0 mol 0 unq 0 iso 0 dist 5.98788 7.49611 6.91778 11.4849 5.8463 9.67081 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.00738 11.2749 8.6653 15.6741 10.3493 7.03372 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 6.19304 11.7888 7.99969 13.5229 10.8132 8.91596 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 6.48163 11.5195 5.9465 11.4857 5.09449 5.42067 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 6.48163 11.5567 6.97962 11.4857 5.09449 7.36435 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.9575 5.28643 6.97707 9.22398 8.16155 4.76974 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 5.9575 5.28643 6.97707 12.5065 11.4853 8.0336 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 6.87196 5.25879 8.78276 8.12319 3.88766 8.81797 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 6.87196 5.26656 7.88805 8.12319 3.88766 9.81269 numMergedOcc 0
9 mol 130 unq 2 iso 0 dist 6.87196 10.9365 7.96646 8.12319 3.88766 5.92733 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 5.43662 5.29825 8.70296 8.44004 5.92118 8.80895 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 8.30857 7.26802 7.44629 7.667 5.71136 8.92592 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 8.30857 7.26802 7.44629 10.4816 5.46307 9.57452 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 5.25309 7.07865 5.94469 7.39733 3.63671 8.29467 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 6.65725 7.25468 6.42735 7.72354 5.05856 9.84566 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 6.65725 7.25468 6.42735 11.6335 5.69882 8.22001 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 9.819 15.6354 8.65535 7.26295 3.7326 9.52922 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 8.76398 5.97098 7.37798 13.0931 15.5804 8.82761 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 8.52162 11.6549 8.94014 14.3804 13.4894 8.94231 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 8.52162 12.9109 7.02333 14.3804 13.4894 8.88652 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 8.52162 12.3128 8.67864 14.3804 13.4894 6.46771 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 6.68183 5.81799 7.07965 11.5875 8.31265 6.69619 numMergedOcc 0
22 mol 292 unq 1 iso 0 dist 6.68183 5.81799 7.07965 8.27039 5.06937 4.49592 numMergedOcc 0
