0 mol 35 unq 0 iso 0 dist 6.82998 4.89526 4.08654 8.20317 9.466 5.55901 numMergedOcc 0
1 mol 35 unq 1 iso 0 dist 7.95265 5.31257 4.08654 6.65776 9.466 5.55901 numMergedOcc 0
2 mol 35 unq 2 iso 0 dist 9.0429 8.72659 4.08654 12.1607 9.466 5.55901 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.90344 6.29097 11.1916 13.2808 18.3902 9.57191 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.45418 6.29097 10.9634 13.2808 15.6324 9.57191 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.02605 6.29097 8.87084 13.2808 12.8754 9.57191 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 6.2216 7.10637 11.9262 15.2184 19.5459 9.57191 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 8.44427 8.13992 5.40759 5.46827 9.23023 9.739 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 7.34329 9.83521 9.91165 17.5548 16.4626 8.79457 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 7.34329 9.83521 9.91165 6.6176 11.976 9.25264 numMergedOcc 0
10 mol 83 unq 2 iso 0 dist 9.52645 6.97373 11.0878 4.89289 12.0556 9.94635 numMergedOcc 0
11 mol 91 unq 0 iso 0 dist 8.17924 6.18317 10.3492 9.72224 15.3864 5.11803 numMergedOcc 0
12 mol 105 unq 0 iso 0 dist 8.34566 4.43679 7.42954 5.7477 12.9081 8.03876 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 6.83313 9.78498 6.3084 6.26588 10.0998 9.91321 numMergedOcc 0
14 mol 127 unq 1 iso 0 dist 4.84594 9.78498 12.4721 6.26588 9.42513 9.91321 numMergedOcc 0
15 mol 162 unq 0 iso 0 dist 8.21854 9.27308 5.65753 10.3669 12.6002 8.99034 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 8.55939 5.65941 4.0303 7.34694 9.66407 8.00931 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 8.55939 5.65941 4.0303 4.86112 11.403 9.65262 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 7.73514 6.49342 6.26263 10.3638 10.218 9.99096 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 7.2365 6.64055 7.703 6.16781 7.4878 6.32455 numMergedOcc 0
