0 mol 10 unq 0 iso 0 dist 7.82875 10.5356 6.18431 14.7208 7.06787 9.07726 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 7.92518 6.8989 6.13351 10.0661 3.52812 8.20298 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.79061 5.00474 6.14542 11.6655 3.30399 8.96616 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.26763 9.40625 9.77084 6.30814 6.48468 6.5551 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 6.30814 9.40625 6.5551 8.26763 6.48468 9.77084 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 8.93288 14.0288 9.95355 11.1719 3.82203 9.69913 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 7.95751 4.1584 7.42144 5.39002 3.3724 6.27658 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 5.39002 4.1584 6.27658 7.95751 3.3724 7.42144 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 8.18217 6.6467 9.85438 5.51167 13.6611 9.42807 numMergedOcc 0
9 mol 168 unq 1 iso 0 dist 5.51167 6.6467 9.42807 8.18217 13.6611 9.85438 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 5.97971 7.18433 5.99437 9.30874 3.55187 8.4848 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 8.72747 6.37887 5.99437 12.2435 3.55187 8.4848 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 8.23845 4.94211 5.99437 11.4007 3.55187 8.4848 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.84679 9.12063 6.88127 13.9764 8.40937 6.56416 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 7.99441 4.07008 8.43195 6.71817 3.58181 8.23406 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 6.71817 4.07008 8.23406 7.99441 3.58181 8.43195 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 7.71863 4.86001 9.46687 10.0366 17.5293 9.25617 numMergedOcc 0
