0 mol 30 unq 0 iso 0 dist 7.6477 4.43881 6.07517 9.50593 8.74649 5.61656 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 7.6477 4.43881 6.07517 8.99097 10.9847 7.22242 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 7.6477 9.17153 6.74179 9.50593 8.74649 6.95343 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 5.63499 5.55291 7.28228 8.02434 7.53994 9.43171 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.79061 4.78435 9.73086 13.4718 10.4668 9.33919 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 9.79061 6.33833 7.4369 13.4718 10.4668 9.79143 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 8.40461 5.28089 6.89918 10.0469 3.92897 7.19937 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.88752 10.9364 8.77023 14.2091 13.2024 4.51266 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 4.73115 10.8108 7.99477 18.3631 15.8799 8.65986 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.73668 14.5913 6.42772 10.07 5.40695 6.50009 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 9.66676 11.4871 9.08274 10.0097 5.40635 6.36868 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 5.97971 10.8374 9.01624 13.4294 8.25265 8.47008 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.72747 11.9541 9.01624 16.0906 8.25265 8.47008 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 8.23845 8.672 9.01624 14.1858 8.25265 8.47008 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 6.84679 5.5366 7.2793 11.8778 7.32479 8.64379 numMergedOcc 0
15 mol 198 unq 0 iso 0 dist 9.40433 9.33462 9.31526 10.5258 5.02597 5.82585 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.69052 10.3976 8.14831 14.6318 17.2402 9.88976 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.993 13.3838 6.73665 12.3394 7.77371 5.45139 numMergedOcc 0
