0 mol 4 unq 0 iso 0 dist 8.15534 5.12159 6.12485 5.69329 7.88748 4.10578 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.15534 10.7952 9.04027 5.69329 7.88748 6.87439 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 5.27589 10.0167 8.07914 4.2995 7.30688 10.1117 numMergedOcc 0
3 mol 21 unq 1 iso 0 dist 5.27589 10.0167 8.07914 5.73645 6.70786 9.53082 numMergedOcc 0
4 mol 21 unq 2 iso 0 dist 5.27589 10.0167 8.07914 5.29979 8.16395 9.20888 numMergedOcc 0
5 mol 29 unq 0 iso 0 dist 9.27422 8.44709 7.50258 5.61941 6.04161 5.97852 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 8.71324 10.7791 8.86433 7.61052 9.899 4.63989 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.47105 11.193 9.2759 6.43647 5.9959 4.85121 numMergedOcc 0
8 mol 139 unq 0 iso 0 dist 7.83417 7.11333 8.78382 5.21231 7.20542 3.82037 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 9.5214 4.12631 8.72323 10.0341 5.03696 11.109 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 5.63632 6.04551 6.38335 4.13718 5.61979 5.2973 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.35708 12.3139 9.2254 14.2497 5.27578 12.8633 numMergedOcc 0
12 mol 187 unq 0 iso 0 dist 9.55621 9.61673 5.58167 11.4507 5.7938 8.06583 numMergedOcc 0
13 mol 187 unq 1 iso 0 dist 9.55621 12.9459 8.0501 11.4507 5.7938 3.94358 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 8.82945 7.41218 7.36571 8.2928 5.77035 6.62595 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 8.82945 16.7139 9.80122 8.2928 5.77035 9.6618 numMergedOcc 0
16 mol 192 unq 2 iso 0 dist 8.82945 14.6803 9.17137 8.2928 5.77035 12.1003 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 8.3941 8.14211 5.61326 11.5968 7.75518 4.3166 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 6.58174 10.9794 6.20044 5.10199 5.81438 7.35194 numMergedOcc 0
19 mol 204 unq 1 iso 0 dist 6.58174 9.00243 8.41232 5.10199 5.81438 5.87202 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 9.54443 12.5471 5.86839 11.0071 6.50586 3.73699 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 7.24175 11.0439 5.86911 10.996 8.44407 4.54444 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 7.24175 11.0439 5.86911 5.055 6.0155 7.05353 numMergedOcc 0
23 mol 214 unq 2 iso 0 dist 7.24175 11.0439 5.86911 10.6488 8.89981 12.9344 numMergedOcc 0
24 mol 214 unq 3 iso 0 dist 7.24175 8.85251 7.89258 10.996 8.44407 5.33718 numMergedOcc 0
25 mol 214 unq 4 iso 0 dist 7.24175 8.85251 7.89258 5.055 6.0155 5.12324 numMergedOcc 0
26 mol 214 unq 5 iso 0 dist 7.24175 8.85251 7.89258 10.6488 8.89981 12.8738 numMergedOcc 0
27 mol 225 unq 0 iso 0 dist 8.33143 8.88571 7.65121 5.30128 8.94981 11.8703 numMergedOcc 0
28 mol 225 unq 1 iso 0 dist 8.33143 8.88571 7.65121 7.291 5.90986 4.88404 numMergedOcc 0
29 mol 225 unq 2 iso 0 dist 8.33143 8.88571 7.65121 15.2642 7.50697 13.6563 numMergedOcc 0
30 mol 226 unq 0 iso 0 dist 6.3687 4.52889 8.74399 3.70516 8.31266 5.27153 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 7.72433 5.86368 6.57444 5.78744 8.95841 10.6488 numMergedOcc 0
32 mol 266 unq 1 iso 0 dist 7.72433 4.95934 7.9555 5.78744 8.95841 9.70494 numMergedOcc 0
33 mol 266 unq 2 iso 0 dist 9.46926 4.95934 8.8646 5.78744 8.62843 9.70494 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 7.29081 12.2394 5.78262 15.3556 8.66133 5.53908 numMergedOcc 0
35 mol 273 unq 1 iso 0 dist 7.29081 12.2394 5.78262 4.3735 6.95569 12.7125 numMergedOcc 0
36 mol 273 unq 2 iso 0 dist 7.29081 7.5139 7.6489 15.3556 8.66133 12.7274 numMergedOcc 0
37 mol 273 unq 3 iso 0 dist 7.29081 7.5139 7.6489 4.3735 6.95569 10.8576 numMergedOcc 0
38 mol 285 unq 0 iso 0 dist 4.49395 9.47966 7.872 7.14335 5.49829 3.05975 numMergedOcc 0
39 mol 285 unq 1 iso 0 dist 4.49395 9.47966 7.872 7.67857 6.24134 11.5704 numMergedOcc 0
40 mol 285 unq 2 iso 0 dist 4.49395 6.49869 6.32984 7.14335 5.49829 5.76392 numMergedOcc 0
41 mol 285 unq 3 iso 0 dist 4.49395 6.49869 6.32984 7.67857 6.24134 4.4744 numMergedOcc 0
42 mol 287 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 numMergedOcc 0
43 mol 288 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 numMergedOcc 0
44 mol 289 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 numMergedOcc 0
