0 mol 12 unq 0 iso 0 dist 9.37134 8.42244 6.52451 7.12948 4.4802 8.98903 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.57724 6.48849 4.99734 9.74802 14.9166 9.92123 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 8.5448 9.63542 6.25789 8.70934 6.00133 4.81351 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 7.77613 8.35897 6.16589 8.23162 4.6013 4.39214 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 7.77613 8.35897 6.16589 6.57908 9.12499 4.76457 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 6.34231 7.27623 9.46692 9.01453 5.89166 7.30972 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.96016 7.40481 13.6683 7.00373 13.0095 10.5767 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 9.13604 9.0655 7.90541 7.81733 6.19595 4.47584 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 5.00508 7.95378 7.24465 9.33636 7.2107 13.4147 numMergedOcc 0
9 mol 239 unq 1 iso 0 dist 8.34798 8.87704 4.72952 9.73021 6.19462 4.81796 numMergedOcc 0
10 mol 260 unq 0 iso 0 dist 7.69551 5.72892 7.55547 8.76664 10.2822 4.85514 numMergedOcc 0
11 mol 260 unq 1 iso 0 dist 7.69551 5.72892 7.55547 9.00987 12.6946 13.212 numMergedOcc 0
12 mol 270 unq 0 iso 0 dist 8.36659 6.17797 11.1641 9.4555 15.1605 7.58893 numMergedOcc 0
