0 mol 20 unq 0 iso 0 dist 6.4074 12.3432 9.78224 6.44057 5.11883 6.39663 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 6.4074 5.33316 7.57379 6.44057 5.11883 8.0278 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 6.29578 9.76503 9.33568 5.28233 8.81141 13.2155 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 5.70349 5.41473 9.43824 5.85389 5.44124 7.71584 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.46867 6.28936 5.52283 10.9893 5.64989 5.7253 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 9.17864 8.27934 7.48283 4.42156 5.92729 5.72753 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 9.39373 10.5358 7.48283 5.12233 5.92729 5.72753 numMergedOcc 0
7 mol 120 unq 2 iso 0 dist 8.28744 6.91038 9.35573 11.469 9.23243 9.0525 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 6.10881 4.8716 8.76367 7.77018 9.54038 10.4465 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 9.46363 11.4312 5.10016 8.10658 7.48626 5.20422 numMergedOcc 0
10 mol 219 unq 0 iso 0 dist 9.72263 12.4335 6.65093 14.4125 9.09124 7.67827 numMergedOcc 0
11 mol 219 unq 1 iso 0 dist 9.72263 13.4956 9.93514 14.4125 9.09124 17.6499 numMergedOcc 0
12 mol 219 unq 2 iso 0 dist 9.65487 12.6746 6.65093 11.1547 9.09124 7.67827 numMergedOcc 0
13 mol 219 unq 3 iso 0 dist 9.65487 13.8617 9.93514 11.1547 9.09124 17.6499 numMergedOcc 0
14 mol 251 unq 0 iso 0 dist 9.31994 8.97824 8.63134 10.752 6.12282 4.20853 numMergedOcc 0
15 mol 251 unq 1 iso 0 dist 9.31994 8.97824 8.63134 8.66389 6.99995 10.5451 numMergedOcc 0
16 mol 251 unq 2 iso 0 dist 4.63025 12.3076 8.63134 10.5167 6.12282 4.20853 numMergedOcc 0
17 mol 251 unq 3 iso 0 dist 4.63025 12.3076 8.63134 6.87795 6.99995 10.5451 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 9.4458 5.58886 9.55134 8.47071 9.05339 9.84762 numMergedOcc 0
19 mol 281 unq 1 iso 0 dist 8.9745 10.2235 9.55134 11.6796 9.05339 9.84762 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 7.06369 4.91258 8.45077 6.98442 5.04032 6.93502 numMergedOcc 0
21 mol 285 unq 1 iso 0 dist 7.06369 4.91258 8.45077 7.41581 8.48397 11.2993 numMergedOcc 0
