0 mol 12 unq 0 iso 0 dist 9.4685 8.89734 5.44478 7.52843 9.41745 6.9065 numMergedOcc 0
1 mol 22 unq 0 iso 0 dist 9.64681 6.00963 7.74523 10.9298 8.28901 5.70422 numMergedOcc 0
2 mol 22 unq 1 iso 0 dist 9.64681 7.13897 6.90519 10.9298 8.28901 4.69565 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 8.14002 12.8097 9.1487 9.96191 9.38611 5.38234 numMergedOcc 0
4 mol 132 unq 0 iso 0 dist 8.49299 4.24969 7.14447 13.8837 9.0339 11.6877 numMergedOcc 0
5 mol 132 unq 1 iso 0 dist 8.49299 4.24969 7.14447 14.8844 8.48641 11.8999 numMergedOcc 0
6 mol 132 unq 2 iso 0 dist 8.49299 4.24969 7.14447 8.02299 6.23573 5.77316 numMergedOcc 0
7 mol 136 unq 0 iso 0 dist 9.44126 5.72482 9.67457 10.7369 6.53519 10.4141 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 8.64985 5.1382 9.67207 14.2151 9.05666 15.8138 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 9.54594 14.5274 9.67207 10.9985 9.05666 15.8138 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 4.971 9.48016 9.33299 6.00315 6.49599 7.32419 numMergedOcc 0
11 mol 259 unq 1 iso 0 dist 4.971 9.48016 9.33299 6.72493 9.34738 6.04412 numMergedOcc 0
12 mol 259 unq 2 iso 0 dist 4.971 9.48016 9.33299 5.69584 9.47382 12.7868 numMergedOcc 0
13 mol 259 unq 3 iso 0 dist 4.971 5.98095 9.49732 6.00315 6.49599 11.0067 numMergedOcc 0
14 mol 259 unq 4 iso 0 dist 4.971 5.98095 9.49732 6.72493 9.34738 11.569 numMergedOcc 0
15 mol 259 unq 5 iso 0 dist 4.971 5.98095 9.49732 5.69584 9.47382 6.18571 numMergedOcc 0
16 mol 276 unq 0 iso 0 dist 5.39708 5.58105 8.0652 5.58984 7.11272 11.0506 numMergedOcc 0
17 mol 276 unq 1 iso 0 dist 5.39708 5.58105 8.0652 5.82952 6.24808 5.88008 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.86256 7.00428 4.66252 10.7231 9.22576 11.3048 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.86256 7.00428 4.66252 10.7231 9.22576 11.3048 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.86256 7.00428 4.66252 10.7231 9.22576 11.3048 numMergedOcc 0
