0 mol 14 unq 0 iso 0 dist 5.40648 5.25322 6.69294 7.06234 9.24546 10.7182 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 5.40648 5.25322 6.69294 7.83211 7.79091 12.3636 numMergedOcc 0
2 mol 14 unq 2 iso 0 dist 8.4114 5.25322 5.35021 10.5318 9.54103 12.1744 numMergedOcc 0
3 mol 14 unq 3 iso 0 dist 9.60796 10.2228 5.35021 7.23419 9.54103 12.1744 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.98958 5.82545 5.58467 7.38197 6.85245 9.03287 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 8.37315 11.8334 7.62977 8.95606 7.6314 5.55161 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 9.17671 8.5691 9.0807 5.29804 7.68908 8.96379 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 9.17671 8.5691 9.0807 9.70381 7.95587 10.0988 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 9.08158 14.0557 9.69841 8.90485 7.3864 5.30617 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.86332 9.16854 6.90904 4.42593 6.53862 5.32245 numMergedOcc 0
10 mol 174 unq 0 iso 0 dist 9.60482 5.84027 7.77647 5.17022 7.5144 6.02641 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 6.58684 7.96104 7.01007 5.99976 8.88463 4.73739 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.6897 5.8741 9.10711 12.5471 8.96503 14.538 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 9.6897 12.5779 8.94211 12.5471 8.96503 12.6987 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 8.99521 12.0484 6.93858 9.4366 9.82101 9.19013 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 8.67228 7.52187 8.10617 12.3825 8.73768 10.9944 numMergedOcc 0
