05 Basic nitrogen compounds
697 13 13 1 1 0 8 199.114 3.4e-05 Basic nitrogen compounds
698 24 33 0 1 0 9 335.274 9.6e-05 Basic nitrogen compounds
699 23 31 0 1 0 9 321.258 0.000258 Basic nitrogen compounds
700 22 29 0 1 0 9 307.242 0.000464 Basic nitrogen compounds
701 21 27 0 1 0 9 293.226 0.001157 Basic nitrogen compounds
702 20 25 0 1 0 9 279.21 0.002073 Basic nitrogen compounds
703 20 25 1 1 0 9 295.21 6.4e-05 Basic nitrogen compounds
704 19 23 0 1 0 9 265.194 0.003164 Basic nitrogen compounds
705 19 23 1 1 0 9 281.194 7.9e-05 Basic nitrogen compounds
706 18 21 0 1 0 9 251.178 0.002833 Basic nitrogen compounds
707 18 21 1 1 0 9 267.178 6.3e-05 Basic nitrogen compounds
708 17 19 0 1 0 9 237.162 0.003724 Basic nitrogen compounds
709 17 19 1 1 0 9 253.162 6.4e-05 Basic nitrogen compounds
710 16 17 0 1 0 9 223.146 0.004717 Basic nitrogen compounds
711 15 15 0 1 0 9 209.13 0.003178 Basic nitrogen compounds
712 14 13 0 1 0 9 195.114 0.001375 Basic nitrogen compounds
713 13 11 0 1 0 9 181.098 0.000657 Basic nitrogen compounds
714 24 31 0 1 0 10 333.258 8e-05 Basic nitrogen compounds
715 23 29 0 1 0 10 319.242 0.000182 Basic nitrogen compounds
716 22 27 0 1 0 10 305.226 0.000357 Basic nitrogen compounds
717 21 25 0 1 0 10 291.21 0.000724 Basic nitrogen compounds
718 20 23 0 1 0 10 277.194 0.000999 Basic nitrogen compounds
719 19 21 0 1 0 10 263.178 0.001311 Basic nitrogen compounds
720 18 19 0 1 0 10 249.162 0.000627 Basic nitrogen compounds
721 17 17 0 1 0 10 235.146 0.000481 Basic nitrogen compounds
722 16 15 0 1 0 10 221.13 0.00018 Basic nitrogen compounds
723 15 13 0 1 0 10 207.114 6.1e-05 Basic nitrogen compounds
724 24 29 0 1 0 11 331.242 7.5e-05 Basic nitrogen compounds
725 23 27 0 1 0 11 317.226 0.000136 Basic nitrogen compounds
726 22 25 0 1 0 11 303.21 0.000147 Basic nitrogen compounds
727 21 23 0 1 0 11 289.194 0.000211 Basic nitrogen compounds
728 20 21 0 1 0 11 275.178 0.000137 Basic nitrogen compounds
729 19 19 0 1 0 11 261.162 7.5e-05 Basic nitrogen compounds
730 25 29 0 1 0 12 343.242 6.7e-05 Basic nitrogen compounds
731 24 27 0 1 0 12 329.226 8.5e-05 Basic nitrogen compounds
732 23 25 0 1 0 12 315.21 0.000107 Basic nitrogen compounds
733 22 23 0 1 0 12 301.194 0.00018 Basic nitrogen compounds
734 21 21 0 1 0 12 287.178 0.000371 Basic nitrogen compounds
735 20 19 0 1 0 12 273.162 0.00063 Basic nitrogen compounds
736 19 17 0 1 0 12 259.146 0.000858 Basic nitrogen compounds
737 18 15 0 1 0 12 245.13 0.000526 Basic nitrogen compounds
738 17 13 0 1 0 12 231.114 0.000407 Basic nitrogen compounds
739 16 11 0 1 0 12 217.098 0.000163 Basic nitrogen compounds
740 25 27 0 1 0 13 341.226 6.3e-05 Basic nitrogen compounds
741 24 25 0 1 0 13 327.21 6.8e-05 Basic nitrogen compounds
742 23 23 0 1 0 13 313.194 0.00013 Basic nitrogen compounds
743 22 21 0 1 0 13 299.178 0.000226 Basic nitrogen compounds
744 21 19 0 1 0 13 285.162 0.00017 Basic nitrogen compounds
745 20 17 0 1 0 13 271.146 9.9e-05 Basic nitrogen compounds
746 19 15 0 1 0 13 257.13 9.1e-05 Basic nitrogen compounds
747 24 23 0 1 0 14 325.194 7.6e-05 Basic nitrogen compounds
748 23 21 0 1 0 14 311.178 6.9e-05 Basic nitrogen compounds
749 22 19 0 1 0 14 297.162 7.7e-05 Basic nitrogen compounds
750 24 21 0 1 0 15 323.178 6.1e-05 Basic nitrogen compounds
751 23 19 0 1 0 15 309.162 6.4e-05 Basic nitrogen compounds
752 22 17 0 1 0 15 295.146 7.3e-05 Basic nitrogen compounds
753 34 64 0 0 1 3 504.572 0.000496 Thiophenic compounds
754 33 62 0 0 1 3 490.556 0.000438 Thiophenic compounds
755 32 60 0 0 1 3 476.54 0.000687 Thiophenic compounds
756 31 58 0 0 1 3 462.524 0.00098 Thiophenic compounds
757 30 56 0 0 1 3 448.508 0.001068 Thiophenic compounds
758 29 54 0 0 1 3 434.492 0.001293 Thiophenic compounds
759 28 52 0 0 1 3 420.476 0.001612 Thiophenic compounds
760 27 50 0 0 1 3 406.46 0.001665 Thiophenic compounds
761 26 48 0 0 1 3 392.444 0.001711 Thiophenic compounds
762 25 46 0 0 1 3 378.428 0.001648 Thiophenic compounds
763 24 44 0 0 1 3 364.412 0.001776 Thiophenic compounds
764 23 42 0 0 1 3 350.396 0.001702 Thiophenic compounds
765 22 40 0 0 1 3 336.38 0.001358 Thiophenic compounds
766 21 38 0 0 1 3 322.364 0.001014 Thiophenic compounds
767 20 36 0 0 1 3 308.348 0.000806 Thiophenic compounds
768 19 34 0 0 1 3 294.332 0.000666 Thiophenic compounds
769 18 32 0 0 1 3 280.316 0.000485 Thiophenic compounds
770 17 30 0 0 1 3 266.3 0.000361 Thiophenic compounds
771 16 28 0 0 1 3 252.284 0.000237 Thiophenic compounds
772 15 26 0 0 1 3 238.268 0.000205 Thiophenic compounds
773 14 24 0 0 1 3 224.252 0.000123 Thiophenic compounds
774 13 22 0 0 1 3 210.236 0.00013 Thiophenic compounds
775 37 68 0 0 1 4 544.604 0.000508 Thiophenic compounds
776 35 64 0 0 1 4 516.572 0.000737 Thiophenic compounds
777 34 62 0 0 1 4 502.556 0.001192 Thiophenic compounds
778 33 60 0 0 1 4 488.54 0.001369 Thiophenic compounds
779 32 58 0 0 1 4 474.524 0.001849 Thiophenic compounds
780 31 56 0 0 1 4 460.508 0.002163 Thiophenic compounds
781 30 54 0 0 1 4 446.492 0.002251 Thiophenic compounds
782 29 52 0 0 1 4 432.476 0.00246 Thiophenic compounds
783 28 50 0 0 1 4 418.46 0.002421 Thiophenic compounds
784 27 48 0 0 1 4 404.444 0.002796 Thiophenic compounds
785 26 46 0 0 1 4 390.428 0.002451 Thiophenic compounds
786 25 44 0 0 1 4 376.412 0.002595 Thiophenic compounds
787 24 42 0 0 1 4 362.396 0.001908 Thiophenic compounds
788 23 40 0 0 1 4 348.38 0.002021 Thiophenic compounds
789 22 38 0 0 1 4 334.364 0.00176 Thiophenic compounds
790 21 36 0 0 1 4 320.348 0.00153 Thiophenic compounds
791 20 34 0 0 1 4 306.332 0.00199 Thiophenic compounds
792 19 32 0 0 1 4 292.316 0.001043 Thiophenic compounds
793 18 30 0 0 1 4 278.3 0.001226 Thiophenic compounds
794 17 28 0 0 1 4 264.284 0.000575 Thiophenic compounds
795 16 26 0 0 1 4 250.268 0.000374 Thiophenic compounds
796 15 24 0 0 1 4 236.252 0.000414 Thiophenic compounds
797 14 22 0 0 1 4 222.236 0.000312 Thiophenic compounds
798 13 20 0 0 1 4 208.22 0.000154 Thiophenic compounds
799 12 18 0 0 1 4 194.204 0.000247 Thiophenic compounds
800 38 68 0 0 1 5 556.604 0.000451 Thiophenic compounds
801 37 66 0 0 1 5 542.588 0.000423 Thiophenic compounds
802 36 64 0 0 1 5 528.572 0.000639 Thiophenic compounds
803 35 62 0 0 1 5 514.556 0.000882 Thiophenic compounds
804 34 60 0 0 1 5 500.54 0.001201 Thiophenic compounds
805 33 58 0 0 1 5 486.524 0.001605 Thiophenic compounds
806 32 56 0 0 1 5 472.508 0.001791 Thiophenic compounds
807 31 54 0 0 1 5 458.492 0.002287 Thiophenic compounds
808 30 52 0 0 1 5 444.476 0.002755 Thiophenic compounds
809 29 50 0 0 1 5 430.46 0.002845 Thiophenic compounds
810 28 48 0 0 1 5 416.444 0.002499 Thiophenic compounds
811 27 46 0 0 1 5 402.428 0.002591 Thiophenic compounds
812 26 44 0 0 1 5 388.412 0.002708 Thiophenic compounds
813 25 42 0 0 1 5 374.396 0.004128 Thiophenic compounds
814 24 40 0 0 1 5 360.38 0.002247 Thiophenic compounds
815 23 38 0 0 1 5 346.364 0.002051 Thiophenic compounds
816 22 36 0 0 1 5 332.348 0.001842 Thiophenic compounds
817 21 34 0 0 1 5 318.332 0.001547 Thiophenic compounds
818 20 32 0 0 1 5 304.316 0.001366 Thiophenic compounds
819 19 30 0 0 1 5 290.3 0.001194 Thiophenic compounds
820 18 28 0 0 1 5 276.284 0.000796 Thiophenic compounds
821 17 26 0 0 1 5 262.268 0.000701 Thiophenic compounds
822 16 24 0 0 1 5 248.252 0.000384 Thiophenic compounds
823 15 22 0 0 1 5 234.236 0.000372 Thiophenic compounds
824 14 20 0 0 1 5 220.22 0.000194 Thiophenic compounds
825 13 18 0 0 1 5 206.204 0.000121 Thiophenic compounds
826 9 10 0 0 1 5 150.14 6.8e-05 Thiophenic compounds
827 40 70 0 0 1 6 582.62 0.000499 Thiophenic compounds
828 36 62 0 0 1 6 526.556 0.000654 Thiophenic compounds
829 35 60 0 0 1 6 512.54 0.000934 Thiophenic compounds
830 34 58 0 0 1 6 498.524 0.001266 Thiophenic compounds
831 33 56 0 0 1 6 484.508 0.002114 Thiophenic compounds
832 32 54 0 0 1 6 470.492 0.002732 Thiophenic compounds
833 31 52 0 0 1 6 456.476 0.003961 Thiophenic compounds
834 30 50 0 0 1 6 442.46 0.005013 Thiophenic compounds
835 29 48 0 0 1 6 428.444 0.007348 Thiophenic compounds
836 28 46 0 0 1 6 414.428 0.009858 Thiophenic compounds
837 27 44 0 0 1 6 400.412 0.012749 Thiophenic compounds
838 26 42 0 0 1 6 386.396 0.014284 Thiophenic compounds
839 25 40 0 0 1 6 372.38 0.016008 Thiophenic compounds
840 24 38 0 0 1 6 358.364 0.006997 Thiophenic compounds
841 23 36 0 0 1 6 344.348 0.017075 Thiophenic compounds
842 22 34 0 0 1 6 330.332 0.016924 Thiophenic compounds
843 21 32 0 0 1 6 316.316 0.005022 Thiophenic compounds
844 20 30 0 0 1 6 302.3 0.003883 Thiophenic compounds
845 19 28 0 0 1 6 288.284 0.002774 Thiophenic compounds
846 18 26 0 0 1 6 274.268 0.001998 Thiophenic compounds
847 17 24 0 0 1 6 260.252 0.00138 Thiophenic compounds
848 16 22 0 0 1 6 246.236 0.001016 Thiophenic compounds
849 15 20 0 0 1 6 232.22 0.002335 Thiophenic compounds
850 14 18 0 0 1 6 218.204 0.000615 Thiophenic compounds
851 13 16 0 0 1 6 204.188 0.000468 Thiophenic compounds
852 12 14 0 0 1 6 190.172 0.00024 Thiophenic compounds
853 11 12 0 0 1 6 176.156 0.000113 Thiophenic compounds
854 9 8 0 0 1 6 148.124 6.5e-05 Thiophenic compounds
855 39 66 0 0 1 7 566.588 0.000493 Thiophenic compounds
856 38 64 0 0 1 7 552.572 0.000694 Thiophenic compounds
857 37 62 0 0 1 7 538.556 0.000626 Thiophenic compounds
858 36 60 0 0 1 7 524.54 0.000873 Thiophenic compounds
859 35 58 0 0 1 7 510.524 0.001184 Thiophenic compounds
860 34 56 0 0 1 7 496.508 0.001565 Thiophenic compounds
861 33 54 0 0 1 7 482.492 0.001805 Thiophenic compounds
862 32 52 0 0 1 7 468.476 0.002649 Thiophenic compounds
863 31 50 0 0 1 7 454.46 0.003477 Thiophenic compounds
864 30 48 0 0 1 7 440.444 0.004196 Thiophenic compounds
865 29 46 0 0 1 7 426.428 0.005571 Thiophenic compounds
866 28 44 0 0 1 7 412.412 0.00664 Thiophenic compounds
867 27 42 0 0 1 7 398.396 0.009721 Thiophenic compounds
868 26 40 0 0 1 7 384.38 0.009765 Thiophenic compounds
869 25 38 0 0 1 7 370.364 0.011815 Thiophenic compounds
870 24 36 0 0 1 7 356.348 0.007671 Thiophenic compounds
871 23 34 0 0 1 7 342.332 0.010956 Thiophenic compounds
872 22 32 0 0 1 7 328.316 0.010655 Thiophenic compounds
873 21 30 0 0 1 7 314.3 0.010172 Thiophenic compounds
874 20 28 0 0 1 7 300.284 0.00344 Thiophenic compounds
875 19 26 0 0 1 7 286.268 0.002405 Thiophenic compounds
876 18 24 0 0 1 7 272.252 0.008658 Thiophenic compounds
877 17 22 0 0 1 7 258.236 0.004799 Thiophenic compounds
878 16 20 0 0 1 7 244.22 0.001496 Thiophenic compounds
879 15 18 0 0 1 7 230.204 0.000713 Thiophenic compounds
880 14 16 0 0 1 7 216.188 0.000387 Thiophenic compounds
881 13 14 0 0 1 7 202.172 0.000491 Thiophenic compounds
882 12 12 0 0 1 7 188.156 0.000213 Thiophenic compounds
883 11 10 0 0 1 7 174.14 0.000108 Thiophenic compounds
884 40 66 0 0 1 8 578.588 0.000558 Thiophenic compounds
885 38 62 0 0 1 8 550.556 0.000512 Thiophenic compounds
886 37 60 0 0 1 8 536.54 0.000604 Thiophenic compounds
887 36 58 0 0 1 8 522.524 0.00088 Thiophenic compounds
888 35 56 0 0 1 8 508.508 0.001119 Thiophenic compounds
889 34 54 0 0 1 8 494.492 0.001148 Thiophenic compounds
890 33 52 0 0 1 8 480.476 0.001861 Thiophenic compounds
891 32 50 0 0 1 8 466.46 0.00223 Thiophenic compounds
892 31 48 0 0 1 8 452.444 0.002991 Thiophenic compounds
893 30 46 0 0 1 8 438.428 0.004471 Thiophenic compounds
894 29 44 0 0 1 8 424.412 0.004843 Thiophenic compounds
895 28 42 0 0 1 8 410.396 0.005523 Thiophenic compounds
896 27 40 0 0 1 8 396.38 0.007246 Thiophenic compounds
897 26 38 0 0 1 8 382.364 0.008016 Thiophenic compounds
898 25 36 0 0 1 8 368.348 0.008688 Thiophenic compounds
899 24 34 0 0 1 8 354.332 0.00964 Thiophenic compounds
900 23 32 0 0 1 8 340.316 0.010453 Thiophenic compounds
901 22 30 0 0 1 8 326.3 0.009486 Thiophenic compounds
902 21 28 0 0 1 8 312.284 0.003313 Thiophenic compounds
903 20 26 0 0 1 8 298.268 0.002718 Thiophenic compounds
904 19 24 0 0 1 8 284.252 0.002097 Thiophenic compounds
905 18 22 0 0 1 8 270.236 0.005471 Thiophenic compounds
906 17 20 0 0 1 8 256.22 0.000916 Thiophenic compounds
907 16 18 0 0 1 8 242.204 0.001035 Thiophenic compounds
908 15 16 0 0 1 8 228.188 0.000543 Thiophenic compounds
909 14 14 0 0 1 8 214.172 0.000377 Thiophenic compounds
910 13 12 0 0 1 8 200.156 0.000149 Thiophenic compounds
911 12 10 0 0 1 8 186.14 0.00013 Thiophenic compounds
912 41 66 0 0 1 9 590.588 0.000573 Thiophenic compounds
913 40 64 0 0 1 9 576.572 0.000671 Thiophenic compounds
914 39 62 0 0 1 9 562.556 0.00066 Thiophenic compounds
915 38 60 0 0 1 9 548.54 0.001036 Thiophenic compounds
916 37 58 0 0 1 9 534.524 0.001236 Thiophenic compounds
917 36 56 0 0 1 9 520.508 0.001175 Thiophenic compounds
918 35 54 0 0 1 9 506.492 0.00142 Thiophenic compounds
919 34 52 0 0 1 9 492.476 0.001622 Thiophenic compounds
920 33 50 0 0 1 9 478.46 0.002109 Thiophenic compounds
921 32 48 0 0 1 9 464.444 0.002458 Thiophenic compounds
922 31 46 0 0 1 9 450.428 0.003752 Thiophenic compounds
923 30 44 0 0 1 9 436.412 0.004103 Thiophenic compounds
924 29 42 0 0 1 9 422.396 0.00622 Thiophenic compounds
925 28 40 0 0 1 9 408.38 0.008153 Thiophenic compounds
926 27 38 0 0 1 9 394.364 0.00381 Thiophenic compounds
927 26 36 0 0 1 9 380.348 0.015075 Thiophenic compounds
928 25 34 0 0 1 9 366.332 0.007239 Thiophenic compounds
929 24 32 0 0 1 9 352.316 0.006783 Thiophenic compounds
930 23 30 0 0 1 9 338.3 0.006621 Thiophenic compounds
931 22 28 0 0 1 9 324.284 0.005166 Thiophenic compounds
932 21 26 0 0 1 9 310.268 0.007028 Thiophenic compounds
933 20 24 0 0 1 9 296.252 0.006864 Thiophenic compounds
934 19 22 0 0 1 9 282.236 0.005878 Thiophenic compounds
935 18 20 0 0 1 9 268.22 0.008154 Thiophenic compounds
936 17 18 0 0 1 9 254.204 0.008138 Thiophenic compounds
937 16 16 0 0 1 9 240.188 0.006171 Thiophenic compounds
938 15 14 0 0 1 9 226.172 0.00365 Thiophenic compounds
939 14 12 0 0 1 9 212.156 0.001676 Thiophenic compounds
940 13 10 0 0 1 9 198.14 0.000935 Thiophenic compounds
941 12 8 0 0 1 9 184.124 8.4e-05 Thiophenic compounds
942 44 70 0 0 1 10 630.62 0.000424 Thiophenic compounds
943 42 66 0 0 1 10 602.588 0.000566 Thiophenic compounds
944 40 62 0 0 1 10 574.556 0.000598 Thiophenic compounds
945 39 60 0 0 1 10 560.54 0.000743 Thiophenic compounds
946 38 58 0 0 1 10 546.524 0.000648 Thiophenic compounds
947 37 56 0 0 1 10 532.508 0.000919 Thiophenic compounds
948 36 54 0 0 1 10 518.492 0.001128 Thiophenic compounds
949 35 52 0 0 1 10 504.476 0.001399 Thiophenic compounds
950 34 50 0 0 1 10 490.46 0.001854 Thiophenic compounds
951 33 48 0 0 1 10 476.444 0.002082 Thiophenic compounds
952 32 46 0 0 1 10 462.428 0.002732 Thiophenic compounds
953 31 44 0 0 1 10 448.412 0.003777 Thiophenic compounds
954 30 42 0 0 1 10 434.396 0.004525 Thiophenic compounds
955 29 40 0 0 1 10 420.38 0.006208 Thiophenic compounds
956 28 38 0 0 1 10 406.364 0.007416 Thiophenic compounds
957 27 36 0 0 1 10 392.348 0.01041 Thiophenic compounds
958 26 34 0 0 1 10 378.332 0.013764 Thiophenic compounds
959 25 32 0 0 1 10 364.316 0.005704 Thiophenic compounds
960 24 30 0 0 1 10 350.3 0.005847 Thiophenic compounds
961 23 28 0 0 1 10 336.284 0.004966 Thiophenic compounds
962 22 26 0 0 1 10 322.268 0.006269 Thiophenic compounds
963 21 24 0 0 1 10 308.252 0.00574 Thiophenic compounds
964 20 22 0 0 1 10 294.236 0.010276 Thiophenic compounds
965 19 20 0 0 1 10 280.22 0.007619 Thiophenic compounds
966 18 18 0 0 1 10 266.204 0.00501 Thiophenic compounds
967 17 16 0 0 1 10 252.188 0.003842 Thiophenic compounds
968 16 14 0 0 1 10 238.172 0.004238 Thiophenic compounds
969 15 12 0 0 1 10 224.156 0.000866 Thiophenic compounds
970 14 10 0 0 1 10 210.14 0.000663 Thiophenic compounds
971 13 8 0 0 1 10 196.124 0.000345 Thiophenic compounds
972 12 6 0 0 1 10 182.108 9.5e-05 Thiophenic compounds
973 45 70 0 0 1 11 642.62 0.000445 Thiophenic compounds
974 41 62 0 0 1 11 586.556 0.000699 Thiophenic compounds
975 40 60 0 0 1 11 572.54 0.00056 Thiophenic compounds
976 39 58 0 0 1 11 558.524 0.000558 Thiophenic compounds
977 38 56 0 0 1 11 544.508 0.000893 Thiophenic compounds
978 36 52 0 0 1 11 516.476 0.001131 Thiophenic compounds
979 35 50 0 0 1 11 502.46 0.001495 Thiophenic compounds
980 34 48 0 0 1 11 488.444 0.001757 Thiophenic compounds
981 33 46 0 0 1 11 474.428 0.002165 Thiophenic compounds
982 32 44 0 0 1 11 460.412 0.003083 Thiophenic compounds
983 31 42 0 0 1 11 446.396 0.00328 Thiophenic compounds
984 30 40 0 0 1 11 432.38 0.004026 Thiophenic compounds
985 29 38 0 0 1 11 418.364 0.005231 Thiophenic compounds
986 28 36 0 0 1 11 404.348 0.006995 Thiophenic compounds
987 27 34 0 0 1 11 390.332 0.00882 Thiophenic compounds
988 26 32 0 0 1 11 376.316 0.011601 Thiophenic compounds
989 25 30 0 0 1 11 362.3 0.013205 Thiophenic compounds
990 24 28 0 0 1 11 348.284 0.016001 Thiophenic compounds
991 23 26 0 0 1 11 334.268 0.004846 Thiophenic compounds
992 22 24 0 0 1 11 320.252 0.004359 Thiophenic compounds
993 21 22 0 0 1 11 306.236 0.003887 Thiophenic compounds
994 20 20 0 0 1 11 292.22 0.003848 Thiophenic compounds
995 19 18 0 0 1 11 278.204 0.002725 Thiophenic compounds
996 18 16 0 0 1 11 264.188 0.008093 Thiophenic compounds
997 17 14 0 0 1 11 250.172 0.001261 Thiophenic compounds
998 16 12 0 0 1 11 236.156 0.001967 Thiophenic compounds
999 15 10 0 0 1 11 222.14 0.000361 Thiophenic compounds
1000 14 8 0 0 1 11 208.124 0.000143 Thiophenic compounds
1001 13 6 0 0 1 11 194.108 0.000166 Thiophenic compounds
1002 45 68 0 0 1 12 640.604 0.000469 Thiophenic compounds
1003 44 66 0 0 1 12 626.588 0.000505 Thiophenic compounds
1004 43 64 0 0 1 12 612.572 0.000453 Thiophenic compounds
1005 40 58 0 0 1 12 570.524 0.000628 Thiophenic compounds
1006 39 56 0 0 1 12 556.508 0.000566 Thiophenic compounds
1007 38 54 0 0 1 12 542.492 0.000953 Thiophenic compounds
1008 37 52 0 0 1 12 528.476 0.001064 Thiophenic compounds
1009 35 48 0 0 1 12 500.444 0.001529 Thiophenic compounds
1010 34 46 0 0 1 12 486.428 0.001828 Thiophenic compounds
1011 33 44 0 0 1 12 472.412 0.002442 Thiophenic compounds
1012 32 42 0 0 1 12 458.396 0.003165 Thiophenic compounds
1013 31 40 0 0 1 12 444.38 0.003661 Thiophenic compounds
1014 30 38 0 0 1 12 430.364 0.004725 Thiophenic compounds
1015 29 36 0 0 1 12 416.348 0.005334 Thiophenic compounds
1016 28 34 0 0 1 12 402.332 0.002389 Thiophenic compounds
1017 27 32 0 0 1 12 388.316 0.00274 Thiophenic compounds
1018 26 30 0 0 1 12 374.3 0.003251 Thiophenic compounds
1019 25 28 0 0 1 12 360.284 0.002498 Thiophenic compounds
1020 24 26 0 0 1 12 346.268 0.004291 Thiophenic compounds
1021 23 24 0 0 1 12 332.252 0.004982 Thiophenic compounds
1022 22 22 0 0 1 12 318.236 0.007401 Thiophenic compounds
1023 21 20 0 0 1 12 304.22 0.010779 Thiophenic compounds
1024 20 18 0 0 1 12 290.204 0.007963 Thiophenic compounds
1025 19 16 0 0 1 12 276.188 0.004824 Thiophenic compounds
1026 18 14 0 0 1 12 262.172 0.008272 Thiophenic compounds
1027 17 12 0 0 1 12 248.156 0.002001 Thiophenic compounds
1028 16 10 0 0 1 12 234.14 0.000751 Thiophenic compounds
1029 15 8 0 0 1 12 220.124 0.000559 Thiophenic compounds
1030 14 6 0 0 1 12 206.108 0.000266 Thiophenic compounds
1031 42 60 0 0 1 13 596.54 0.000493 Thiophenic compounds
1032 41 58 0 0 1 13 582.524 0.000659 Thiophenic compounds
1033 40 56 0 0 1 13 568.508 0.000696 Thiophenic compounds
1034 39 54 0 0 1 13 554.492 0.000858 Thiophenic compounds
1035 38 52 0 0 1 13 540.476 0.001067 Thiophenic compounds
1036 37 50 0 0 1 13 526.46 0.001141 Thiophenic compounds
1037 36 48 0 0 1 13 512.444 0.001327 Thiophenic compounds
1038 35 46 0 0 1 13 498.428 0.001742 Thiophenic compounds
1039 34 44 0 0 1 13 484.412 0.002367 Thiophenic compounds
1040 33 42 0 0 1 13 470.396 0.002369 Thiophenic compounds
1041 32 40 0 0 1 13 456.38 0.00277 Thiophenic compounds
1042 31 38 0 0 1 13 442.364 0.000758 Thiophenic compounds
1043 30 36 0 0 1 13 428.348 0.001013 Thiophenic compounds
1044 29 34 0 0 1 13 414.332 0.004902 Thiophenic compounds
1045 28 32 0 0 1 13 400.316 0.0063 Thiophenic compounds
1046 27 30 0 0 1 13 386.3 0.002305 Thiophenic compounds
1047 26 28 0 0 1 13 372.284 0.002459 Thiophenic compounds
1048 25 26 0 0 1 13 358.268 0.003078 Thiophenic compounds
1049 24 24 0 0 1 13 344.252 0.010822 Thiophenic compounds
1050 23 22 0 0 1 13 330.236 0.002532 Thiophenic compounds
1051 22 20 0 0 1 13 316.22 0.008215 Thiophenic compounds
1052 21 18 0 0 1 13 302.204 0.001557 Thiophenic compounds
1053 20 16 0 0 1 13 288.188 0.00081 Thiophenic compounds
1054 19 14 0 0 1 13 274.172 0.001672 Thiophenic compounds
1055 18 12 0 0 1 13 260.156 0.00125 Thiophenic compounds
1056 17 10 0 0 1 13 246.14 0.000856 Thiophenic compounds
1057 16 8 0 0 1 13 232.124 0.00045 Thiophenic compounds
1058 46 66 0 0 1 14 650.588 0.000437 Thiophenic compounds
1059 43 60 0 0 1 14 608.54 0.000446 Thiophenic compounds
1060 42 58 0 0 1 14 594.524 0.000568 Thiophenic compounds
1061 41 56 0 0 1 14 580.508 0.000704 Thiophenic compounds
1062 40 54 0 0 1 14 566.492 0.000992 Thiophenic compounds
1063 39 52 0 0 1 14 552.476 0.001107 Thiophenic compounds
1064 38 50 0 0 1 14 538.46 0.001054 Thiophenic compounds
1065 37 48 0 0 1 14 524.444 0.001478 Thiophenic compounds
1066 36 46 0 0 1 14 510.428 0.001562 Thiophenic compounds
1067 35 44 0 0 1 14 496.412 0.001996 Thiophenic compounds
1068 34 42 0 0 1 14 482.396 0.002186 Thiophenic compounds
1069 33 40 0 0 1 14 468.38 0.002487 Thiophenic compounds
1070 32 38 0 0 1 14 454.364 0.000483 Thiophenic compounds
1071 31 36 0 0 1 14 440.348 0.00284 Thiophenic compounds
1072 30 34 0 0 1 14 426.332 0.000821 Thiophenic compounds
1073 29 32 0 0 1 14 412.316 0.003289 Thiophenic compounds
1074 28 30 0 0 1 14 398.3 0.003415 Thiophenic compounds
1075 27 28 0 0 1 14 384.284 0.001002 Thiophenic compounds
1076 26 26 0 0 1 14 370.268 0.001178 Thiophenic compounds
1077 25 24 0 0 1 14 356.252 0.001541 Thiophenic compounds
1078 24 22 0 0 1 14 342.236 0.001196 Thiophenic compounds
1079 23 20 0 0 1 14 328.22 0.001143 Thiophenic compounds
1080 22 18 0 0 1 14 314.204 0.004055 Thiophenic compounds
1081 21 16 0 0 1 14 300.188 0.002837 Thiophenic compounds
1082 20 14 0 0 1 14 286.172 0.001905 Thiophenic compounds
1083 19 12 0 0 1 14 272.156 0.001232 Thiophenic compounds
1084 18 10 0 0 1 14 258.14 0.000314 Thiophenic compounds
1085 17 8 0 0 1 14 244.124 0.000312 Thiophenic compounds
1086 45 62 0 0 1 15 634.556 0.000424 Thiophenic compounds
1087 43 58 0 0 1 15 606.524 0.000419 Thiophenic compounds
1088 42 56 0 0 1 15 592.508 0.000555 Thiophenic compounds
1089 41 54 0 0 1 15 578.492 0.000919 Thiophenic compounds
1090 40 52 0 0 1 15 564.476 0.000837 Thiophenic compounds
1091 39 50 0 0 1 15 550.46 0.000966 Thiophenic compounds
1092 38 48 0 0 1 15 536.444 0.001171 Thiophenic compounds
1093 37 46 0 0 1 15 522.428 0.001439 Thiophenic compounds
1094 36 44 0 0 1 15 508.412 0.001583 Thiophenic compounds
1095 35 42 0 0 1 15 494.396 0.001467 Thiophenic compounds
1096 34 40 0 0 1 15 480.38 0.001884 Thiophenic compounds
1097 33 38 0 0 1 15 466.364 0.002085 Thiophenic compounds
1098 32 36 0 0 1 15 452.348 0.001936 Thiophenic compounds
1099 31 34 0 0 1 15 438.332 0.001737 Thiophenic compounds
1100 30 32 0 0 1 15 424.316 0.001845 Thiophenic compounds
1101 29 30 0 0 1 15 410.3 0.002233 Thiophenic compounds
1102 28 28 0 0 1 15 396.284 0.001906 Thiophenic compounds
1103 27 26 0 0 1 15 382.268 0.001671 Thiophenic compounds
1104 26 24 0 0 1 15 368.252 0.001518 Thiophenic compounds
1105 25 22 0 0 1 15 354.236 0.001104 Thiophenic compounds
1106 24 20 0 0 1 15 340.22 0.000917 Thiophenic compounds
1107 23 18 0 0 1 15 326.204 0.00069 Thiophenic compounds
1108 22 16 0 0 1 15 312.188 0.000467 Thiophenic compounds
1109 21 14 0 0 1 15 298.172 0.000319 Thiophenic compounds
1110 20 12 0 0 1 15 284.156 0.000299 Thiophenic compounds
1111 19 10 0 0 1 15 270.14 0.000344 Thiophenic compounds
1112 18 8 0 0 1 15 256.124 0.000351 Thiophenic compounds
1113 43 56 0 0 1 16 604.508 0.000531 Thiophenic compounds
1114 42 54 0 0 1 16 590.492 0.000867 Thiophenic compounds
1115 41 52 0 0 1 16 576.476 0.000714 Thiophenic compounds
1116 40 50 0 0 1 16 562.46 0.000914 Thiophenic compounds
1117 39 48 0 0 1 16 548.444 0.001275 Thiophenic compounds
1118 38 46 0 0 1 16 534.428 0.00135 Thiophenic compounds
1119 37 44 0 0 1 16 520.412 0.001266 Thiophenic compounds
1120 36 42 0 0 1 16 506.396 0.001527 Thiophenic compounds
1121 35 40 0 0 1 16 492.38 0.00138 Thiophenic compounds
1122 34 38 0 0 1 16 478.364 0.001482 Thiophenic compounds
1123 33 36 0 0 1 16 464.348 0.001471 Thiophenic compounds
1124 32 34 0 0 1 16 450.332 0.001597 Thiophenic compounds
1125 31 32 0 0 1 16 436.316 0.001746 Thiophenic compounds
1126 30 30 0 0 1 16 422.3 0.000769 Thiophenic compounds
1127 29 28 0 0 1 16 408.284 0.001149 Thiophenic compounds
1128 28 26 0 0 1 16 394.268 0.001648 Thiophenic compounds
1129 27 24 0 0 1 16 380.252 0.000704 Thiophenic compounds
1130 26 22 0 0 1 16 366.236 0.00189 Thiophenic compounds
1131 25 20 0 0 1 16 352.22 0.0015 Thiophenic compounds
1132 24 18 0 0 1 16 338.204 0.0003 Thiophenic compounds
1133 45 58 0 0 1 17 630.524 0.00053 Thiophenic compounds
1134 44 56 0 0 1 17 616.508 0.00049 Thiophenic compounds
1135 43 54 0 0 1 17 602.492 0.000527 Thiophenic compounds
1136 42 52 0 0 1 17 588.476 0.00073 Thiophenic compounds
1137 41 50 0 0 1 17 574.46 0.001239 Thiophenic compounds
1138 40 48 0 0 1 17 560.444 0.001137 Thiophenic compounds
1139 39 46 0 0 1 17 546.428 0.001189 Thiophenic compounds
1140 38 44 0 0 1 17 532.412 0.001316 Thiophenic compounds
1141 37 42 0 0 1 17 518.396 0.001338 Thiophenic compounds
1142 36 40 0 0 1 17 504.38 0.001527 Thiophenic compounds
1143 35 38 0 0 1 17 490.364 0.001422 Thiophenic compounds
1144 34 36 0 0 1 17 476.348 0.001785 Thiophenic compounds
1145 33 34 0 0 1 17 462.332 0.001072 Thiophenic compounds
1146 32 32 0 0 1 17 448.316 0.001028 Thiophenic compounds
1147 31 30 0 0 1 17 434.3 0.000989 Thiophenic compounds
1148 30 28 0 0 1 17 420.284 0.001354 Thiophenic compounds
1149 29 26 0 0 1 17 406.268 0.001104 Thiophenic compounds
1150 28 24 0 0 1 17 392.252 0.001066 Thiophenic compounds
1151 27 22 0 0 1 17 378.236 0.000915 Thiophenic compounds
1152 26 20 0 0 1 17 364.22 0.000538 Thiophenic compounds
1153 25 18 0 0 1 17 350.204 0.000404 Thiophenic compounds
1154 23 14 0 0 1 17 322.172 0.000228 Thiophenic compounds
1155 51 68 0 0 1 18 712.604 0.000464 Thiophenic compounds
1156 46 58 0 0 1 18 642.524 0.000512 Thiophenic compounds
1157 44 54 0 0 1 18 614.492 0.000422 Thiophenic compounds
1158 43 52 0 0 1 18 600.476 0.000632 Thiophenic compounds
1159 42 50 0 0 1 18 586.46 0.000783 Thiophenic compounds
1160 41 48 0 0 1 18 572.444 0.000832 Thiophenic compounds
1161 40 46 0 0 1 18 558.428 0.001103 Thiophenic compounds
1162 39 44 0 0 1 18 544.412 0.001074 Thiophenic compounds
1163 38 42 0 0 1 18 530.396 0.001283 Thiophenic compounds
1164 37 40 0 0 1 18 516.38 0.001263 Thiophenic compounds
1165 36 38 0 0 1 18 502.364 0.001136 Thiophenic compounds
1166 35 36 0 0 1 18 488.348 0.001023 Thiophenic compounds
1167 34 34 0 0 1 18 474.332 0.000724 Thiophenic compounds
1168 33 32 0 0 1 18 460.316 0.000747 Thiophenic compounds
1169 32 30 0 0 1 18 446.3 0.000545 Thiophenic compounds
1170 31 28 0 0 1 18 432.284 0.000517 Thiophenic compounds
1171 30 26 0 0 1 18 418.268 0.000409 Thiophenic compounds
1172 28 22 0 0 1 18 390.236 0.000357 Thiophenic compounds
1173 27 20 0 0 1 18 376.22 0.000349 Thiophenic compounds
1174 42 48 0 0 1 19 584.444 0.000611 Thiophenic compounds
1175 40 44 0 0 1 19 556.412 0.001088 Thiophenic compounds
1176 39 42 0 0 1 19 542.396 0.000914 Thiophenic compounds
1177 38 40 0 0 1 19 528.38 0.001046 Thiophenic compounds
1178 37 38 0 0 1 19 514.364 0.001198 Thiophenic compounds
1179 36 36 0 0 1 19 500.348 0.000661 Thiophenic compounds
1180 35 34 0 0 1 19 486.332 0.000706 Thiophenic compounds
1181 34 32 0 0 1 19 472.316 0.000544 Thiophenic compounds
1182 32 28 0 0 1 19 444.284 0.000403 Thiophenic compounds
1183 31 26 0 0 1 19 430.268 0.000386 Thiophenic compounds
1184 29 22 0 0 1 19 402.236 0.000362 Thiophenic compounds
1185 32 64 0 0 1 1 480.572 3.9e-05 Sulfidic compounds
1186 31 62 0 0 1 1 466.556 5.5e-05 Sulfidic compounds
1187 29 58 0 0 1 1 438.524 6.3e-05 Sulfidic compounds
1188 28 56 0 0 1 1 424.508 0.00051 Sulfidic compounds
1189 27 54 0 0 1 1 410.492 0.001094 Sulfidic compounds
1190 26 52 0 0 1 1 396.476 0.002753 Sulfidic compounds
1191 25 50 0 0 1 1 382.46 0.036519 Sulfidic compounds
1192 24 48 0 0 1 1 368.444 0.011856 Sulfidic compounds
1193 23 46 0 0 1 1 354.428 0.016221 Sulfidic compounds
1194 22 44 0 0 1 1 340.412 0.021821 Sulfidic compounds
1195 21 42 0 0 1 1 326.396 0.029257 Sulfidic compounds
1196 20 40 0 0 1 1 312.38 0.062006 Sulfidic compounds
1197 19 38 0 0 1 1 298.364 0.04644 Sulfidic compounds
1198 18 36 0 0 1 1 284.348 0.048968 Sulfidic compounds
1199 17 34 0 0 1 1 270.332 0.018241 Sulfidic compounds
1200 16 32 0 0 1 1 256.316 0.007998 Sulfidic compounds
1201 15 30 0 0 1 1 242.3 0.002583 Sulfidic compounds
1202 14 28 0 0 1 1 228.284 0.000372 Sulfidic compounds
1203 13 26 0 0 1 1 214.268 4.6e-05 Sulfidic compounds
1204 12 24 0 0 1 1 200.252 0.000139 Sulfidic compounds
1205 11 22 0 0 1 1 186.236 0.000144 Sulfidic compounds
1206 10 20 0 0 1 1 172.22 0.000169 Sulfidic compounds
1207 34 66 0 0 1 2 506.588 5.6e-05 Sulfidic compounds
1208 31 60 0 0 1 2 464.54 0.000101 Sulfidic compounds
1209 30 58 0 0 1 2 450.524 0.000155 Sulfidic compounds
1210 29 56 0 0 1 2 436.508 0.000319 Sulfidic compounds
1211 28 54 0 0 1 2 422.492 0.00058 Sulfidic compounds
1212 27 52 0 0 1 2 408.476 0.001734 Sulfidic compounds
1213 26 50 0 0 1 2 394.46 0.003398 Sulfidic compounds
1214 25 48 0 0 1 2 380.444 0.009323 Sulfidic compounds
1215 24 46 0 0 1 2 366.428 0.012954 Sulfidic compounds
1216 23 44 0 0 1 2 352.412 0.012117 Sulfidic compounds
1217 22 42 0 0 1 2 338.396 0.021506 Sulfidic compounds
1218 21 40 0 0 1 2 324.38 0.023454 Sulfidic compounds
1219 20 38 0 0 1 2 310.364 0.027563 Sulfidic compounds
1220 19 36 0 0 1 2 296.348 0.026297 Sulfidic compounds
1221 18 34 0 0 1 2 282.332 0.019582 Sulfidic compounds
1222 17 32 0 0 1 2 268.316 0.005778 Sulfidic compounds
1223 16 30 0 0 1 2 254.3 0.001937 Sulfidic compounds
1224 15 28 0 0 1 2 240.284 0.000493 Sulfidic compounds
1225 14 26 0 0 1 2 226.268 0.000401 Sulfidic compounds
1226 13 24 0 0 1 2 212.252 9.6e-05 Sulfidic compounds
1227 12 22 0 0 1 2 198.236 0.000321 Sulfidic compounds
1228 11 20 0 0 1 2 184.22 0.000244 Sulfidic compounds
1229 10 18 0 0 1 2 170.204 7e-05 Sulfidic compounds
1230 35 66 0 0 1 3 518.588 5.7e-05 Sulfidic compounds
1231 33 62 0 0 1 3 490.556 7.9e-05 Sulfidic compounds
1232 32 60 0 0 1 3 476.54 8e-05 Sulfidic compounds
1233 31 58 0 0 1 3 462.524 0.000138 Sulfidic compounds
1234 30 56 0 0 1 3 448.508 0.00025 Sulfidic compounds
1235 29 54 0 0 1 3 434.492 0.000552 Sulfidic compounds
1236 28 52 0 0 1 3 420.476 0.000834 Sulfidic compounds
1237 27 50 0 0 1 3 406.46 0.001823 Sulfidic compounds
1238 26 48 0 0 1 3 392.444 0.004196 Sulfidic compounds
1239 25 46 0 0 1 3 378.428 0.007984 Sulfidic compounds
1240 24 44 0 0 1 3 364.412 0.013034 Sulfidic compounds
1241 23 42 0 0 1 3 350.396 0.012067 Sulfidic compounds
1242 22 40 0 0 1 3 336.38 0.021779 Sulfidic compounds
1243 21 38 0 0 1 3 322.364 0.024147 Sulfidic compounds
1244 20 36 0 0 1 3 308.348 0.022689 Sulfidic compounds
1245 19 34 0 0 1 3 294.332 0.017164 Sulfidic compounds
1246 18 32 0 0 1 3 280.316 0.011204 Sulfidic compounds
1247 17 30 0 0 1 3 266.3 0.002984 Sulfidic compounds
1248 16 28 0 0 1 3 252.284 0.001019 Sulfidic compounds
1249 15 26 0 0 1 3 238.268 0.000132 Sulfidic compounds
1250 14 24 0 0 1 3 224.252 0.000127 Sulfidic compounds
1251 13 22 0 0 1 3 210.236 0.000218 Sulfidic compounds
1252 12 20 0 0 1 3 196.22 5.9e-05 Sulfidic compounds
1253 11 18 0 0 1 3 182.204 9e-05 Sulfidic compounds
1254 34 62 0 0 1 4 502.556 6e-05 Sulfidic compounds
1255 33 60 0 0 1 4 488.54 6e-05 Sulfidic compounds
1256 32 58 0 0 1 4 474.524 0.000142 Sulfidic compounds
1257 31 56 0 0 1 4 460.508 0.00013 Sulfidic compounds
1258 30 54 0 0 1 4 446.492 0.000236 Sulfidic compounds
1259 29 52 0 0 1 4 432.476 0.000601 Sulfidic compounds
1260 28 50 0 0 1 4 418.46 0.000792 Sulfidic compounds
1261 27 48 0 0 1 4 404.444 0.001658 Sulfidic compounds
1262 26 46 0 0 1 4 390.428 0.002766 Sulfidic compounds
1263 25 44 0 0 1 4 376.412 0.004255 Sulfidic compounds
1264 24 42 0 0 1 4 362.396 0.007677 Sulfidic compounds
1265 23 40 0 0 1 4 348.38 0.008234 Sulfidic compounds
1266 22 38 0 0 1 4 334.364 0.011722 Sulfidic compounds
1267 21 36 0 0 1 4 320.348 0.013966 Sulfidic compounds
1268 20 34 0 0 1 4 306.332 0.012742 Sulfidic compounds
1269 19 32 0 0 1 4 292.316 0.008493 Sulfidic compounds
1270 18 30 0 0 1 4 278.3 0.00412 Sulfidic compounds
1271 17 28 0 0 1 4 264.284 0.001138 Sulfidic compounds
1272 16 26 0 0 1 4 250.268 0.000383 Sulfidic compounds
1273 15 24 0 0 1 4 236.252 1.4e-05 Sulfidic compounds
1274 14 22 0 0 1 4 222.236 3.2e-05 Sulfidic compounds
1275 13 20 0 0 1 4 208.22 1.5e-05 Sulfidic compounds
1276 12 18 0 0 1 4 194.204 2.1e-05 Sulfidic compounds
1277 11 16 0 0 1 4 180.188 5.5e-05 Sulfidic compounds
1278 10 14 0 0 1 4 166.172 9e-06 Sulfidic compounds
1279 35 62 0 0 1 5 514.556 3e-05 Sulfidic compounds
1280 32 56 0 0 1 5 472.508 9.7e-05 Sulfidic compounds
1281 31 54 0 0 1 5 458.492 0.000159 Sulfidic compounds
1282 30 52 0 0 1 5 444.476 0.00042 Sulfidic compounds
1283 29 50 0 0 1 5 430.46 0.000333 Sulfidic compounds
1284 28 48 0 0 1 5 416.444 0.000781 Sulfidic compounds
1285 27 46 0 0 1 5 402.428 0.001516 Sulfidic compounds
1286 26 44 0 0 1 5 388.412 0.002046 Sulfidic compounds
1287 25 42 0 0 1 5 374.396 0.003303 Sulfidic compounds
1288 24 40 0 0 1 5 360.38 0.005039 Sulfidic compounds
1289 23 38 0 0 1 5 346.364 0.005745 Sulfidic compounds
1290 22 36 0 0 1 5 332.348 0.007541 Sulfidic compounds
1291 21 34 0 0 1 5 318.332 0.008094 Sulfidic compounds
1292 20 32 0 0 1 5 304.316 0.007184 Sulfidic compounds
1293 19 30 0 0 1 5 290.3 0.004575 Sulfidic compounds
1294 18 28 0 0 1 5 276.284 0.002371 Sulfidic compounds
1295 17 26 0 0 1 5 262.268 0.000793 Sulfidic compounds
1296 16 24 0 0 1 5 248.252 0.000385 Sulfidic compounds
1297 15 22 0 0 1 5 234.236 9.6e-05 Sulfidic compounds
1298 14 20 0 0 1 5 220.22 5.4e-05 Sulfidic compounds
1299 13 18 0 0 1 5 206.204 3.8e-05 Sulfidic compounds
1300 12 16 0 0 1 5 192.188 1.1e-05 Sulfidic compounds
1301 33 56 0 0 1 6 484.508 5.2e-05 Sulfidic compounds
1302 31 52 0 0 1 6 456.476 6.3e-05 Sulfidic compounds
1303 30 50 0 0 1 6 442.46 0.000318 Sulfidic compounds
1304 29 48 0 0 1 6 428.444 0.000239 Sulfidic compounds
1305 28 46 0 0 1 6 414.428 0.000331 Sulfidic compounds
1306 27 44 0 0 1 6 400.412 0.000804 Sulfidic compounds
1307 26 42 0 0 1 6 386.396 0.001316 Sulfidic compounds
1308 25 40 0 0 1 6 372.38 0.001828 Sulfidic compounds
1309 24 38 0 0 1 6 358.364 0.002657 Sulfidic compounds
1310 23 36 0 0 1 6 344.348 0.003084 Sulfidic compounds
1311 22 34 0 0 1 6 330.332 0.00518 Sulfidic compounds
1312 21 32 0 0 1 6 316.316 0.004244 Sulfidic compounds
1313 20 30 0 0 1 6 302.3 0.00311 Sulfidic compounds
1314 19 28 0 0 1 6 288.284 0.002243 Sulfidic compounds
1315 18 26 0 0 1 6 274.268 0.001618 Sulfidic compounds
1316 17 24 0 0 1 6 260.252 0.000832 Sulfidic compounds
1317 16 22 0 0 1 6 246.236 0.000896 Sulfidic compounds
1318 15 20 0 0 1 6 232.22 0.000577 Sulfidic compounds
1319 13 16 0 0 1 6 204.188 3.7e-05 Sulfidic compounds
1320 12 14 0 0 1 6 190.172 2.2e-05 Sulfidic compounds
1321 11 12 0 0 1 6 176.156 1.6e-05 Sulfidic compounds
1322 33 54 0 0 1 7 482.492 3.3e-05 Sulfidic compounds
1323 32 52 0 0 1 7 468.476 3.2e-05 Sulfidic compounds
1324 30 48 0 0 1 7 440.444 3.2e-05 Sulfidic compounds
1325 29 46 0 0 1 7 426.428 0.00023 Sulfidic compounds
1326 28 44 0 0 1 7 412.412 0.000132 Sulfidic compounds
1327 27 42 0 0 1 7 398.396 0.000316 Sulfidic compounds
1328 26 40 0 0 1 7 384.38 0.000639 Sulfidic compounds
1329 25 38 0 0 1 7 370.364 0.001134 Sulfidic compounds
1330 24 36 0 0 1 7 356.348 0.001583 Sulfidic compounds
1331 23 34 0 0 1 7 342.332 0.001729 Sulfidic compounds
1332 22 32 0 0 1 7 328.316 0.002484 Sulfidic compounds
1333 21 30 0 0 1 7 314.3 0.002795 Sulfidic compounds
1334 20 28 0 0 1 7 300.284 0.003013 Sulfidic compounds
1335 19 26 0 0 1 7 286.268 0.002184 Sulfidic compounds
1336 18 24 0 0 1 7 272.252 0.00094 Sulfidic compounds
1337 17 22 0 0 1 7 258.236 0.001004 Sulfidic compounds
1338 16 20 0 0 1 7 244.22 0.000212 Sulfidic compounds
1339 15 18 0 0 1 7 230.204 0.000246 Sulfidic compounds
1340 14 16 0 0 1 7 216.188 0.0001 Sulfidic compounds
1341 13 14 0 0 1 7 202.172 0.000499 Sulfidic compounds
1342 11 10 0 0 1 7 174.14 1.8e-05 Sulfidic compounds
1343 30 46 0 0 1 8 438.428 8.8e-05 Sulfidic compounds
1344 29 44 0 0 1 8 424.412 0.000163 Sulfidic compounds
1345 28 42 0 0 1 8 410.396 8e-05 Sulfidic compounds
1346 27 40 0 0 1 8 396.38 0.000279 Sulfidic compounds
1347 26 38 0 0 1 8 382.364 0.000353 Sulfidic compounds
1348 25 36 0 0 1 8 368.348 0.000482 Sulfidic compounds
1349 24 34 0 0 1 8 354.332 0.000876 Sulfidic compounds
1350 23 32 0 0 1 8 340.316 0.000874 Sulfidic compounds
1351 22 30 0 0 1 8 326.3 0.001078 Sulfidic compounds
1352 21 28 0 0 1 8 312.284 0.001188 Sulfidic compounds
1353 20 26 0 0 1 8 298.268 0.000931 Sulfidic compounds
1354 19 24 0 0 1 8 284.252 0.000369 Sulfidic compounds
1355 18 22 0 0 1 8 270.236 0.002026 Sulfidic compounds
1356 17 20 0 0 1 8 256.22 0.001472 Sulfidic compounds
1357 16 18 0 0 1 8 242.204 0.000326 Sulfidic compounds
1358 15 16 0 0 1 8 228.188 0.001692 Sulfidic compounds
1359 14 14 0 0 1 8 214.172 0.000899 Sulfidic compounds
1360 13 12 0 0 1 8 200.156 0.000309 Sulfidic compounds
1361 36 56 0 0 1 9 520.508 8.9e-05 Sulfidic compounds
1362 35 54 0 0 1 9 506.492 3.3e-05 Sulfidic compounds
1363 34 52 0 0 1 9 492.476 3.1e-05 Sulfidic compounds
1364 30 44 0 0 1 9 436.412 9e-05 Sulfidic compounds
1365 29 42 0 0 1 9 422.396 8.1e-05 Sulfidic compounds
1366 28 40 0 0 1 9 408.38 0.000132 Sulfidic compounds
1367 27 38 0 0 1 9 394.364 0.000156 Sulfidic compounds
1368 26 36 0 0 1 9 380.348 0.000284 Sulfidic compounds
1369 25 34 0 0 1 9 366.332 0.000492 Sulfidic compounds
1370 24 32 0 0 1 9 352.316 0.000332 Sulfidic compounds
1371 23 30 0 0 1 9 338.3 0.000597 Sulfidic compounds
1372 22 28 0 0 1 9 324.284 0.000351 Sulfidic compounds
1373 21 26 0 0 1 9 310.268 0.00054 Sulfidic compounds
1374 20 24 0 0 1 9 296.252 0.000345 Sulfidic compounds
1375 19 22 0 0 1 9 282.236 0.000447 Sulfidic compounds
1376 18 20 0 0 1 9 268.22 0.000871 Sulfidic compounds
1377 10 22 2 0 0 0 174.176 2.2e-05 Acidic fraction
1378 14 30 2 0 0 0 230.24 4e-05 Acidic fraction
1379 15 32 2 0 0 0 244.256 4.3e-05 Acidic fraction
1380 16 34 1 0 0 0 242.272 3.1e-05 Acidic fraction
1381 16 34 2 0 0 0 258.272 4.6e-05 Acidic fraction
1382 7 14 2 0 0 1 130.112 2.2e-05 Acidic fraction
1383 8 16 2 0 0 1 144.128 3.7e-05 Acidic fraction
1384 9 18 2 0 0 1 158.144 0.000768 Acidic fraction
1385 10 20 1 0 0 1 156.16 1.8e-05 Acidic fraction
1386 10 20 2 0 0 1 172.16 0.000985 Acidic fraction
1387 11 22 2 0 0 1 186.176 0.002383 Acidic fraction
1388 12 24 1 0 0 1 184.192 3.9e-05 Acidic fraction
1389 12 24 2 0 0 1 200.192 0.004547 Acidic fraction
1390 13 26 1 0 0 1 198.208 2.7e-05 Acidic fraction
1391 13 26 2 0 0 1 214.208 0.008115 Acidic fraction
1392 14 28 1 0 0 1 212.224 3.4e-05 Acidic fraction
1393 14 28 2 0 0 1 228.224 0.024523 Acidic fraction
1394 15 30 1 0 0 1 226.24 7.2e-05 Acidic fraction
1395 15 30 2 0 0 1 242.24 0.017431 Acidic fraction
1396 16 32 1 0 0 1 240.256 4.1e-05 Acidic fraction
1397 16 32 2 0 0 1 256.256 0.152563 Acidic fraction
1398 17 34 2 0 0 1 270.272 0.012034 Acidic fraction
1399 18 36 1 0 0 1 268.288 5.7e-05 Acidic fraction
1400 18 36 2 0 0 1 284.288 0.050842 Acidic fraction
1401 19 38 2 0 0 1 298.304 0.004434 Acidic fraction
1402 20 40 2 0 0 1 312.32 0.006647 Acidic fraction
1403 21 42 2 0 0 1 326.336 0.001272 Acidic fraction
1404 22 44 2 0 0 1 340.352 0.001382 Acidic fraction
1405 23 46 2 0 0 1 354.368 0.000548 Acidic fraction
1406 7 12 1 0 0 2 112.096 1.6e-05 Acidic fraction
1407 7 12 2 0 0 2 128.096 1.5e-05 Acidic fraction
1408 8 14 1 0 0 2 126.112 2.5e-05 Acidic fraction
1409 8 14 2 0 0 2 142.112 1.8e-05 Acidic fraction
1410 9 16 1 0 0 2 140.128 1.5e-05 Acidic fraction
1411 9 16 2 0 0 2 156.128 4.2e-05 Acidic fraction
1412 10 18 2 0 0 2 170.144 0.000492 Acidic fraction
1413 11 20 1 0 0 2 168.16 2.9e-05 Acidic fraction
1414 11 20 2 0 0 2 184.16 0.002026 Acidic fraction
1415 12 22 1 0 0 2 182.176 4.7e-05 Acidic fraction
1416 12 22 2 0 0 2 198.176 0.002609 Acidic fraction
1417 13 24 2 0 0 2 212.192 0.00594 Acidic fraction
1418 14 26 1 0 0 2 210.208 2.9e-05 Acidic fraction
1419 14 26 2 0 0 2 226.208 0.007347 Acidic fraction
1420 15 28 1 0 0 2 224.224 4.9e-05 Acidic fraction
1421 15 28 2 0 0 2 240.224 0.003317 Acidic fraction
1422 16 30 1 0 0 2 238.24 4.3e-05 Acidic fraction
1423 16 30 2 0 0 2 254.24 0.007818 Acidic fraction
1424 17 32 1 0 0 2 252.256 3.7e-05 Acidic fraction
1425 17 32 2 0 0 2 268.256 0.003025 Acidic fraction
1426 18 34 2 0 0 2 282.272 0.009483 Acidic fraction
1427 19 36 1 0 0 2 280.288 3.8e-05 Acidic fraction
1428 19 36 2 0 0 2 296.288 0.001 Acidic fraction
1429 20 38 2 0 0 2 310.304 0.000779 Acidic fraction
1430 21 40 2 0 0 2 324.32 0.000252 Acidic fraction
1431 22 42 2 0 0 2 338.336 0.000192 Acidic fraction
1432 23 44 2 0 0 2 352.352 5.3e-05 Acidic fraction
1433 7 10 2 0 0 3 126.08 1.9e-05 Acidic fraction
1434 8 12 2 0 0 3 140.096 1.6e-05 Acidic fraction
1435 9 14 1 0 0 3 138.112 1.5e-05 Acidic fraction
1436 9 14 2 0 0 3 154.112 5.2e-05 Acidic fraction
1437 10 16 1 0 0 3 152.128 1.9e-05 Acidic fraction
1438 10 16 2 0 0 3 168.128 0.000129 Acidic fraction
1439 11 18 1 0 0 3 166.144 1.9e-05 Acidic fraction
1440 11 18 2 0 0 3 182.144 0.000551 Acidic fraction
1441 12 20 1 0 0 3 180.16 3.8e-05 Acidic fraction
1442 12 20 2 0 0 3 196.16 0.001648 Acidic fraction
1443 13 22 1 0 0 3 194.176 3.5e-05 Acidic fraction
1444 13 22 2 0 0 3 210.176 0.005616 Acidic fraction
1445 14 24 1 0 0 3 208.192 2.7e-05 Acidic fraction
1446 14 24 2 0 0 3 224.192 0.009659 Acidic fraction
1447 15 26 1 0 0 3 222.208 3.8e-05 Acidic fraction
1448 15 26 2 0 0 3 238.208 0.008507 Acidic fraction
1449 16 28 1 0 0 3 236.224 4.1e-05 Acidic fraction
1450 16 28 2 0 0 3 252.224 0.005672 Acidic fraction
1451 17 30 2 0 0 3 266.24 0.003095 Acidic fraction
1452 18 32 2 0 0 3 280.256 0.002837 Acidic fraction
1453 19 34 2 0 0 3 294.272 0.000782 Acidic fraction
1454 20 36 2 0 0 3 308.288 0.000527 Acidic fraction
1455 21 38 2 0 0 3 322.304 0.000216 Acidic fraction
1456 22 40 2 0 0 3 336.32 9.1e-05 Acidic fraction
1457 8 10 1 0 0 4 122.08 1.3e-05 Acidic fraction
1458 8 10 2 0 0 4 138.08 2.7e-05 Acidic fraction
1459 9 12 1 0 0 4 136.096 2.7e-05 Acidic fraction
1460 9 12 2 0 0 4 152.096 4.3e-05 Acidic fraction
1461 10 14 1 0 0 4 150.112 3.8e-05 Acidic fraction
1462 10 14 2 0 0 4 166.112 0.000109 Acidic fraction
1463 11 16 1 0 0 4 164.128 0.001179 Acidic fraction
1464 11 16 2 0 0 4 180.128 0.000166 Acidic fraction
1465 12 18 1 0 0 4 178.144 0.003119 Acidic fraction
1466 12 18 2 0 0 4 194.144 0.000317 Acidic fraction
1467 13 20 1 0 0 4 192.16 0.003738 Acidic fraction
1468 13 20 2 0 0 4 208.16 0.002044 Acidic fraction
1469 14 22 1 0 0 4 206.176 0.007075 Acidic fraction
1470 14 22 2 0 0 4 222.176 0.010649 Acidic fraction
1471 15 24 1 0 0 4 220.192 0.001956 Acidic fraction
1472 15 24 2 0 0 4 236.192 0.008647 Acidic fraction
1473 16 26 1 0 0 4 234.208 0.001158 Acidic fraction
1474 16 26 2 0 0 4 250.208 0.006 Acidic fraction
1475 17 28 1 0 0 4 248.224 0.000849 Acidic fraction
1476 17 28 2 0 0 4 264.224 0.004223 Acidic fraction
1477 18 30 1 0 0 4 262.24 0.001346 Acidic fraction
1478 18 30 2 0 0 4 278.24 0.001503 Acidic fraction
1479 19 32 1 0 0 4 276.256 0.001057 Acidic fraction
1480 19 32 2 0 0 4 292.256 0.000602 Acidic fraction
1481 20 34 1 0 0 4 290.272 0.000992 Acidic fraction
1482 20 34 2 0 0 4 306.272 0.000322 Acidic fraction
1483 21 36 1 0 0 4 304.288 0.000674 Acidic fraction
1484 21 36 2 0 0 4 320.288 0.000143 Acidic fraction
1485 22 38 1 0 0 4 318.304 0.00049 Acidic fraction
1486 22 38 2 0 0 4 334.304 5.6e-05 Acidic fraction
1487 23 40 1 0 0 4 332.32 0.000197 Acidic fraction
1488 23 40 2 0 0 4 348.32 4.7e-05 Acidic fraction
1489 24 42 1 0 0 4 346.336 0.000102 Acidic fraction
1490 9 10 1 0 0 5 134.08 1.6e-05 Acidic fraction
1491 10 12 1 0 0 5 148.096 2.2e-05 Acidic fraction
1492 10 12 2 0 0 5 164.096 0.0001 Acidic fraction
1493 11 14 1 0 0 5 162.112 0.000325 Acidic fraction
1494 11 14 2 0 0 5 178.112 0.000336 Acidic fraction
1495 12 16 1 0 0 5 176.128 0.001765 Acidic fraction
1496 12 16 2 0 0 5 192.128 0.000313 Acidic fraction
1497 13 18 1 0 0 5 190.144 0.003155 Acidic fraction
1498 13 18 2 0 0 5 206.144 0.000613 Acidic fraction
1499 14 20 1 0 0 5 204.16 0.00156 Acidic fraction
1500 14 20 2 0 0 5 220.16 0.000971 Acidic fraction
1501 15 22 1 0 0 5 218.176 0.001441 Acidic fraction
1502 15 22 2 0 0 5 234.176 0.002565 Acidic fraction
1503 16 24 1 0 0 5 232.192 0.00099 Acidic fraction
1504 16 24 2 0 0 5 248.192 0.00266 Acidic fraction
1505 17 26 1 0 0 5 246.208 0.000769 Acidic fraction
1506 17 26 2 0 0 5 262.208 0.00231 Acidic fraction
1507 18 28 1 0 0 5 260.224 0.001027 Acidic fraction
1508 18 28 2 0 0 5 276.224 0.000863 Acidic fraction
1509 19 30 1 0 0 5 274.24 0.000657 Acidic fraction
1510 19 30 2 0 0 5 290.24 0.000438 Acidic fraction
1511 20 32 1 0 0 5 288.256 0.00078 Acidic fraction
1512 20 32 2 0 0 5 304.256 0.000273 Acidic fraction
1513 21 34 1 0 0 5 302.272 0.000507 Acidic fraction
1514 21 34 2 0 0 5 318.272 0.000105 Acidic fraction
1515 22 36 1 0 0 5 316.288 0.000298 Acidic fraction
1516 22 36 2 0 0 5 332.288 6.3e-05 Acidic fraction
1517 23 38 1 0 0 5 330.304 0.000165 Acidic fraction
1518 24 40 1 0 0 5 344.32 5.5e-05 Acidic fraction
1519 25 42 1 0 0 5 358.336 5.7e-05 Acidic fraction
1520 10 10 2 0 0 6 162.08 3.4e-05 Acidic fraction
1521 11 12 1 0 0 6 160.096 2.9e-05 Acidic fraction
1522 11 12 2 0 0 6 176.096 9.2e-05 Acidic fraction
1523 12 14 1 0 0 6 174.112 0.000106 Acidic fraction
1524 12 14 2 0 0 6 190.112 0.000186 Acidic fraction
1525 13 16 1 0 0 6 188.128 0.000176 Acidic fraction
1526 13 16 2 0 0 6 204.128 0.000326 Acidic fraction
1527 14 18 1 0 0 6 202.144 0.00022 Acidic fraction
1528 14 18 2 0 0 6 218.144 0.00038 Acidic fraction
1529 15 20 1 0 0 6 216.16 0.000338 Acidic fraction
1530 15 20 2 0 0 6 232.16 0.0006 Acidic fraction
1531 16 22 1 0 0 6 230.176 0.000656 Acidic fraction
1532 16 22 2 0 0 6 246.176 0.000775 Acidic fraction
1533 17 24 1 0 0 6 244.192 0.000533 Acidic fraction
1534 17 24 2 0 0 6 260.192 0.001344 Acidic fraction
1535 18 26 1 0 0 6 258.208 0.000772 Acidic fraction
1536 18 26 2 0 0 6 274.208 0.000666 Acidic fraction
1537 19 28 1 0 0 6 272.224 0.00071 Acidic fraction
1538 19 28 2 0 0 6 288.224 0.00049 Acidic fraction
1539 20 30 1 0 0 6 286.24 0.000715 Acidic fraction
1540 20 30 2 0 0 6 302.24 0.000375 Acidic fraction
1541 21 32 1 0 0 6 300.256 0.000386 Acidic fraction
1542 21 32 2 0 0 6 316.256 7.9e-05 Acidic fraction
1543 22 34 1 0 0 6 314.272 0.000268 Acidic fraction
1544 22 34 2 0 0 6 330.272 5.8e-05 Acidic fraction
1545 23 36 1 0 0 6 328.288 8.7e-05 Acidic fraction
1546 24 38 1 0 0 6 342.304 9.2e-05 Acidic fraction
1547 11 10 1 0 0 7 158.08 3.3e-05 Acidic fraction
1548 11 10 2 0 0 7 174.08 2.2e-05 Acidic fraction
1549 12 12 1 0 0 7 172.096 6.3e-05 Acidic fraction
1550 12 12 2 0 0 7 188.096 4e-05 Acidic fraction
1551 13 14 1 0 0 7 186.112 6e-05 Acidic fraction
1552 13 14 2 0 0 7 202.112 5.3e-05 Acidic fraction
1553 14 16 1 0 0 7 200.128 3.9e-05 Acidic fraction
1554 14 16 2 0 0 7 216.128 0.000121 Acidic fraction
1555 15 18 1 0 0 7 214.144 6.9e-05 Acidic fraction
1556 15 18 2 0 0 7 230.144 0.00033 Acidic fraction
1557 16 20 1 0 0 7 228.16 9.7e-05 Acidic fraction
1558 16 20 2 0 0 7 244.16 0.000582 Acidic fraction
1559 17 22 1 0 0 7 242.176 0.000121 Acidic fraction
1560 17 22 2 0 0 7 258.176 0.001197 Acidic fraction
1561 18 24 1 0 0 7 256.192 0.000207 Acidic fraction
1562 18 24 2 0 0 7 272.192 0.000936 Acidic fraction
1563 19 26 1 0 0 7 270.208 0.000281 Acidic fraction
1564 19 26 2 0 0 7 286.208 0.000505 Acidic fraction
1565 20 28 1 0 0 7 284.224 0.000315 Acidic fraction
1566 20 28 2 0 0 7 300.224 0.000585 Acidic fraction
1567 21 30 1 0 0 7 298.24 0.000218 Acidic fraction
1568 21 30 2 0 0 7 314.24 0.000329 Acidic fraction
1569 22 32 1 0 0 7 312.256 0.000127 Acidic fraction
1570 22 32 2 0 0 7 328.256 5.3e-05 Acidic fraction
1571 23 34 1 0 0 7 326.272 7e-05 Acidic fraction
1572 28 44 1 0 0 7 396.352 5.3e-05 Acidic fraction
1573 12 10 1 0 0 8 170.08 5.8e-05 Acidic fraction
1574 12 10 2 0 0 8 186.08 6.9e-05 Acidic fraction
1575 13 12 1 0 0 8 184.096 0.000245 Acidic fraction
1576 13 12 2 0 0 8 200.096 3.4e-05 Acidic fraction
1577 14 14 1 0 0 8 198.112 0.000298 Acidic fraction
1578 14 14 2 0 0 8 214.112 0.000124 Acidic fraction
1579 15 16 1 0 0 8 212.128 0.000468 Acidic fraction
1580 15 16 2 0 0 8 228.128 0.000308 Acidic fraction
1581 16 18 1 0 0 8 226.144 0.000505 Acidic fraction
1582 16 18 2 0 0 8 242.144 0.000432 Acidic fraction
1583 17 20 1 0 0 8 240.16 0.000309 Acidic fraction
1584 17 20 2 0 0 8 256.16 0.000267 Acidic fraction
1585 18 22 1 0 0 8 254.176 0.000283 Acidic fraction
1586 18 22 2 0 0 8 270.176 0.000288 Acidic fraction
1587 19 24 1 0 0 8 268.192 0.000412 Acidic fraction
1588 19 24 2 0 0 8 284.192 0.000198 Acidic fraction
1589 20 26 1 0 0 8 282.208 0.000257 Acidic fraction
1590 20 26 2 0 0 8 298.208 0.00011 Acidic fraction
1591 21 28 1 0 0 8 296.224 0.000217 Acidic fraction
1592 21 28 2 0 0 8 312.224 4.9e-05 Acidic fraction
1593 22 30 1 0 0 8 310.24 0.000138 Acidic fraction
1594 23 32 1 0 0 8 324.256 8.2e-05 Acidic fraction
1595 14 12 1 0 0 9 196.096 3.2e-05 Acidic fraction
1596 14 12 2 0 0 9 212.096 6.2e-05 Acidic fraction
1597 15 14 1 0 0 9 210.112 7.2e-05 Acidic fraction
1598 15 14 2 0 0 9 226.112 2.9e-05 Acidic fraction
1599 16 16 1 0 0 9 224.128 0.000141 Acidic fraction
1600 16 16 2 0 0 9 240.128 6.8e-05 Acidic fraction
1601 17 18 1 0 0 9 238.144 0.00016 Acidic fraction
1602 17 18 2 0 0 9 254.144 8.1e-05 Acidic fraction
1603 18 20 1 0 0 9 252.16 0.00017 Acidic fraction
1604 18 20 2 0 0 9 268.16 9e-05 Acidic fraction
1605 19 22 1 0 0 9 266.176 0.000298 Acidic fraction
1606 19 22 2 0 0 9 282.176 6.8e-05 Acidic fraction
1607 20 24 1 0 0 9 280.192 0.000243 Acidic fraction
1608 20 24 2 0 0 9 296.192 8.2e-05 Acidic fraction
1609 21 26 1 0 0 9 294.208 0.000213 Acidic fraction
1610 22 28 1 0 0 9 308.224 0.000107 Acidic fraction
1611 23 30 1 0 0 9 322.24 5.9e-05 Acidic fraction
1612 24 32 1 0 0 9 336.256 5.2e-05 Acidic fraction
1613 24 32 2 0 0 9 352.256 0.000217 Acidic fraction
1614 15 12 2 0 0 10 224.096 3e-05 Acidic fraction
1615 18 18 1 0 0 10 250.144 4e-05 Acidic fraction
1616 18 18 2 0 0 10 266.144 4.9e-05 Acidic fraction
1617 19 20 1 0 0 10 264.16 6.3e-05 Acidic fraction
1618 19 20 2 0 0 10 280.16 5.1e-05 Acidic fraction
1619 20 22 1 0 0 10 278.176 0.000113 Acidic fraction
1620 21 24 1 0 0 10 292.192 0.000109 Acidic fraction
1621 22 26 1 0 0 10 306.208 5.5e-05 Acidic fraction
1622 23 28 1 0 0 10 320.224 4.2e-05 Acidic fraction
1623 24 30 1 0 0 10 334.24 4.4e-05 Acidic fraction
1624 15 10 1 0 0 11 206.08 2.7e-05 Acidic fraction
1625 16 12 1 0 0 11 220.096 4.6e-05 Acidic fraction
1626 17 14 1 0 0 11 234.112 5.8e-05 Acidic fraction
1627 18 16 1 0 0 11 248.128 7.1e-05 Acidic fraction
1628 19 18 1 0 0 11 262.144 0.000135 Acidic fraction
1629 19 18 2 0 0 11 278.144 3.8e-05 Acidic fraction
1630 20 20 1 0 0 11 276.16 0.000105 Acidic fraction
1631 21 22 1 0 0 11 290.176 8.4e-05 Acidic fraction
1632 22 24 1 0 0 11 304.192 4.6e-05 Acidic fraction
1633 22 24 2 0 0 11 320.192 4.5e-05 Acidic fraction
1634 20 18 1 0 0 12 274.144 5.2e-05 Acidic fraction