0 mol 78 unq 0 iso 0 dist 9.83729 9.80366 5.85766 9.93719 8.50364 10.2714 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.05612 9.64287 5.38692 8.96635 9.44847 9.24005 numMergedOcc 0
2 mol 95 unq 1 iso 0 dist 9.05612 9.64287 5.38692 7.00682 6.05839 7.88846 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 6.93938 7.87345 12.3755 8.88381 5.64143 16.1212 numMergedOcc 0
4 mol 112 unq 1 iso 0 dist 6.93938 9.01196 5.70307 8.88381 5.64143 10.0497 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 9.8506 7.91749 13.5156 13.9376 8.43726 18.2619 numMergedOcc 0
6 mol 150 unq 0 iso 0 dist 9.91991 7.96309 13.6094 13.884 8.38828 18.2566 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 6.22696 4.80508 5.09517 8.13786 9.2016 11.0116 numMergedOcc 0
8 mol 158 unq 1 iso 0 dist 6.22696 4.88625 6.2149 8.13786 9.2016 12.4521 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 9.38297 8.87575 15.8939 13.1927 9.12343 21.7362 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.45614 8.43599 12.3855 15.3051 8.00791 19.8302 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 8.32647 6.03505 11.1533 5.66314 4.56607 10.5473 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 8.32647 6.30144 3.74437 5.66314 4.56607 5.62851 numMergedOcc 0
13 mol 284 unq 0 iso 0 dist 9.84174 4.69611 13.4014 5.78192 5.83416 10.1895 numMergedOcc 0
