0 mol 7 unq 0 iso 0 dist 5.77374 9.8603 5.70161 9.33944 8.0166 6.22805 9.30196 6.0323 7.15434 5.85668 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.8603 4.57188 10.0257 9.67498 13.9815 13.63 8.85869 12.3221 10.2939 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.57437 9.8603 4.57188 9.33944 9.32945 6.22805 13.63 8.85869 12.3221 15.279 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.85573 7.78905 6.07691 11.0282 8.23606 13.8654 10.1746 9.53901 14.2564 6.11297 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 6.21423 9.44909 6.07691 6.5318 8.23606 13.8654 9.23503 9.53901 14.2564 6.11297 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.67403 8.46556 11.5608 8.24748 8.30431 12.3891 16.6923 9.94756 19.7171 16.966 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 7.53682 5.39171 6.30194 12.2435 7.84699 8.124 6.13631 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 5.58346 6.18305 5.2774 7.53682 5.39171 6.30194 10.362 7.53504 11.801 12.6081 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.10386 6.18305 5.44275 7.53682 9.27355 6.30194 12.2435 8.40844 8.124 6.13631 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 9.10386 6.18305 5.44275 7.53682 9.27355 6.30194 14.2654 7.02351 10.9082 16.1129 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 9.10386 6.18305 5.44275 7.53682 9.27355 6.30194 10.362 8.66342 11.801 12.6081 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 9.06225 7.47794 5.31439 8.04327 7.02854 10.3438 13.42 7.71596 12.1702 8.50377 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 7.73701 8.062 9.7586 7.5418 9.26387 7.87125 4.95466 6.41916 9.47932 4.78007 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 6.2441 7.0843 9.92743 7.15853 4.61671 13.1458 6.7488 5.98076 9.89546 6.82687 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 6.2441 7.0843 9.92743 5.7173 8.44004 12.1227 6.7488 5.98076 9.89546 10.8844 numMergedOcc 0
15 mol 218 unq 2 iso 0 dist 6.2441 7.73315 12.0573 7.15853 4.61671 14.0877 6.7488 5.98076 9.66527 6.82687 numMergedOcc 0
16 mol 218 unq 3 iso 0 dist 6.2441 7.73315 12.0573 5.7173 8.44004 13.0264 6.7488 5.98076 9.66527 10.8844 numMergedOcc 0
17 mol 218 unq 4 iso 0 dist 6.2441 6.9398 8.31343 7.15853 4.61671 10.6908 6.7488 5.98076 4.851 6.82687 numMergedOcc 0
18 mol 218 unq 5 iso 0 dist 6.2441 6.9398 8.31343 5.7173 8.44004 12.5172 6.7488 5.98076 4.851 10.8844 numMergedOcc 0
19 mol 219 unq 0 iso 0 dist 9.52151 4.87446 10.9246 7.00921 4.67452 10.3945 6.28221 7.98941 6.8424 7.61939 numMergedOcc 0
20 mol 219 unq 1 iso 0 dist 9.52151 4.87446 10.9246 10.3376 9.86916 12.2725 6.28221 7.98941 6.8424 5.58316 numMergedOcc 0
21 mol 219 unq 2 iso 0 dist 9.52151 7.49235 13.5876 7.00921 4.67452 12.328 6.28221 7.98941 12.5982 7.61939 numMergedOcc 0
22 mol 219 unq 3 iso 0 dist 9.52151 7.49235 13.5876 10.3376 9.86916 17.5208 6.28221 7.98941 12.5982 5.58316 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 5.98006 8.06771 5.71237 7.78289 8.73077 11.4871 7.8775 9.16791 13.8844 5.94835 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 5.98006 8.06771 5.71237 5.73217 6.76656 6.96379 7.8775 9.16791 13.8844 9.43627 numMergedOcc 0
25 mol 259 unq 2 iso 0 dist 7.97113 9.12507 13.3027 6.92619 8.91916 14.9752 9.69102 9.2772 11.8092 15.0643 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 3.90274 8.12852 5.73592 5.01049 5.28417 10.3469 4.55986 6.35457 9.07043 5.08317 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 9.71653 7.74162 6.03718 6.05412 8.57035 5.17586 10.6101 8.15805 12.5257 13.2374 numMergedOcc 0
