0 mol 27 unq 0 iso 0 dist 7.41235 9.75252 4.77763 5.33296 8.57157 9.93104 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 7.41235 5.27118 3.21417 5.33296 8.57157 8.05628 numMergedOcc 0
2 mol 27 unq 2 iso 0 dist 9.40953 8.16102 3.21417 12.1866 8.57157 8.05628 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.72136 9.942 3.7765 9.89704 8.16183 5.2568 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 9.72136 5.92771 13.4768 9.89704 8.16183 15.5545 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 8.38687 6.42645 5.87787 9.07371 9.70494 9.52356 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.83729 9.80366 5.85766 7.85361 5.85873 8.66795 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 6.93938 7.87345 12.3755 12.5809 9.58666 19.9374 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 6.93938 9.01196 5.70307 12.5809 9.58666 13.4699 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 9.8506 7.91749 13.5156 17.0927 9.93912 22.5065 numMergedOcc 0
10 mol 148 unq 1 iso 0 dist 9.8506 7.91749 13.5156 7.50382 8.3656 14.9179 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 9.91991 7.96309 13.6094 7.48524 8.44633 14.9398 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 8.45614 8.43599 12.3855 9.76376 7.21988 13.2454 numMergedOcc 0
13 mol 182 unq 1 iso 0 dist 8.45614 8.43599 12.3855 10.8611 8.14376 16.8774 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 8.9694 6.03628 5.22858 9.59563 5.79617 9.38177 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 8.02723 9.22105 9.08285 6.52672 5.79617 12.6463 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.97859 9.59909 14.95 16.9796 8.28643 18.2442 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 7.63933 6.94666 3.14843 16.8035 9.30058 10.6438 numMergedOcc 0
18 mol 285 unq 1 iso 0 dist 7.63933 6.94666 3.14843 11.3649 6.5354 9.28059 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.74312 8.08382 3.66473 5.44878 9.94851 11.2301 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.74312 8.08382 3.66473 5.44878 9.94851 11.2301 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.74312 8.08382 3.66473 5.44878 9.94851 11.2301 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 7.18462 8.26365 3.08474 5.28998 6.13272 7.89784 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.66342 8.26365 6.12546 5.28998 7.02679 7.89784 numMergedOcc 0
