0 mol 2 unq 0 iso 0 dist 9.9335 9.49821 15.5299 7.99162 11.2776 4.67907 10.8368 6.15195 18.7336 15.0494 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.9335 9.49821 15.5299 7.99162 11.2776 4.67907 6.38677 7.37296 12.8366 9.58976 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.8592 6.95017 12.6897 8.48743 10.2888 5.5824 7.91041 9.67498 11.4058 13.4907 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.16791 8.23686 11.252 8.29727 8.77472 10.3017 15.4318 7.09393 17.7729 15.2649 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 9.16791 8.23686 11.252 8.29727 8.77472 10.3017 11.6163 3.87167 14.4442 12.3291 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 9.16791 9.38571 7.3232 8.29727 8.77472 8.15522 15.4318 7.09393 10.9145 15.2649 numMergedOcc 0
6 mol 69 unq 3 iso 0 dist 9.16791 9.38571 7.3232 8.29727 8.77472 8.15522 11.6163 3.87167 8.41025 12.3291 numMergedOcc 0
7 mol 69 unq 4 iso 0 dist 6.57452 8.23686 7.91431 8.29727 5.16822 10.3017 11.6815 9.22636 13.8592 13.9229 numMergedOcc 0
8 mol 69 unq 5 iso 0 dist 6.57452 9.38571 11.4854 8.29727 5.16822 8.15522 11.6815 9.22636 18.2865 13.9229 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.15949 8.85912 5.50163 6.99793 7.65733 11.1664 5.67441 5.31281 10.5582 7.25166 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 6.15949 8.85912 5.50163 6.99793 7.65733 11.1664 10.0602 8.9922 13.5802 12.8848 numMergedOcc 0
11 mol 114 unq 2 iso 0 dist 6.15949 8.85912 5.50163 6.71345 5.24877 4.77991 5.67441 5.31281 10.5582 8.42445 numMergedOcc 0
12 mol 114 unq 3 iso 0 dist 6.15949 8.85912 5.50163 6.71345 5.24877 4.77991 10.0602 8.9922 13.5802 10.2889 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.614 7.10634 5.6672 8.27794 11.0057 5.48043 9.24302 8.78709 11.4954 15.0674 numMergedOcc 0
14 mol 207 unq 0 iso 0 dist 4.70143 7.08146 5.55728 5.18312 7.53149 6.2409 9.07366 8.84785 11.8114 13.6848 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.46484 6.45266 6.93622 8.95071 6.49831 12.0614 8.95567 7.6402 9.41513 13.61 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 8.80671 9.52945 16.6823 7.49412 6.81625 11.3652 5.98568 7.6402 15.4629 10.818 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 7.16232 9.89398 13.7032 6.90245 7.93809 10.8667 10.121 9.174 19.0883 9.72526 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 9.66298 7.43425 7.98909 9.80409 13.6041 6.75336 17.0555 9.70222 14.4764 17.2791 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 6.03414 9.23937 5.63407 9.91518 8.66976 14.0179 5.49004 8.87405 11.6081 9.82774 numMergedOcc 0
