0 mol 34 unq 0 iso 0 dist 6.35997 9.4837 9.56614 6.66835 4.75881 9.78639 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 7.68019 4.47917 7.4403 5.29955 4.75881 3.76025 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 7.68019 4.6013 8.61815 5.29955 4.75881 8.50202 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.48328 4.65586 7.03832 8.11968 8.65524 5.59994 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 9.48328 4.65586 7.03832 12.3188 8.96151 7.78417 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 9.48328 4.65586 7.03832 9.72788 9.02535 5.47187 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.63792 12.9327 8.90522 8.58059 7.66068 10.865 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.63792 12.9327 8.90522 14.7497 9.5043 10.2651 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 8.63792 12.9327 8.90522 14.3572 8.34132 5.92868 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 6.29267 9.878 7.90338 6.02092 4.15789 4.35906 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 6.56288 12.0467 5.61151 7.14242 6.67137 10.803 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 6.56288 12.0467 5.61151 15.2173 9.78707 5.49707 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 5.97559 12.0467 6.54289 9.52671 7.07839 11.6623 numMergedOcc 0
13 mol 85 unq 3 iso 0 dist 5.97559 12.0467 6.54289 5.86553 9.09711 15.6048 numMergedOcc 0
14 mol 85 unq 4 iso 0 dist 5.97559 12.0467 6.54289 7.14242 7.04244 10.803 numMergedOcc 0
15 mol 85 unq 5 iso 0 dist 5.97559 12.0467 6.54289 8.62855 7.91193 13.4097 numMergedOcc 0
16 mol 85 unq 6 iso 0 dist 5.97559 12.0467 6.54289 15.2173 9.63449 5.49707 numMergedOcc 0
17 mol 85 unq 7 iso 0 dist 5.97559 11.8012 7.52869 9.52671 7.07839 4.86391 numMergedOcc 0
18 mol 85 unq 8 iso 0 dist 5.97559 11.8012 7.52869 5.86553 9.09711 11.6463 numMergedOcc 0
19 mol 85 unq 9 iso 0 dist 5.97559 11.8012 7.52869 7.14242 7.04244 9.46256 numMergedOcc 0
20 mol 85 unq 10 iso 0 dist 5.97559 11.8012 7.52869 15.2173 9.63449 11.3191 numMergedOcc 0
21 mol 85 unq 11 iso 0 dist 5.97559 11.8012 7.52869 8.62855 7.91193 8.06224 numMergedOcc 0
22 mol 85 unq 12 iso 0 dist 5.97559 12.0763 9.18945 9.52671 7.07839 9.18879 numMergedOcc 0
23 mol 85 unq 13 iso 0 dist 5.97559 12.0763 9.18945 5.86553 9.09711 13.1591 numMergedOcc 0
24 mol 85 unq 14 iso 0 dist 5.97559 12.0763 9.18945 7.14242 7.04244 6.34431 numMergedOcc 0
25 mol 85 unq 15 iso 0 dist 5.97559 12.0763 9.18945 15.2173 9.63449 14.7195 numMergedOcc 0
26 mol 85 unq 16 iso 0 dist 5.97559 12.0763 9.18945 8.62855 7.91193 11.8663 numMergedOcc 0
27 mol 111 unq 0 iso 0 dist 5.53271 4.10604 7.75479 7.42165 9.34782 11.4065 numMergedOcc 0
28 mol 141 unq 0 iso 0 dist 8.14978 13.2439 6.50336 9.809 4.88514 9.08526 numMergedOcc 0
29 mol 151 unq 0 iso 0 dist 5.91643 4.89642 9.92657 6.07474 9.37533 3.72016 numMergedOcc 0
30 mol 176 unq 0 iso 0 dist 8.00223 9.87769 9.67312 3.84631 6.85902 6.33976 numMergedOcc 0
31 mol 204 unq 0 iso 0 dist 7.15344 4.22625 7.76863 6.82158 8.32259 3.99343 numMergedOcc 0
32 mol 204 unq 1 iso 0 dist 7.15344 4.22625 7.76863 11.8793 8.54737 11.4601 numMergedOcc 0
33 mol 204 unq 2 iso 0 dist 8.09863 11.0196 8.41517 6.29741 8.54737 6.68247 numMergedOcc 0
34 mol 204 unq 3 iso 0 dist 8.09863 11.0196 8.41517 3.88406 7.64057 7.51762 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 5.28746 8.1524 9.6721 9.23405 6.96692 16.2268 numMergedOcc 0
36 mol 266 unq 1 iso 0 dist 5.28746 8.1524 9.6721 11.313 8.25286 16.7453 numMergedOcc 0
37 mol 266 unq 2 iso 0 dist 5.28746 8.1524 9.6721 13.005 9.9965 17.4207 numMergedOcc 0
38 mol 281 unq 0 iso 0 dist 9.05453 10.095 9.94612 16.2801 7.90368 14.4804 numMergedOcc 0
39 mol 281 unq 1 iso 0 dist 9.05453 10.095 9.94612 9.81081 6.69267 6.83942 numMergedOcc 0
40 mol 283 unq 0 iso 0 dist 9.82274 7.46667 7.83424 4.3196 7.31132 4.58127 numMergedOcc 0
41 mol 283 unq 1 iso 0 dist 7.17276 5.78328 7.83424 6.30031 7.31132 4.58127 numMergedOcc 0
42 mol 287 unq 0 iso 0 dist 9.14217 8.73374 5.50067 9.84883 4.68668 8.99193 numMergedOcc 0
43 mol 288 unq 0 iso 0 dist 9.14217 8.73374 5.50067 9.84883 4.68668 8.99193 numMergedOcc 0
44 mol 289 unq 0 iso 0 dist 9.14217 8.73374 5.50067 9.84883 4.68668 8.99193 numMergedOcc 0
