0 mol 0 unq 0 iso 0 dist 9.42137 11.6896 9.6994 8.60656 7.40865 9.11323 12.1052 5.25456 13.5517 7.79534 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.42137 14.5258 7.15528 8.60656 7.40865 9.46298 12.1052 5.25456 9.5614 7.79534 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.36377 4.78943 5.05803 5.96976 6.93532 5.30082 7.979 5.72175 8.17898 5.36911 numMergedOcc 0
3 mol 16 unq 1 iso 0 dist 6.36377 5.48395 6.31718 5.96976 6.93532 10.4366 7.979 5.72175 10.6491 5.36911 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 14.8628 14.959 12.6611 8.3964 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 10.5 5.75653 11.0381 7.06532 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 14.8628 14.959 18.5238 8.3964 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 9.54519 5.80023 7.36323 6.53276 8.23446 6.38336 10.5 5.75653 5.87895 7.06532 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 15.3459 9.85198 12.9306 8.3964 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 15.3459 9.85198 16.5811 8.3964 numMergedOcc 0
10 mol 25 unq 0 iso 0 dist 7.63928 6.17631 6.03987 9.78075 6.85556 5.68392 17.7709 13.395 14.2542 8.61491 numMergedOcc 0
11 mol 41 unq 0 iso 0 dist 5.41493 5.09229 6.19529 4.08339 8.51663 8.94326 7.10635 8.85978 10.0713 6.07294 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 3.88757 7.54568 10.2865 7.61312 3.85308 11.7729 9.04728 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 6.58793 9.21014 6.19965 3.88757 7.54568 8.09967 7.61312 3.85308 9.8682 9.04728 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 6.58793 7.83419 7.66905 3.88757 7.54568 4.65335 7.61312 3.85308 9.22376 9.04728 numMergedOcc 0
15 mol 101 unq 0 iso 0 dist 5.22543 4.50603 6.57035 5.08458 6.98314 5.53055 7.22737 4.51951 10.0014 7.73086 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 3.99238 6.03688 8.15057 7.97183 4.25942 9.82156 5.63477 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 3.99238 6.03688 12.4957 7.97183 4.25942 10.4618 5.63477 numMergedOcc 0
18 mol 205 unq 2 iso 0 dist 5.96555 5.87892 7.80463 3.99238 6.03688 6.09749 7.97183 4.25942 9.3629 5.63477 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 9.29752 9.60401 8.27212 6.36084 9.40808 4.9377 12.8152 13.7819 10.8093 8.27761 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 9.10633 7.20238 7.4631 4.85571 7.89524 4.45049 8.96917 8.4988 12.445 9.30143 numMergedOcc 0
