0 mol 54 unq 0 iso 0 dist 5.2932 4.54652 6.31564 9.93082 14.2343 13.0181 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 5.2932 7.42848 4.94741 9.93082 14.2343 15.5074 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.43344 9.97867 12.3008 7.64322 6.32283 6.99666 numMergedOcc 0
3 mol 128 unq 0 iso 0 dist 7.44522 9.52878 11.5809 9.47151 8.51251 9.88328 numMergedOcc 0
4 mol 128 unq 1 iso 0 dist 7.44522 9.52878 11.5809 6.18485 6.09348 11.0083 numMergedOcc 0
5 mol 128 unq 2 iso 0 dist 7.37469 9.52878 8.56151 9.47151 6.1339 9.88328 numMergedOcc 0
6 mol 128 unq 3 iso 0 dist 7.37469 9.52878 8.56151 6.18485 5.5313 11.0083 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 4.4004 9.24258 6.68239 6.27279 4.34786 4.17212 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 4.4004 9.55246 7.74794 6.27279 4.34786 9.64263 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.22459 9.40268 13.0103 9.34662 12.6435 16.2032 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.60304 8.64606 12.2185 8.71163 4.31702 13.5514 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 9.81785 7.89425 8.67242 7.96385 13.8868 11.2154 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 9.81785 8.36552 7.48392 7.96385 13.8868 15.7327 numMergedOcc 0
13 mol 176 unq 2 iso 0 dist 9.81785 7.8954 16.2744 7.96385 13.8868 5.08362 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 6.76322 7.42532 3.60144 9.36505 11.4857 9.91514 numMergedOcc 0
15 mol 211 unq 0 iso 0 dist 9.53956 7.79873 7.9703 9.69937 9.59572 13.9486 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 6.39171 6.65505 3.5334 7.36234 8.0328 6.58374 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 5.54546 7.66682 8.64534 8.35986 4.09981 8.22593 numMergedOcc 0
