0 mol 32 unq 0 iso 0 dist 7.26268 8.91596 6.37026 10.7345 11.9642 8.78511 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 9.19165 7.68478 5.08577 10.0309 13.2493 8.50003 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 9.19165 7.68478 5.08577 10.622 12.0794 7.00717 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 8.69057 8.34191 11.7295 6.18181 13.1572 9.86895 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 8.96727 7.17488 10.5853 10.0669 14.1301 9.10675 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 8.01308 7.17488 5.11422 10.0669 11.3747 9.10675 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.72682 8.62079 14.0236 5.9144 9.94443 4.27766 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.45841 8.62079 11.9118 5.9144 10.7236 4.27766 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 5.5087 7.37171 10.0644 6.41115 8.46627 4.27766 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 5.61588 8.62079 10.0644 5.9144 8.46627 4.27766 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 6.08682 7.37171 12.1501 6.41115 9.22208 4.27766 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 7.83244 8.62079 12.1501 5.9144 9.22208 4.27766 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 8.28795 8.51123 6.51576 3.87365 10.1658 7.54274 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.37047 8.64905 10.4448 7.39837 9.29944 6.60366 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 8.97589 8.22001 3.88698 4.08775 9.52678 7.25623 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 5.96423 8.22001 3.30691 4.08775 4.61596 7.25623 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.73533 5.90765 3.60793 3.90244 11.5162 8.92135 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 9.31526 9.7657 3.70259 12.1607 9.91727 7.04521 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.49765 9.31158 6.49396 8.97813 5.03818 7.68686 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 7.39775 8.45764 5.79539 11.5298 12.5936 7.72528 numMergedOcc 0
20 mol 251 unq 1 iso 0 dist 6.50357 8.45764 3.45567 11.5298 9.02417 7.72528 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 9.35539 4.9764 13.2853 3.97543 13.0595 5.13533 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 5.46926 7.42932 5.9732 4.40029 7.16209 5.13533 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 8.9682 4.9764 5.9732 3.97543 7.16209 5.13533 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 5.13913 7.42932 3.79766 4.40029 4.62936 5.13533 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 6.92711 4.9764 3.79766 3.97543 4.62936 5.13533 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 9.46442 9.96374 3.08474 17.5073 9.23612 9.21469 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 7.30758 9.96374 6.12546 17.5073 11.928 9.21469 numMergedOcc 0
28 mol 292 unq 2 iso 0 dist 9.90967 9.93746 5.04658 6.73772 12.5251 9.56933 numMergedOcc 0
29 mol 292 unq 3 iso 0 dist 9.9886 9.93746 3.44186 6.73772 7.89938 9.56933 numMergedOcc 0
30 mol 292 unq 4 iso 0 dist 9.5785 9.96374 12.0714 17.5073 20.473 9.21469 numMergedOcc 0
31 mol 292 unq 5 iso 0 dist 9.76319 9.96374 12.7236 17.5073 21.9374 9.21469 numMergedOcc 0
