0 mol 16 unq 0 iso 0 dist 6.32791 5.28404 4.7319 11.4198 6.51133 6.72833 11.1182 7.65889 6.86055 5.94982 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.34277 5.55893 5.04899 8.98227 7.33728 7.45383 4.68147 7.05196 6.47509 5.20109 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.40763 6.7276 5.04899 13.0625 7.33728 7.45383 9.41688 7.05196 6.47509 5.20109 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.46842 13.3513 7.57578 14.0507 6.08585 8.50222 14.3527 11.037 13.2447 9.16515 numMergedOcc 0
4 mol 25 unq 3 iso 0 dist 8.46842 13.3513 7.57578 14.0507 6.08585 8.50222 17.7636 13.0315 11.8139 9.82987 numMergedOcc 0
5 mol 25 unq 4 iso 0 dist 8.46842 13.3513 7.57578 14.0507 6.08585 8.50222 18.3659 11.971 6.28979 9.40732 numMergedOcc 0
6 mol 25 unq 5 iso 0 dist 8.46842 13.3513 7.57578 14.0507 6.08585 8.50222 16.8735 9.48085 5.18617 6.53269 numMergedOcc 0
7 mol 25 unq 6 iso 0 dist 8.46842 14.4516 7.17969 14.0507 6.08585 7.55264 14.3527 11.037 14.9982 9.16515 numMergedOcc 0
8 mol 25 unq 7 iso 0 dist 8.46842 14.4516 7.17969 14.0507 6.08585 7.55264 17.7636 13.0315 14.1251 9.82987 numMergedOcc 0
9 mol 25 unq 8 iso 0 dist 8.46842 14.4516 7.17969 14.0507 6.08585 7.55264 18.3659 11.971 8.41421 9.40732 numMergedOcc 0
10 mol 25 unq 9 iso 0 dist 8.46842 14.4516 7.17969 14.0507 6.08585 7.55264 16.8735 9.48085 5.68041 6.53269 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 7.02792 11.4302 9.35224 13.8692 10.0456 7.01812 12.293 11.5088 4.03277 6.59691 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 7.02792 6.20162 6.56369 13.8692 10.0456 8.30845 12.293 11.5088 6.23008 6.59691 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.34456 4.83846 5.86073 10.0722 10.1816 8.8822 16.6435 15.7535 13.9729 9.30645 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 9.06272 10.7142 5.83384 12.3006 7.29399 4.97175 14.6368 11.8464 6.16616 9.35533 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.85025 4.26332 6.29155 9.196 4.54648 6.16242 13.4842 8.77023 13.0405 8.83732 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.85025 11.5948 6.80239 9.196 4.54648 5.87634 13.4842 8.77023 13.7612 8.83732 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 8.31743 10.2414 9.89303 11.1414 4.60632 7.69991 19.6907 13.0242 12.847 9.0176 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 8.5778 10.2414 6.54501 11.1414 5.71679 7.69991 19.6907 11.988 12.847 9.0176 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 8.5778 13.5276 6.49416 11.1414 5.71679 6.23142 19.6907 11.988 8.06642 9.0176 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 7.21035 8.27436 9.31746 11.4047 7.68794 6.73956 13.0863 13.5224 4.88992 8.62102 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 8.58465 6.37463 7.54065 14.51 11.7429 8.73217 15.5317 17.8564 10.8286 9.99396 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 9.65951 9.99471 8.51516 12.9264 5.86489 7.32294 4.51957 7.9133 5.57347 9.48625 numMergedOcc 0
23 mol 204 unq 1 iso 0 dist 9.14829 13.2127 8.51516 14.6586 5.86489 7.32294 9.9552 7.9133 5.57347 9.48625 numMergedOcc 0
24 mol 229 unq 0 iso 0 dist 9.68636 10.705 8.22528 15.5316 6.65022 8.66332 9.76444 7.27993 5.70473 9.37336 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 6.94983 5.08111 8.27212 8.70651 4.9377 9.40808 7.30782 6.71524 5.10213 9.9183 numMergedOcc 0
