0 mol 78 unq 0 iso 0 dist 6.53252 9.6088 11.0843 4.9102 6.13394 13.8236 numMergedOcc 0
1 mol 93 unq 0 iso 0 dist 7.55854 7.49235 4.85981 7.76629 8.24402 6.67678 numMergedOcc 0
2 mol 93 unq 1 iso 0 dist 7.55854 7.49235 4.85981 3.83191 7.14241 8.28591 numMergedOcc 0
3 mol 93 unq 2 iso 0 dist 7.55854 7.19431 4.03764 7.76629 8.24402 10.4903 numMergedOcc 0
4 mol 93 unq 3 iso 0 dist 7.55854 7.19431 4.03764 3.83191 7.14241 5.35008 numMergedOcc 0
5 mol 169 unq 0 iso 0 dist 8.77324 9.70796 6.49048 5.73931 6.27378 10.9391 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 5.82681 8.9388 11.3012 6.7472 8.35588 7.36794 numMergedOcc 0
7 mol 193 unq 0 iso 0 dist 7.77216 5.06367 6.90307 9.34378 9.00084 6.94187 numMergedOcc 0
8 mol 233 unq 0 iso 0 dist 9.85333 9.00218 11.4762 9.45149 9.8976 16.4917 numMergedOcc 0
9 mol 233 unq 1 iso 0 dist 9.85333 9.00218 11.4762 5.31235 7.97911 12.859 numMergedOcc 0
10 mol 233 unq 2 iso 0 dist 9.85333 6.0751 7.87864 9.45149 9.8976 13.1938 numMergedOcc 0
11 mol 233 unq 3 iso 0 dist 9.85333 6.0751 7.87864 5.31235 7.97911 8.4338 numMergedOcc 0
12 mol 233 unq 4 iso 0 dist 8.08374 7.69531 8.24087 10.9237 8.70416 14.8442 numMergedOcc 0
13 mol 233 unq 5 iso 0 dist 8.08374 7.69531 8.24087 8.59304 8.18379 14.1176 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 5.27218 6.95744 4.08014 3.68745 4.44509 7.97504 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 8.88803 6.79386 7.02274 9.96926 4.76164 10.8041 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 8.88803 6.19564 4.58993 9.96926 4.76164 7.49606 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.17075 7.30349 15.4022 6.80038 6.39822 14.0326 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 9.17075 7.30349 15.4022 4.5731 5.36518 11.6442 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.55071 7.46806 5.08465 7.91977 6.37248 8.68477 numMergedOcc 0
