0 mol 7 unq 0 iso 0 dist 8.81871 16.368 8.0166 13.0511 5.70161 6.22805 19.6724 12.2471 6.96396 7.10621 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.71959 16.368 9.32945 13.0511 4.57188 6.22805 19.6724 10.2729 6.96396 7.10621 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 6.69294 10.2428 7.66311 9.90483 7.00835 8.91266 9.88721 8.39221 4.15151 6.38364 numMergedOcc 0
3 mol 14 unq 1 iso 0 dist 5.35021 9.04499 7.66311 11.9982 7.00835 8.91266 11.7436 8.39221 4.15151 6.38364 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.91858 12.7633 9.27355 12.5553 9.76331 4.24428 15.4507 14.8258 6.58444 5.93252 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.91858 12.7633 9.27355 12.0936 5.44275 6.30194 16.0863 7.26679 10.5627 6.19304 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 7.5442 12.7633 8.60363 12.5553 10.4402 4.24428 15.4507 14.0323 6.58444 5.93252 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 7.5442 12.7633 8.60363 12.0936 8.0624 6.30194 16.0863 10.1503 10.5627 6.19304 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.07051 6.19687 6.60356 14.1058 14.3495 9.57498 8.71142 11.5472 6.89762 6.45675 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 8.25442 11.0509 7.9663 16.8046 9.97628 9.05626 14.4818 12.0527 7.09664 8.70949 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.01007 8.21784 8.6609 7.04318 6.15969 6.73365 8.09861 10.7272 5.73338 5.6234 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 7.01007 8.21784 8.6609 7.04318 6.15969 6.73365 10.1323 14.7648 12.753 9.92231 numMergedOcc 0
12 mol 175 unq 2 iso 0 dist 7.01007 8.21784 8.6609 11.9173 11.0866 9.45659 8.09861 10.7272 5.73338 6.57069 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 8.87835 7.45619 6.24111 7.19917 5.82028 8.07523 9.55205 9.67457 13.3929 6.18308 numMergedOcc 0
14 mol 210 unq 1 iso 0 dist 8.87835 4.70332 9.00343 7.19917 5.82028 7.56882 9.55205 9.67457 12.3088 6.18308 numMergedOcc 0
15 mol 210 unq 2 iso 0 dist 9.54076 9.42733 6.24111 14.9023 5.82028 8.07523 18.346 9.67457 13.3929 6.18308 numMergedOcc 0
16 mol 210 unq 3 iso 0 dist 9.54076 13.6553 9.00343 14.9023 5.82028 7.56882 18.346 9.67457 12.3088 6.18308 numMergedOcc 0
17 mol 210 unq 4 iso 0 dist 8.93859 7.45619 8.60412 7.19917 4.62641 8.07523 9.55205 9.90494 13.3929 6.18308 numMergedOcc 0
18 mol 210 unq 5 iso 0 dist 8.93859 4.70332 7.05535 7.19917 4.62641 7.56882 9.55205 9.90494 12.3088 6.18308 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.73616 9.41461 9.08719 7.69537 7.85135 7.04127 5.92906 13.1222 11.7724 9.40098 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 7.73616 9.41461 9.08719 7.69537 7.85135 7.04127 5.41675 6.08709 4.55824 6.61986 numMergedOcc 0
21 mol 231 unq 0 iso 0 dist 9.16488 6.17101 7.28719 8.17766 5.3251 9.98232 11.3675 7.79865 10.9863 7.37839 numMergedOcc 0
22 mol 231 unq 1 iso 0 dist 9.16488 6.17101 7.28719 8.17766 5.3251 9.98232 12.5238 6.14348 10.2117 8.40182 numMergedOcc 0
23 mol 241 unq 0 iso 0 dist 8.99792 7.14491 9.174 8.62971 4.86437 6.40592 4.99503 9.72526 7.93809 7.4631 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 9.97669 11.7587 4.03921 4.96568 5.11366 7.54805 5.25115 12.3211 12.5953 8.4218 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.85653 8.89193 8.57035 8.27977 6.03718 5.17586 13.1217 14.3672 5.9229 9.70696 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 9.40138 5.64349 7.93511 7.70229 4.58403 6.84554 8.93697 5.67266 9.67023 8.76532 numMergedOcc 0
27 mol 282 unq 1 iso 0 dist 9.40138 5.64349 7.93511 7.90792 5.04235 9.51581 8.93697 5.67266 9.67023 6.33524 numMergedOcc 0
