0 mol 1 unq 0 iso 0 dist 8.93702 7.48521 5.96833 9.40282 5.11735 6.86701 4.61559 7.90928 5.06184 6.4181 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.34656 16.3136 8.81608 12.8676 10.515 9.67164 20.9845 20.1827 16.6461 9.8603 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.34656 16.3136 8.81608 13.0935 6.06176 5.99459 17.9044 10.9688 4.7739 5.51421 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.89196 7.751 9.1062 8.27156 5.49555 6.9103 8.33049 8.84323 5.46563 8.1599 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 6.85365 4.9759 8.91262 7.42474 6.35364 9.05166 6.92638 9.45003 3.61827 7.53905 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 6.85365 6.59976 6.12922 7.42474 6.35364 5.56994 6.92638 9.45003 3.78964 7.53905 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.43229 9.02908 8.0168 11.172 10.9739 9.42082 11.363 13.1716 12.6105 5.02717 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 4.95674 7.44092 8.55349 9.00172 9.53782 8.77023 13.3005 15.0113 11.5628 5.82404 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.17226 11.0449 8.55349 15.6173 9.53782 8.77023 20.7162 15.0113 11.5628 5.82404 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 7.13287 9.1255 7.05845 12.4841 6.01455 7.36975 15.0826 11.674 9.60065 8.30654 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.58245 9.66766 9.27218 6.18446 5.2908 9.10817 10.0696 10.7619 17.2264 8.3337 numMergedOcc 0
11 mol 234 unq 0 iso 0 dist 7.54327 16.363 9.11572 11.234 5.56749 7.81215 16.2393 10.0197 9.8663 7.86368 numMergedOcc 0
12 mol 267 unq 0 iso 0 dist 6.87713 10.6273 5.08174 11.3997 6.45566 7.34981 17.9834 11.2069 8.3484 9.62043 numMergedOcc 0
13 mol 267 unq 1 iso 0 dist 8.87518 10.1261 5.08174 10.4269 6.45566 7.34981 8.81614 11.2069 8.3484 9.62043 numMergedOcc 0
14 mol 272 unq 0 iso 0 dist 6.27189 13.4399 8.84523 12.454 6.64985 6.44147 15.0607 11.6311 3.7218 9.64596 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 8.38395 11.3961 6.66172 12.6182 5.31116 6.4611 18.1729 10.1897 11.4981 9.65265 numMergedOcc 0
