0 mol 7 unq 0 iso 0 dist 5.51421 4.7739 5.99459 13.5184 12.2041 9.67164 14.3048 13.3926 12.2255 6.22805 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.76968 5.36195 8.43054 8.8641 6.92781 6.57331 6.44253 10.6491 9.62324 8.17898 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 8.6396 10.9391 9.49421 16.5953 17.4517 10.985 8.23292 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.18305 5.65986 7.4369 11.0671 5.4148 9.73086 14.9482 10.4766 11.5216 5.79954 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.18305 5.65986 7.4369 11.0671 5.4148 9.73086 17.0347 10.997 16.3376 7.01889 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.10981 9.89481 8.65848 13.9943 7.19663 6.85523 18.757 11.477 14.4224 9.99029 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.72689 10.0429 7.80898 17.1552 12.1547 7.51139 9.96416 10.751 3.42334 9.25163 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 7.74197 11.151 7.80898 14.2965 12.1547 7.51139 13.8649 10.751 3.42334 9.25163 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.92932 3.76211 7.21868 9.60411 5.49782 7.93372 10.6313 10.738 10.8891 5.67862 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 9.60369 4.63732 9.66543 12.1043 10.7144 7.93372 15.363 16.1802 10.8891 5.67862 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 9.55556 4.63732 7.21868 12.1043 5.49782 7.93372 15.363 10.738 10.8891 5.67862 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.96988 3.6848 8.90571 9.44405 7.09479 6.61112 9.26214 12.9799 5.85073 7.45401 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 8.6537 3.72432 7.27993 5.57702 7.0298 6.95201 5.17118 12.776 6.80826 8.0007 numMergedOcc 0
13 mol 229 unq 1 iso 0 dist 8.75374 3.72432 9.51168 5.57702 6.54885 6.95201 5.17118 13.2981 6.80826 8.0007 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.86368 9.8663 7.81215 11.8838 10.2693 5.64285 11.554 11.6069 5.07724 9.67966 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.54857 5.13138 6.95511 14.0139 6.96053 9.46361 13.2213 11.1532 8.41608 6.96379 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 7.36905 3.63202 5.90924 6.83408 8.96144 9.58916 4.93509 10.9135 8.11813 6.80096 numMergedOcc 0
