0 mol 43 unq 0 iso 0 dist 6.6263 7.39848 5.14161 10.8828 8.34145 12.2699 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 5.5087 7.37171 10.0644 6.41115 8.46627 4.27766 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 5.61588 8.62079 10.0644 5.9144 8.46627 4.27766 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 6.08682 7.37171 12.1501 6.41115 9.22208 4.27766 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 7.83244 8.62079 12.1501 5.9144 9.22208 4.27766 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.13008 4.17838 7.35325 9.50063 8.89015 11.0244 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 7.79505 6.80627 11.1934 7.58649 9.97028 12.9326 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.07097 7.46621 8.53163 13.2918 7.92216 15.9403 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 5.37047 8.64905 10.4448 7.39837 9.29944 6.60366 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 5.40637 8.99891 5.94217 4.78563 9.29944 12.5751 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.01624 8.29467 11.4645 5.42158 9.92831 10.2602 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 5.96423 9.84566 9.71065 4.08775 4.61596 12.4197 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 5.96423 8.22001 3.30691 4.08775 4.61596 7.25623 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 9.10817 9.23086 17.435 9.61454 6.69042 18.7047 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 9.31526 9.7657 3.70259 12.1607 9.91727 7.04521 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.49765 9.31158 6.49396 8.97813 5.03818 7.68686 numMergedOcc 0
16 mol 251 unq 0 iso 0 dist 6.50357 8.45764 3.45567 11.5298 9.02417 7.72528 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 5.46926 7.42932 5.9732 4.40029 7.16209 5.13533 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.9682 4.9764 5.9732 3.97543 7.16209 5.13533 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 8.9682 6.36559 8.61922 3.97543 7.16209 8.0969 numMergedOcc 0
20 mol 277 unq 3 iso 0 dist 5.13913 7.42932 3.79766 4.40029 4.62936 5.13533 numMergedOcc 0
21 mol 277 unq 4 iso 0 dist 6.92711 4.9764 3.79766 3.97543 4.62936 5.13533 numMergedOcc 0
22 mol 277 unq 5 iso 0 dist 6.92711 6.36559 7.07613 3.97543 4.62936 8.0969 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.46442 9.96374 3.08474 17.5073 9.23612 9.21469 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 9.46442 5.41432 7.07029 17.5073 9.23612 16.2796 numMergedOcc 0
25 mol 292 unq 2 iso 0 dist 9.9886 9.93746 3.44186 6.73772 7.89938 9.56933 numMergedOcc 0
