0 mol 11 unq 0 iso 0 dist 9.76233 9.12768 5.47299 16.7099 7.93357 8.34508 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 5.98169 13.5108 9.28621 11.5319 5.83388 5.87633 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 5.98169 5.51879 8.94643 12.5323 16.276 9.38747 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 5.98169 5.51879 8.94643 9.04621 15.0049 8.99724 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 5.98169 11.3454 8.36195 11.5319 5.83388 7.09381 numMergedOcc 0
5 mol 28 unq 4 iso 0 dist 6.14086 4.81564 5.42412 9.9661 5.61871 8.48456 numMergedOcc 0
6 mol 28 unq 5 iso 0 dist 6.76158 6.18197 5.42412 6.75443 5.61871 8.48456 numMergedOcc 0
7 mol 28 unq 6 iso 0 dist 6.31487 4.81564 8.09862 9.9661 7.3517 8.48456 numMergedOcc 0
8 mol 28 unq 7 iso 0 dist 6.31487 12.7577 8.97167 10.9386 6.51048 7.24073 numMergedOcc 0
9 mol 28 unq 8 iso 0 dist 7.423 6.18197 8.09862 6.75443 7.3517 8.48456 numMergedOcc 0
10 mol 28 unq 9 iso 0 dist 7.423 13.6562 8.97167 9.02508 6.51048 7.24073 numMergedOcc 0
11 mol 28 unq 10 iso 0 dist 7.07851 4.81564 8.89114 9.9661 6.13016 8.48456 numMergedOcc 0
12 mol 28 unq 11 iso 0 dist 7.07851 12.7577 8.8182 10.9386 4.18951 7.24073 numMergedOcc 0
13 mol 28 unq 12 iso 0 dist 5.89257 6.18197 8.89114 6.75443 6.13016 8.48456 numMergedOcc 0
14 mol 28 unq 13 iso 0 dist 5.89257 13.6562 8.8182 9.02508 4.18951 7.24073 numMergedOcc 0
15 mol 46 unq 0 iso 0 dist 7.12713 4.50032 7.44805 10.8654 8.28528 7.43338 numMergedOcc 0
16 mol 62 unq 0 iso 0 dist 8.1717 10.5572 8.96898 14.2508 7.10506 9.60892 numMergedOcc 0
17 mol 76 unq 0 iso 0 dist 8.26805 4.77004 9.50939 13.2855 14.6307 9.26231 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 7.30934 9.63545 7.01987 11.5456 4.28396 7.94379 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 9.3776 4.91732 8.52131 10.6388 6.79695 9.54774 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 6.80203 6.94063 8.82481 8.63202 6.65338 4.59484 numMergedOcc 0
21 mol 171 unq 1 iso 0 dist 8.00826 4.53761 8.82481 4.46397 6.65338 4.59484 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 7.78316 4.83833 7.4575 11.9066 5.48173 9.24739 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 6.15671 5.97855 6.35772 12.5037 9.71885 7.0412 numMergedOcc 0
24 mol 269 unq 0 iso 0 dist 6.8127 13.6116 9.20068 11.5034 4.89258 7.76667 numMergedOcc 0
