0 mol 11 unq 0 iso 0 dist 5.59847 13.2938 9.89425 6.49709 4.10106 6.84216 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 6.72878 10.6462 8.27119 12.8717 6.791 7.42612 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.44727 4.86477 9.46349 5.32149 5.67577 9.1397 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 8.98326 9.00405 4.36087 12.5983 3.79581 6.09002 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 4.29713 5.36021 5.47447 5.36895 7.18662 6.40219 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.91019 4.05022 4.27766 9.49512 6.41115 7.37171 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.91019 4.05022 4.27766 11.5741 5.9144 8.62079 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.57607 6.56529 4.3439 7.90775 4.99174 7.51733 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 8.57607 6.56529 4.3439 9.96562 8.67311 9.01607 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 6.1991 6.56529 6.05855 7.90775 4.46005 7.51733 numMergedOcc 0
10 mol 95 unq 3 iso 0 dist 6.1991 6.56529 6.05855 9.96562 3.94293 9.01607 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 5.32773 3.71942 4.30875 10.8115 5.70579 9.59585 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 5.32773 9.01611 8.65807 10.8115 5.70579 9.7073 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 8.71812 6.28158 7.54274 11.5792 3.87365 8.51123 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.4275 14.7423 8.60651 12.6531 4.94983 6.79114 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 5.30818 3.61063 4.11374 10.8278 5.7891 9.37946 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 5.30818 8.83987 8.37602 10.8278 5.7891 9.13646 numMergedOcc 0
17 mol 169 unq 2 iso 0 dist 8.89822 12.9917 4.11374 6.28961 5.7891 9.37946 numMergedOcc 0
18 mol 169 unq 3 iso 0 dist 8.89822 12.2955 8.37602 6.28961 5.7891 9.13646 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.95209 4.59453 9.4366 6.0639 11.6282 9.65093 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 8.63804 11.3307 8.88902 11.4413 6.84862 5.1609 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 7.95045 14.1621 9.81261 18.527 12.2555 8.55044 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.22453 9.7252 5.13533 8.53324 4.40029 7.42932 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 9.22453 9.7252 5.13533 7.23956 3.97543 4.9764 numMergedOcc 0
