0 mol 9 unq 0 iso 0 dist 8.77074 17.4675 9.27637 12.9363 6.00657 6.11048 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 13.2653 4.93188 8.6586 4.21283 8.23075 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 13.2653 4.93188 13.2236 4.97191 4.7841 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 5.97432 6.17631 5.81959 11.3003 6.32857 7.03372 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.46609 13.1626 8.44506 13.1741 12.4814 7.98005 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.46609 13.1626 8.44506 18.9875 15.4838 8.31381 numMergedOcc 0
6 mol 28 unq 0 iso 0 dist 9.00593 9.68942 7.28416 14.7191 6.37119 8.95154 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 6.13391 6.0968 6.98934 10.6073 9.53672 7.60162 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.27951 5.89379 8.93905 9.16089 9.23272 6.42623 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 9.27951 5.89379 8.93905 14.6365 14.3708 8.95899 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 6.4752 8.95179 5.49226 12.3949 7.88487 8.39897 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 8.48559 6.46702 6.20182 9.067 5.21512 7.93088 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 5.80513 4.12904 8.38738 11.9872 15.2764 9.90947 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 5.80513 4.12904 8.38738 9.37245 12.99 8.16252 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 8.4673 4.27736 5.4969 11.389 6.41193 9.19156 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 9.12296 4.27736 7.35824 11.389 14.7729 9.19156 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 15.1012 7.82899 9.52922 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 7.31388 3.84723 5.37446 9.25184 7.61953 6.85824 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 9.6309 10.8948 6.29511 14.9841 5.46009 7.84952 numMergedOcc 0
19 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 18.419 10.2659 5.77749 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 9.89698 16.8679 7.52109 18.0014 8.96388 8.12739 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 9.89698 16.8679 7.52109 16.307 6.75363 6.09853 numMergedOcc 0
22 mol 274 unq 2 iso 0 dist 7.65671 5.9882 9.56685 11.8576 8.10746 9.83622 numMergedOcc 0
23 mol 274 unq 3 iso 0 dist 7.3996 5.9882 8.49922 11.8576 13.2205 9.83622 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 6.89391 4.16039 5.31728 9.59733 4.12133 6.71946 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 6.89391 4.16039 5.31728 9.51087 10.3898 8.28061 numMergedOcc 0
26 mol 285 unq 2 iso 0 dist 6.89391 4.16039 5.31728 5.28731 6.89311 5.03601 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 9.2542 11.198 7.91611 12.6729 4.65086 8.88595 numMergedOcc 0
