0 mol 16 unq 0 iso 0 dist 7.34873 8.06584 10.2769 9.92391 8.36361 16.7437 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.36951 9.3973 6.37687 7.5289 7.31253 11.9926 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.87499 8.3224 5.38977 13.1527 8.51968 9.37602 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 8.87499 8.71602 5.29629 13.1527 8.51968 13.7516 numMergedOcc 0
4 mol 30 unq 2 iso 0 dist 8.87499 7.54379 9.17076 13.1527 8.51968 16.7483 numMergedOcc 0
5 mol 33 unq 0 iso 0 dist 7.37592 9.67585 13.5924 12.5179 9.69775 21.1899 numMergedOcc 0
6 mol 33 unq 1 iso 0 dist 7.37592 9.67585 13.5924 11.7701 9.01202 20.9354 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.37149 9.99971 6.60498 5.9344 8.02004 9.61448 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.54468 7.10218 12.2009 6.86446 9.5345 13.9501 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.54468 7.10218 12.2009 10.5257 7.61405 16.4853 numMergedOcc 0
10 mol 78 unq 0 iso 0 dist 8.90372 8.56119 6.6691 5.18488 6.22956 9.6163 numMergedOcc 0
11 mol 78 unq 1 iso 0 dist 8.90372 8.56119 6.6691 3.86636 9.51587 11.1316 numMergedOcc 0
12 mol 78 unq 2 iso 0 dist 6.09124 8.56119 6.09402 3.86636 9.04246 11.1316 numMergedOcc 0
13 mol 108 unq 0 iso 0 dist 8.58106 9.57959 3.94147 6.36177 9.89763 11.1444 numMergedOcc 0
14 mol 108 unq 1 iso 0 dist 8.58106 9.57959 3.94147 8.67837 8.49918 5.60118 numMergedOcc 0
15 mol 209 unq 0 iso 0 dist 7.55818 7.56664 8.88962 7.38057 8.50624 12.8205 numMergedOcc 0
16 mol 209 unq 1 iso 0 dist 7.55818 9.65614 10.7239 7.38057 8.50624 13.5081 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.75987 9.41353 3.64097 9.67075 9.62606 12.8776 numMergedOcc 0
18 mol 217 unq 1 iso 0 dist 8.75987 8.28155 8.43469 9.67075 9.62606 14.6994 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 9.31001 8.56943 17.1006 7.53396 9.20848 11.5526 numMergedOcc 0
