0 mol 7 unq 0 iso 0 dist 9.67498 15.0231 9.85726 17.8527 10.4879 7.32392 23.3159 16.2694 8.54694 9.58865 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.32945 17.302 9.85726 15.7555 10.4879 7.32392 20.5327 16.2694 8.54694 9.58865 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.88676 6.06561 8.67719 11.7065 9.57729 6.84569 10.3638 9.57392 6.43294 8.46837 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 9.35633 16.255 9.59261 10.4739 6.14241 5.85841 16.6371 7.59354 6.83826 8.87856 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 9.35633 16.255 9.59261 10.4739 6.14241 5.85841 11.6415 10.0393 9.30656 6.2491 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 9.35633 16.255 9.59261 13.6924 10.8152 6.78839 11.6415 10.0393 9.30656 3.59451 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 9.35633 9.75148 6.67936 10.4739 6.14241 7.00285 16.6371 7.59354 9.94628 8.87856 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 9.35633 9.75148 6.67936 10.4739 6.14241 7.00285 11.6415 10.0393 5.39087 6.2491 numMergedOcc 0
8 mol 98 unq 5 iso 0 dist 9.35633 9.75148 6.67936 13.6924 10.8152 8.02354 11.6415 10.0393 5.39087 3.59451 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 5.43401 7.49575 9.10229 11.8703 12.6508 9.84673 11.7098 14.2643 6.42572 7.73836 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 8.59182 12.4009 8.21889 12.4161 5.07258 7.51061 7.92198 9.0224 10.6667 9.2046 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 12.1736 9.98645 6.21273 6.555 9.58724 4.90657 8.58709 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 7.62593 11.4653 9.33771 18.4903 13.9782 9.73411 24.3809 18.5355 14.3302 8.68767 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 7.62593 11.4653 9.33771 14.1813 14.788 7.07564 9.46589 11.1636 5.63485 7.7163 numMergedOcc 0
14 mol 224 unq 2 iso 0 dist 7.62593 11.4653 9.33771 14.1813 14.788 7.07564 13.9521 12.5889 4.8786 9.2 numMergedOcc 0
15 mol 231 unq 0 iso 0 dist 7.28719 10.9863 7.79865 18.4635 14.3729 8.91036 22.2559 18.6746 11.548 6.73226 numMergedOcc 0
16 mol 231 unq 1 iso 0 dist 6.60684 8.54452 7.79865 17.0912 14.3729 8.91036 19.8856 18.6746 11.548 6.73226 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 6.18866 6.28944 5.78121 9.39819 7.82195 7.72708 9.98606 11.8673 9.50161 6.04688 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 8.97411 4.6881 5.73296 5.04068 9.93782 8.40766 5.52381 14.3981 9.45618 8.34471 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 6.12202 7.23876 9.02749 8.04439 4.84163 6.36173 10.8706 13.2163 4.54581 9.94705 numMergedOcc 0
