0 mol 10 unq 0 iso 0 dist 7.36963 5.18342 8.09253 9.27837 6.77807 11.5593 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.49404 15.9816 8.45916 6.23313 8.85286 13.4799 numMergedOcc 0
2 mol 36 unq 0 iso 0 dist 7.01492 8.63334 9.6266 4.09734 5.70939 6.56592 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 7.39124 5.10234 6.03151 6.16081 5.4713 8.28528 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.31272 7.33183 8.63743 5.19478 8.29196 9.95772 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.65006 12.5798 9.78762 5.5308 5.45099 7.24635 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 5.65006 12.5798 9.78762 10.5881 8.44765 8.05782 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 5.65006 12.5798 9.78762 9.74852 9.06643 12.4827 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.17687 8.36687 9.71043 3.37256 9.54696 6.89822 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 8.17687 8.36687 9.71043 6.27386 4.62636 10.9616 numMergedOcc 0
10 mol 142 unq 0 iso 0 dist 9.64785 6.71726 5.90339 10.5548 5.42679 5.19808 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.09756 3.77738 7.12029 6.14958 9.17458 7.93285 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 5.09756 3.77738 7.12029 5.87342 7.36794 8.70013 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 7.44523 3.77738 8.56602 6.14958 6.94594 7.93285 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.44523 3.77738 8.56602 5.87342 5.81881 8.70013 numMergedOcc 0
15 mol 198 unq 0 iso 0 dist 8.18482 14.2537 9.85404 8.29433 9.75417 11.2214 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.46799 8.73559 9.99496 4.56852 6.31365 6.16076 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 6.05978 7.66976 9.99496 3.52029 6.31365 6.16076 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.79613 8.7985 8.51427 13.8153 8.88902 9.2281 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 6.54521 6.0591 8.29663 7.91474 7.49606 8.05498 numMergedOcc 0
20 mol 260 unq 1 iso 0 dist 8.52702 13.9141 8.01717 4.38276 9.73217 13.2373 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 7.75982 13.0226 9.44618 3.72284 8.62266 11.096 numMergedOcc 0
