0 mol 18 unq 0 iso 0 dist 7.06449 5.97199 5.01765 7.30231 6.27866 6.23161 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 5.47336 4.31912 4.72799 8.35776 9.30168 4.84198 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.61052 4.93077 9.82767 4.74574 6.84869 3.75088 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 9.36203 8.91572 7.29999 8.1717 4.85685 5.27573 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 8.26316 6.40728 6.73018 6.5009 4.27141 3.93602 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 8.60797 7.44647 8.9241 5.43098 9.10091 3.77436 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 8.60797 7.44647 8.9241 9.40555 10.7807 8.38696 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 7.09826 8.3399 4.91072 5.52904 6.8994 9.69029 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 9.67536 8.92131 14.8775 8.89556 17.8355 6.33976 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 9.25815 8.92131 16.6436 8.89556 17.5881 6.33976 numMergedOcc 0
10 mol 187 unq 0 iso 0 dist 8.52941 6.00248 5.83106 8.26077 9.72524 4.87462 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 4.42722 5.44212 4.66802 7.39043 6.47265 9.1398 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 8.66699 8.23463 9.20125 9.02494 15.0717 10.2743 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 8.66699 8.23463 9.20125 8.83641 10.6012 15.7461 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 6.75968 8.23463 14.4372 9.02494 11.5114 10.2743 numMergedOcc 0
15 mol 225 unq 3 iso 0 dist 6.75968 8.23463 14.4372 8.83641 3.90246 15.7461 numMergedOcc 0
16 mol 225 unq 4 iso 0 dist 5.73488 9.16822 4.78147 7.22151 8.58432 8.74865 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 9.10682 6.61098 11.4763 8.26228 12.9881 3.93329 numMergedOcc 0
