0 mol 1 unq 0 iso 0 dist 6.35771 7.55819 5.65716 9.43252 8.26708 4.36042 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.35771 7.55819 5.65716 10.7006 6.09918 6.44928 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.02191 6.27808 8.77074 14.8353 9.27637 17.4675 numMergedOcc 0
3 mol 13 unq 0 iso 0 dist 7.56303 9.77526 5.04036 7.01217 5.78148 5.6314 numMergedOcc 0
4 mol 13 unq 1 iso 0 dist 7.56303 9.77526 5.04036 7.16388 6.26071 4.17261 numMergedOcc 0
5 mol 13 unq 2 iso 0 dist 7.56303 9.77526 5.04036 10.9053 8.43325 6.68749 numMergedOcc 0
6 mol 13 unq 3 iso 0 dist 7.56303 8.77656 9.44958 7.01217 5.78148 11.3605 numMergedOcc 0
7 mol 13 unq 4 iso 0 dist 7.56303 8.77656 9.44958 7.16388 6.26071 13.8587 numMergedOcc 0
8 mol 13 unq 5 iso 0 dist 7.56303 8.77656 9.44958 10.9053 8.43325 16.4369 numMergedOcc 0
9 mol 28 unq 0 iso 0 dist 6.69917 13.6284 9.00593 5.66714 7.28416 9.68942 numMergedOcc 0
10 mol 44 unq 0 iso 0 dist 5.06773 5.57404 7.03812 9.6925 7.52117 11.0744 numMergedOcc 0
11 mol 44 unq 1 iso 0 dist 8.2444 7.08048 7.03812 14.7948 7.52117 11.0744 numMergedOcc 0
12 mol 53 unq 0 iso 0 dist 7.61675 10.3698 9.23241 12.1831 7.09169 13.8028 numMergedOcc 0
13 mol 53 unq 1 iso 0 dist 9.64645 12.1711 9.23241 7.56636 7.09169 13.8028 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 9.26179 9.60689 6.53468 14.2704 8.03303 14.2026 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 9.26179 12.6588 5.90954 14.2704 8.03303 9.27925 numMergedOcc 0
16 mol 112 unq 0 iso 0 dist 5.82495 6.50047 7.98999 5.43987 7.23962 6.68714 numMergedOcc 0
17 mol 112 unq 1 iso 0 dist 5.82495 6.50047 7.98999 11.3454 9.00067 10.8795 numMergedOcc 0
18 mol 112 unq 2 iso 0 dist 5.82495 6.50047 7.98999 14.3588 9.89499 13.2606 numMergedOcc 0
19 mol 112 unq 3 iso 0 dist 5.82495 6.50047 7.98999 9.7695 7.30204 6.71889 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 7.83401 6.53566 6.0733 6.89903 8.56003 4.58263 numMergedOcc 0
21 mol 148 unq 0 iso 0 dist 9.14135 5.92269 5.06687 9.14127 9.02318 5.59872 numMergedOcc 0
22 mol 148 unq 1 iso 0 dist 9.14135 5.92269 5.06687 14.7238 9.74542 9.27313 numMergedOcc 0
23 mol 148 unq 2 iso 0 dist 9.14135 5.92269 5.06687 11.3515 7.97543 8.61198 numMergedOcc 0
24 mol 150 unq 0 iso 0 dist 9.12067 5.95123 5.09809 14.7649 9.6606 9.25213 numMergedOcc 0
25 mol 150 unq 1 iso 0 dist 9.12067 5.95123 5.09809 11.4349 7.85526 8.68422 numMergedOcc 0
26 mol 150 unq 2 iso 0 dist 9.12067 5.95123 5.09809 9.10666 8.94552 5.56996 numMergedOcc 0
27 mol 158 unq 0 iso 0 dist 8.15524 10.973 6.92225 14.6279 7.88319 9.86605 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 9.76706 8.2035 7.31388 7.19612 5.37446 3.84723 numMergedOcc 0
29 mol 252 unq 0 iso 0 dist 9.00798 6.6854 5.22349 6.57025 6.11473 8.32163 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 7.2551 3.93775 5.70326 5.61312 9.3936 9.08161 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 9.99345 9.47753 9.2542 14.8586 7.91611 11.198 numMergedOcc 0
