0 mol 0 unq 0 iso 0 dist 7.31837 4.59249 7.30381 3.68241 9.00092 8.2542 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 6.66861 10.9658 9.95327 6.89662 8.70598 4.9076 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 6.66861 8.71074 7.50825 6.89662 8.70598 12.4379 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 6.72084 6.24438 9.95327 3.74852 8.70598 4.9076 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 6.72084 12.0589 7.50825 3.74852 8.70598 12.4379 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 5.84625 7.7624 7.88172 7.4999 7.58739 5.02512 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 5.84625 7.7624 7.88172 4.99692 9.01564 5.42468 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 5.84625 7.7624 7.88172 3.70586 7.11065 8.24108 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.07989 7.13073 6.34966 6.4113 7.98985 4.58473 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 9.77272 13.7884 6.34966 16.2411 7.98985 4.58473 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 7.4518 12.7865 8.0955 3.91263 7.28831 10.3243 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 5.42828 8.86411 9.69961 3.61827 8.72725 11.4567 numMergedOcc 0
12 mol 112 unq 1 iso 0 dist 5.42828 8.86411 9.69961 3.78964 6.11407 11.4288 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.15381 4.58247 6.69623 6.98142 8.24419 4.25315 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 8.15381 9.70849 6.21951 6.98142 8.24419 4.89614 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 6.32097 10.9196 9.32649 5.06821 9.23863 15.5092 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 9.79381 4.73362 6.6069 11.9758 6.94762 7.30721 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 9.79381 4.73362 6.6069 3.69148 9.89167 5.22792 numMergedOcc 0
18 mol 225 unq 2 iso 0 dist 8.37379 6.31615 6.6069 12.7552 6.94762 7.30721 numMergedOcc 0
19 mol 225 unq 3 iso 0 dist 8.37379 6.31615 6.6069 5.69755 9.89167 5.22792 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.83422 8.47021 6.23146 6.54593 6.59036 11.433 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 5.66817 4.29865 7.40057 8.00048 6.85663 11.2926 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 6.81257 4.50533 8.20933 3.86293 9.03998 8.04035 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 6.60049 9.93138 9.46421 7.45665 8.6233 11.7127 numMergedOcc 0
