0 mol 1 unq 0 iso 0 dist 8.93702 7.48521 5.96833 11.0126 8.78328 7.27254 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 8.71628 5.06894 5.9809 6.81416 6.31611 8.25405 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.97065 4.18634 5.84066 8.8533 4.80984 6.73167 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.50453 13.6582 7.08559 23.0216 16.1649 9.58596 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 6.74716 9.18464 7.08559 18.3605 16.1649 9.58596 numMergedOcc 0
5 mol 34 unq 2 iso 0 dist 5.73257 6.65242 8.63635 8.8717 8.15141 9.58596 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 6.85365 4.9759 8.91262 5.9819 9.06991 7.44041 numMergedOcc 0
7 mol 126 unq 0 iso 0 dist 6.35364 13.8413 9.93613 12.0053 5.83002 8.66815 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 5.98435 4.72407 6.44575 5.8367 8.05714 6.99345 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 5.98435 7.97297 7.43401 5.8367 8.05714 5.11043 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 4.87879 10.9758 6.57379 17.9348 13.6926 8.48313 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 6.76614 10.3627 6.57379 18.4753 13.6926 8.48313 numMergedOcc 0
12 mol 134 unq 4 iso 0 dist 8.80672 4.4987 6.57379 5.8367 13.6926 8.48313 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 7.09847 11.9266 7.59939 10.3634 4.05428 7.32888 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.64561 11.5968 9.74988 8.22643 5.15519 7.87972 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 8.62873 7.96828 8.10546 11.1337 6.43742 7.07833 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 7.54327 16.363 9.11572 14.4053 8.16702 9.08151 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 6.29389 12.978 8.5613 10.3713 4.48119 9.65775 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 9.50619 9.31424 5.7791 8.2776 5.32038 9.65775 numMergedOcc 0
19 mol 267 unq 0 iso 0 dist 6.87713 10.6273 5.08174 11.5815 9.7551 7.60505 numMergedOcc 0
20 mol 267 unq 1 iso 0 dist 8.87518 10.1261 5.08174 16.9995 9.7551 7.60505 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 6.27189 5.87335 6.95241 5.84259 4.61146 9.30437 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.93542 4.3735 9.06937 9.56216 12.0694 5.4307 numMergedOcc 0
