0 mol 8 unq 0 iso 0 dist 6.27477 8.76702 8.02605 7.55301 8.99126 14.849 6.1146 7.8922 13.7261 6.69972 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 7.95122 9.74268 5.22626 10.7301 8.33704 7.92394 7.98177 9.31969 6.54023 11.6542 numMergedOcc 0
2 mol 70 unq 1 iso 0 dist 9.74268 7.95122 5.22626 10.7301 7.92394 8.33704 7.98177 6.54023 9.31969 11.6542 numMergedOcc 0
3 mol 70 unq 2 iso 0 dist 9.74268 7.95122 5.22626 11.7565 9.93423 11.6205 7.98177 6.54023 9.31969 11.7156 numMergedOcc 0
4 mol 70 unq 3 iso 0 dist 9.74268 7.95122 5.22626 12.3296 9.34122 13.4942 7.98177 6.54023 9.31969 4.95817 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 9.26343 9.91446 13.8729 11.6898 8.72704 14.4345 8.90536 9.00544 18.0041 14.6145 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 9.26343 9.91446 13.8729 11.6898 8.72704 14.4345 5.69359 7.12017 10.8066 6.00843 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 5.87387 6.06543 5.59517 6.2394 8.71128 7.52743 11.3694 6.34525 11.6441 14.3491 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 9.69757 9.64856 11.0599 12.4356 8.6243 16.8701 6.53994 8.71039 10.5099 8.15392 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 9.69757 9.64856 11.0599 12.4356 8.6243 16.8701 13.4383 6.92648 13.9687 6.01893 numMergedOcc 0
10 mol 131 unq 2 iso 0 dist 9.69757 6.38977 5.55373 12.4356 8.6243 12.5969 6.53994 8.71039 8.86329 8.15392 numMergedOcc 0
11 mol 131 unq 3 iso 0 dist 9.69757 6.38977 5.55373 12.4356 8.6243 12.5969 13.4383 6.92648 11.4206 6.01893 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 4.93035 9.75558 6.21253 6.70767 6.93652 11.8898 5.74529 6.69515 7.86572 8.00633 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.25528 6.96824 11.9017 14.3955 6.94688 15.7174 6.09526 6.51749 11.6563 10.4684 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.25528 6.96824 11.9017 15.6271 6.71012 16.3976 6.09526 6.51749 11.6563 12.69 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.92766 6.32652 12.5143 13.2566 5.90931 16.9866 10.2224 6.85441 16.2661 10.7974 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 6.18486 9.93154 9.51866 5.31715 8.83563 14.4583 5.98086 5.87815 13.9889 4.3387 numMergedOcc 0
17 mol 227 unq 1 iso 0 dist 6.18486 9.18218 4.48529 5.31715 8.83563 12.9801 5.98086 5.87815 10.3595 4.3387 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 7.2527 7.13194 10.0191 14.0776 9.90142 10.7386 9.87539 6.66971 7.32982 5.8333 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 7.13194 7.2527 10.0191 14.751 9.29858 12.5477 9.87539 7.32982 6.66971 6.48619 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 9.29203 7.62771 5.40359 11.091 9.90142 5.9216 10.4401 6.66971 6.4398 5.8333 numMergedOcc 0
21 mol 238 unq 3 iso 0 dist 9.29203 7.80166 10.0191 11.091 9.90142 10.7386 10.4401 6.66971 7.32982 5.8333 numMergedOcc 0
22 mol 238 unq 4 iso 0 dist 7.62771 9.29203 5.40359 12.4266 9.68513 12.5477 10.4401 6.4398 6.66971 6.48619 numMergedOcc 0
23 mol 238 unq 5 iso 0 dist 7.62771 9.29203 5.40359 11.091 5.9216 9.90142 10.4401 6.4398 6.66971 5.8333 numMergedOcc 0
24 mol 238 unq 6 iso 0 dist 7.62771 7.80166 10.1648 12.4266 9.68513 9.29858 10.4401 6.4398 7.32982 6.48619 numMergedOcc 0
25 mol 238 unq 7 iso 0 dist 7.62771 7.80166 10.1648 11.091 5.9216 10.7386 10.4401 6.4398 7.32982 5.8333 numMergedOcc 0
26 mol 238 unq 8 iso 0 dist 7.80166 9.29203 10.0191 12.4266 9.29858 12.5477 10.4401 7.32982 6.66971 6.48619 numMergedOcc 0
27 mol 238 unq 9 iso 0 dist 7.80166 7.62771 10.1648 12.4266 9.29858 9.68513 10.4401 7.32982 6.4398 6.48619 numMergedOcc 0
28 mol 272 unq 0 iso 0 dist 7.66615 7.22438 5.40809 6.68919 9.09992 6.73206 6.43352 9.19033 11.9971 11.8912 numMergedOcc 0
29 mol 272 unq 1 iso 0 dist 7.66615 7.22438 5.40809 8.13036 6.16449 10.1966 6.43352 9.19033 11.9971 6.56154 numMergedOcc 0
