0 mol 1 unq 0 iso 0 dist 7.59404 7.20594 6.15359 10.5157 11.9886 9.62879 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 8.27424 4.52881 8.70604 7.26957 12.2 9.53901 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 6.4519 4.52881 5.23045 7.26957 11.1522 9.53901 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 9.89949 8.49367 4.54634 7.74994 10.3621 7.24782 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 9.89949 8.49367 4.54634 10.1982 10.4022 5.95004 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.96618 6.70384 6.2317 9.12953 14.0563 7.93891 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.96618 4.4727 7.6278 9.23219 17.0244 9.51608 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 9.96618 4.4727 7.6278 9.12953 14.0563 8.62536 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 7.71423 6.70384 4.61111 9.12953 12.2609 7.93891 numMergedOcc 0
9 mol 76 unq 4 iso 0 dist 7.71423 4.4727 6.88001 9.23219 16.0284 9.51608 numMergedOcc 0
10 mol 76 unq 5 iso 0 dist 7.71423 4.4727 6.88001 9.12953 12.2609 8.62536 numMergedOcc 0
11 mol 76 unq 6 iso 0 dist 8.2344 6.70384 9.21921 9.12953 11.4879 7.93891 numMergedOcc 0
12 mol 76 unq 7 iso 0 dist 8.2344 4.4727 11.1773 9.23219 16.4463 9.51608 numMergedOcc 0
13 mol 76 unq 8 iso 0 dist 8.2344 4.4727 11.1773 9.12953 11.4879 8.62536 numMergedOcc 0
14 mol 89 unq 0 iso 0 dist 6.68154 5.37527 4.93796 10.5526 13.5812 9.14778 numMergedOcc 0
15 mol 99 unq 0 iso 0 dist 4.06171 6.24473 6.9006 5.77364 7.09617 8.23566 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 7.54666 7.04929 10.7924 9.05995 16.4127 9.74763 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 8.74464 6.30762 12.8661 5.7687 12.7607 7.8034 numMergedOcc 0
18 mol 148 unq 0 iso 0 dist 8.6499 6.81055 5.13979 14.2356 11.122 9.74966 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.75339 6.77966 5.23046 14.3323 11.1553 9.87914 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 8.8495 8.94211 4.02883 11.5025 11.0949 7.14871 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 8.00688 8.94211 8.28418 11.5025 14.5303 7.14871 numMergedOcc 0
22 mol 251 unq 0 iso 0 dist 6.70168 7.65571 4.44097 11.9304 11.3965 9.22712 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 8.50624 9.09556 13.152 11.1145 18.4852 8.19772 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 9.00473 7.71744 5.34977 3.90949 11.1884 8.38071 numMergedOcc 0
25 mol 284 unq 1 iso 0 dist 9.00473 4.70976 4.80547 3.90949 11.1884 7.80784 numMergedOcc 0
