0 mol 26 unq 0 iso 0 dist 7.34549 9.08976 11.887 4.20567 10.8071 8.62693 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 9.02927 7.41523 5.0364 11.4962 13.3754 8.91418 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 9.02927 7.41523 5.0364 10.7868 5.41493 6.0961 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 9.95691 6.32571 5.54723 4.19247 12.066 9.12204 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 9.95691 6.32571 5.54723 6.83997 9.79034 9.64783 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.79726 7.93317 11.5972 5.87135 13.1498 9.28803 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.89618 6.11881 13.469 10.9311 20.7371 9.16721 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 7.2461 9.58164 10.9266 10.5488 16.235 9.29817 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 9.26333 9.58164 7.85178 10.5488 15.5526 9.29817 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.57352 6.32393 8.69934 7.31124 13.7855 5.44714 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 9.60425 9.77482 11.3679 15.0483 18.7881 9.58171 numMergedOcc 0
11 mol 117 unq 1 iso 0 dist 9.60425 9.0428 15.2823 8.64874 12.479 8.0578 numMergedOcc 0
12 mol 117 unq 2 iso 0 dist 9.60425 9.0428 15.2823 11.7573 20.8882 8.78982 numMergedOcc 0
13 mol 174 unq 0 iso 0 dist 6.90813 8.79469 8.37744 7.53575 12.204 8.3622 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 7.86668 6.94875 11.9386 4.04112 8.62103 6.87234 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 4.91961 6.5097 7.50943 5.55026 7.86368 7.24774 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 7.14333 6.5097 9.38219 5.55026 11.8838 7.24774 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 8.39522 6.59305 6.20606 11.9227 10.6346 9.94175 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 8.39522 6.59305 6.20606 5.58605 6.24928 8.81534 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 5.99187 6.59305 10.4664 11.9227 13.9196 9.94175 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 5.99187 6.59305 10.4664 5.58605 11.3074 8.81534 numMergedOcc 0
21 mol 238 unq 4 iso 0 dist 9.93378 6.59305 13.3539 11.9227 11.2596 9.94175 numMergedOcc 0
22 mol 238 unq 5 iso 0 dist 9.93378 6.59305 13.3539 5.58605 14.244 8.81534 numMergedOcc 0
