0 mol 16 unq 0 iso 0 dist 7.979 6.32859 9.31149 5.96976 5.36911 4.74317 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 8.01516 10.5523 7.41952 4.05986 7.99438 9.30887 numMergedOcc 0
2 mol 79 unq 1 iso 0 dist 8.01516 10.5523 7.41952 4.91535 6.64915 11.3722 numMergedOcc 0
3 mol 123 unq 0 iso 0 dist 8.56386 14.7054 9.86842 12.3975 9.04549 4.86652 numMergedOcc 0
4 mol 165 unq 0 iso 0 dist 9.8446 9.75412 9.59989 9.96973 5.79029 9.33914 numMergedOcc 0
5 mol 171 unq 0 iso 0 dist 6.20851 14.0871 9.47945 4.47323 6.4751 15.864 numMergedOcc 0
6 mol 171 unq 1 iso 0 dist 6.20851 14.0871 9.47945 4.73373 5.75085 14.3848 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 8.84813 4.23524 5.97008 15.7288 9.31172 14.253 numMergedOcc 0
8 mol 223 unq 0 iso 0 dist 7.29418 5.59816 6.03408 4.29891 7.24878 4.89887 numMergedOcc 0
9 mol 223 unq 1 iso 0 dist 8.63099 4.04961 6.03408 5.70788 7.24878 4.89887 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 7.54614 9.97507 7.20862 5.94294 5.3747 8.58832 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 7.78329 5.82891 6.91184 8.97694 9.62583 4.98219 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 5.6568 10.0728 7.6402 5.99041 8.88405 8.43621 numMergedOcc 0
13 mol 236 unq 1 iso 0 dist 5.6568 10.0728 7.6402 5.55311 7.13854 6.96377 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 8.96917 5.37052 7.41298 4.85571 9.30143 6.97807 numMergedOcc 0
15 mol 241 unq 1 iso 0 dist 8.96917 4.58303 9.99337 4.85571 9.30143 9.37079 numMergedOcc 0
16 mol 244 unq 0 iso 0 dist 9.53211 13.7123 6.51428 9.01951 9.97458 16.0237 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.33791 9.58851 8.61786 12.6676 9.54381 5.4894 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 9.33791 11.5981 8.42706 12.6676 9.54381 15.3099 numMergedOcc 0
19 mol 271 unq 0 iso 0 dist 9.80493 13.1235 8.07242 6.15348 5.75889 7.0065 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.56601 6.17316 5.78017 12.9629 9.29922 13.4771 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 9.56601 13.1019 8.78203 12.9629 9.29922 12.7014 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 7.78355 10.0698 6.83927 8.48093 8.47055 4.6462 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 8.55037 7.77878 8.0661 7.33654 7.14502 7.87119 numMergedOcc 0
