0 mol 58 unq 0 iso 0 dist 8.76223 7.88172 6.08593 6.82593 11.3285 7.6481 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 8.76223 7.88172 6.08593 15.7855 14.1577 9.11258 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.47208 6.91141 4.10173 11.5311 10.0641 7.10439 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 5.98626 5.79841 6.64001 5.71795 9.03785 6.05495 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 7.54915 5.79841 4.58085 5.71795 8.97148 6.05495 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 6.03038 9.95103 13.2428 7.59628 8.72187 7.09065 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 9.21675 9.95103 4.50298 7.59628 6.57181 7.09065 numMergedOcc 0
7 mol 135 unq 0 iso 0 dist 9.2927 9.03598 13.1573 4.90013 13.5441 7.12936 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 5.69707 7.32163 6.09907 5.58057 10.1579 8.28564 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 5.62239 7.42372 5.96176 5.55906 10.0288 8.39475 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 8.9395 9.27911 9.31217 12.677 17.1634 9.19117 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 8.9395 9.27911 9.31217 5.2437 10.9734 6.26365 numMergedOcc 0
12 mol 175 unq 2 iso 0 dist 8.9395 8.57607 6.5271 5.2437 10.9734 7.04177 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.42537 5.4347 8.05078 5.28695 13.9009 7.02079 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 7.94491 9.69025 10.7343 15.1483 14.7287 8.71497 numMergedOcc 0
15 mol 265 unq 0 iso 0 dist 5.8374 7.49913 9.1668 4.98228 9.32377 5.40318 numMergedOcc 0
