0 mol 28 unq 0 iso 0 dist 5.98169 5.51879 8.94643 5.06086 8.11586 7.13468 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.98169 5.51879 8.94643 10.0617 14.6631 9.57803 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 5.98169 11.3454 8.36195 5.06086 8.11586 9.50693 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 6.31487 12.7577 8.97167 14.5054 11.0902 8.33169 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 7.423 13.6562 8.97167 11.9771 11.0902 8.33169 numMergedOcc 0
5 mol 28 unq 5 iso 0 dist 7.07851 12.7577 8.8182 14.5054 8.59089 8.33169 numMergedOcc 0
6 mol 28 unq 6 iso 0 dist 5.89257 13.6562 8.8182 11.9771 8.59089 8.33169 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 7.94697 4.76773 8.57764 9.78763 4.52409 9.03754 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.18193 5.64342 5.87382 5.29259 9.61655 9.68809 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 9.48604 17.4759 9.58166 10.1415 5.11518 8.76341 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 8.11352 4.67118 8.61788 7.85513 4.31404 7.67418 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 6.18165 12.2667 6.27378 6.47837 6.05322 9.25597 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 9.5668 6.36558 9.40138 11.6391 10.3887 5.61752 numMergedOcc 0
13 mol 211 unq 0 iso 0 dist 7.78316 4.83833 7.4575 11.471 12.0005 8.83853 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.76929 6.65459 4.44509 13.1874 5.98994 7.87797 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.95095 12.1402 6.90511 12.6749 5.72883 4.70178 numMergedOcc 0
