0 mol 42 unq 0 iso 0 dist 9.83301 9.82536 14.514 7.73997 10.1829 4.50835 5.6382 5.52834 13.1748 9.39402 numMergedOcc 0
1 mol 42 unq 1 iso 0 dist 9.83301 8.77998 11.4032 7.73997 10.1829 4.98339 5.6382 5.52834 11.3896 9.39402 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.60438 8.14057 9.18603 7.30934 4.77556 10.6242 9.63545 9.06641 15.8361 7.01987 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 7.53333 6.12388 6.29219 9.70317 9.02311 4.91553 5.2815 6.90966 9.64597 12.7153 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 7.88346 9.03233 14.8495 5.24882 5.08025 10.9086 5.57673 5.40826 14.505 6.38786 numMergedOcc 0
5 mol 168 unq 0 iso 0 dist 8.66519 7.53748 12.8964 8.47439 12.949 4.07587 16.2743 8.72323 20.7692 19.6449 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.17789 5.47189 12.5982 8.94445 14.3694 6.92078 10.2242 9.2254 14.3228 17.588 numMergedOcc 0
7 mol 211 unq 0 iso 0 dist 7.49132 7.66285 8.75747 7.78316 9.54726 9.1709 11.2256 8.10779 16.1606 13.1491 numMergedOcc 0
8 mol 266 unq 0 iso 0 dist 8.78501 8.82941 9.7281 7.51951 15.5294 13.1885 8.96584 9.39714 16.0719 14.3052 numMergedOcc 0
9 mol 277 unq 0 iso 0 dist 9.60879 6.86014 7.44724 7.34927 14.4215 7.75371 4.00063 6.66936 4.81916 9.07744 numMergedOcc 0
10 mol 277 unq 1 iso 0 dist 6.92271 6.86014 5.77904 7.34927 5.11865 7.75371 4.00063 8.15119 4.81916 9.07744 numMergedOcc 0
11 mol 277 unq 2 iso 0 dist 8.62666 5.97073 5.77904 7.54315 5.11865 7.75371 9.31316 8.15119 4.81916 9.07744 numMergedOcc 0
12 mol 294 unq 0 iso 0 dist 8.92737 6.45955 6.99988 7.33086 8.0693 8.13925 9.82894 6.37998 9.97601 12.8085 numMergedOcc 0
13 mol 294 unq 1 iso 0 dist 8.92737 6.45955 6.99988 7.88971 9.57892 12.1489 9.82894 6.37998 9.97601 11.1448 numMergedOcc 0
14 mol 294 unq 2 iso 0 dist 8.92737 6.45955 6.99988 6.82335 10.0639 6.18981 9.82894 6.37998 9.97601 14.2426 numMergedOcc 0
15 mol 294 unq 3 iso 0 dist 8.92737 8.86937 11.8346 7.33086 8.0693 11.3477 9.82894 6.37998 14.0967 12.8085 numMergedOcc 0
16 mol 294 unq 4 iso 0 dist 8.92737 8.86937 11.8346 7.88971 9.57892 15.8772 9.82894 6.37998 14.0967 11.1448 numMergedOcc 0
17 mol 294 unq 5 iso 0 dist 8.92737 8.86937 11.8346 6.82335 10.0639 7.45368 9.82894 6.37998 14.0967 14.2426 numMergedOcc 0
18 mol 294 unq 6 iso 0 dist 7.15278 5.71661 6.99988 9.32126 8.0693 8.13925 6.49126 6.37998 9.97601 12.8085 numMergedOcc 0
19 mol 294 unq 7 iso 0 dist 7.15278 5.71661 6.99988 9.38111 9.57892 12.1489 6.49126 6.37998 9.97601 11.1448 numMergedOcc 0
20 mol 294 unq 8 iso 0 dist 7.15278 5.71661 6.99988 9.14005 10.0639 6.18981 6.49126 6.37998 9.97601 14.2426 numMergedOcc 0
21 mol 294 unq 9 iso 0 dist 7.15278 8.98536 11.8346 9.32126 8.0693 11.3477 6.49126 6.37998 14.0967 12.8085 numMergedOcc 0
22 mol 294 unq 10 iso 0 dist 7.15278 8.98536 11.8346 9.38111 9.57892 15.8772 6.49126 6.37998 14.0967 11.1448 numMergedOcc 0
23 mol 294 unq 11 iso 0 dist 7.15278 8.98536 11.8346 9.14005 10.0639 7.45368 6.49126 6.37998 14.0967 14.2426 numMergedOcc 0
