0 mol 7 unq 0 iso 0 dist 9.8592 7.91041 9.67498 9.95133 10.0257 8.57437 10.8066 15.0231 9.85726 17.7278 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.96502 5.25196 8.30431 6.01552 8.24748 9.67403 5.50504 6.32949 9.62468 4.90701 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 7.96502 5.25196 8.30431 12.1428 14.4616 7.28917 5.50504 6.32949 9.62468 16.7918 numMergedOcc 0
3 mol 61 unq 2 iso 0 dist 7.96502 6.97911 4.628 12.9321 9.53688 9.82315 5.50504 6.32949 5.92705 7.49081 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.98532 5.38868 8.67865 8.03407 8.6267 6.78043 8.3558 5.1767 4.98104 7.17015 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.98532 5.38868 8.67865 6.39759 4.68995 5.74364 8.3558 5.1767 4.98104 4.52119 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.47105 10.6706 7.50126 16.1333 14.0828 6.85651 16.0647 15.9524 8.84018 4.84607 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 7.47105 10.6706 7.50126 16.9054 11.5586 7.03858 16.0647 15.9524 8.84018 11.981 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.614 9.24302 8.78709 8.96735 5.53632 4.96259 10.043 9.49952 6.00053 4.11061 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 6.3687 12.3798 7.20862 13.0464 6.92911 8.10096 16.2939 10.5706 9.5723 5.47434 numMergedOcc 0
10 mol 227 unq 0 iso 0 dist 8.32703 5.55239 5.2851 5.36841 7.27568 6.14732 10.4039 5.14019 9.18675 10.9746 numMergedOcc 0
11 mol 227 unq 1 iso 0 dist 8.25412 5.34424 5.2851 10.9438 7.27568 6.14732 9.66521 5.14019 9.18675 10.9746 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 7.16232 10.121 9.174 12.4569 6.70277 8.15897 6.90245 7.93809 9.72526 9.87799 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 9.44017 13.998 8.81903 17.7905 9.59994 7.52227 12.4086 5.28949 6.60309 5.58906 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 6.03414 5.49004 8.87405 8.79625 8.84423 6.83278 9.91518 8.66976 9.82774 13.5373 numMergedOcc 0
