0 mol 16 unq 0 iso 0 dist 7.979 6.36377 5.72175 4.78943 8.17898 5.05803 5.96976 5.36911 6.93532 5.30082 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.979 6.36377 5.72175 5.48395 10.6491 6.31718 5.96976 5.36911 6.93532 10.4366 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 7.10635 5.41493 8.85978 5.09229 10.0713 6.19529 4.08339 6.07294 8.51663 8.94326 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.71467 9.22002 10.8063 6.16737 10.755 6.65721 12.7481 14.3098 9.25641 13.5488 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.61312 6.58793 3.85308 10.1919 11.7729 7.95579 3.88757 9.04728 7.54568 10.2865 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 7.61312 6.58793 3.85308 9.21014 9.8682 6.19965 3.88757 9.04728 7.54568 8.09967 numMergedOcc 0
6 mol 85 unq 2 iso 0 dist 7.61312 6.58793 3.85308 7.83419 9.22376 7.66905 3.88757 9.04728 7.54568 4.65335 numMergedOcc 0
7 mol 101 unq 0 iso 0 dist 7.22737 5.22543 4.51951 4.50603 10.0014 6.57035 5.08458 7.73086 6.98314 5.53055 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 7.97183 5.96555 4.25942 4.6995 9.82156 6.03031 3.99238 5.63477 6.03688 8.15057 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 7.97183 5.96555 4.25942 10.7091 10.4618 7.26832 3.99238 5.63477 6.03688 12.4957 numMergedOcc 0
10 mol 205 unq 2 iso 0 dist 7.97183 5.96555 4.25942 5.87892 9.3629 7.80463 3.99238 5.63477 6.03688 6.09749 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 9.87685 9.07872 17.4802 9.9474 19.7156 7.09863 4.21811 13.9595 6.02296 6.35849 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.24066 7.46434 7.87385 13.0285 15.1742 8.41436 6.06471 11.6669 6.30154 7.44558 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 9.24066 7.46434 7.87385 13.0285 15.1742 8.41436 11.1213 14.1034 7.32499 10.7902 numMergedOcc 0
14 mol 234 unq 2 iso 0 dist 9.24066 7.46434 7.87385 13.9912 16.4929 8.92474 6.06471 11.6669 6.30154 10.9712 numMergedOcc 0
15 mol 234 unq 3 iso 0 dist 9.24066 7.46434 7.87385 13.9912 16.4929 8.92474 11.1213 14.1034 7.32499 4.4288 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 8.96917 9.10633 8.4988 7.20238 12.445 7.4631 4.85571 9.30143 7.89524 4.45049 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 8.06908 9.54857 6.18571 15.3806 13.6279 7.46176 8.74892 10.9688 7.08526 8.81835 numMergedOcc 0
