0 mol 5 unq 0 iso 0 dist 9.58876 5.03696 8.85818 9.05086 8.68577 8.39528 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.58876 5.03696 8.85818 4.32004 8.13672 5.26748 numMergedOcc 0
2 mol 31 unq 0 iso 0 dist 9.99589 6.19401 9.97586 4.46909 9.95496 4.493 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.66932 10.9996 7.39304 9.39237 6.38866 10.387 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 9.66932 9.68145 7.59131 9.39237 6.38866 11.891 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 8.33405 9.13428 7.96096 9.36667 9.13228 15.4616 numMergedOcc 0
6 mol 63 unq 1 iso 0 dist 8.33405 5.59796 7.63277 9.36667 9.13228 13.0363 numMergedOcc 0
7 mol 63 unq 2 iso 0 dist 8.33405 9.24278 6.29504 9.36667 9.13228 5.52932 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.51631 8.30448 8.06999 8.24064 7.7485 5.19109 numMergedOcc 0
9 mol 107 unq 0 iso 0 dist 7.09988 11.1652 7.2697 7.96442 8.88124 15.0258 numMergedOcc 0
10 mol 107 unq 1 iso 0 dist 7.09988 11.1652 7.2697 14.3565 8.19484 8.10328 numMergedOcc 0
11 mol 107 unq 2 iso 0 dist 7.73898 10.8746 7.2697 6.37998 8.88124 15.0258 numMergedOcc 0
12 mol 107 unq 3 iso 0 dist 7.73898 10.8746 7.2697 11.5335 8.19484 8.10328 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 6.36631 5.73808 8.28997 5.86518 5.31126 9.40786 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 6.36631 5.73808 8.28997 4.8668 4.49669 4.37694 numMergedOcc 0
15 mol 113 unq 2 iso 0 dist 6.36631 5.73808 8.28997 8.60367 6.00221 6.31995 numMergedOcc 0
16 mol 113 unq 3 iso 0 dist 6.36631 13.7052 7.98399 5.86518 5.31126 9.26558 numMergedOcc 0
17 mol 113 unq 4 iso 0 dist 6.36631 13.7052 7.98399 4.8668 4.49669 10.9453 numMergedOcc 0
18 mol 113 unq 5 iso 0 dist 6.36631 13.7052 7.98399 8.60367 6.00221 10.0348 numMergedOcc 0
19 mol 113 unq 6 iso 0 dist 6.24308 5.73808 8.54311 5.86518 7.16619 9.40786 numMergedOcc 0
20 mol 113 unq 7 iso 0 dist 6.24308 5.73808 8.54311 4.8668 5.88896 4.37694 numMergedOcc 0
21 mol 116 unq 0 iso 0 dist 8.83566 9.78082 8.35659 6.28158 6.55227 5.97396 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 7.96613 5.03854 7.34607 6.80038 7.8598 4.97876 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 7.96613 5.03854 7.34607 4.5731 7.80711 5.36572 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 7.73997 8.87182 5.04543 9.39306 6.53598 8.19724 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 7.73997 5.69851 8.99501 9.39306 6.53598 12.0119 numMergedOcc 0
26 mol 281 unq 0 iso 0 dist 7.5689 9.71694 5.70591 6.06807 5.33372 9.7837 numMergedOcc 0
27 mol 281 unq 1 iso 0 dist 7.5689 9.71694 5.70591 9.10512 6.56886 8.67682 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 5.93983 10.5523 6.5191 8.32005 5.88958 10.9233 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 5.93983 10.5523 6.5191 7.07384 7.78121 14.0087 numMergedOcc 0
