0 mol 62 unq 0 iso 0 dist 9.75794 4.83009 6.51901 8.93653 4.46067 4.29679 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 9.75794 9.28042 9.1926 8.93653 4.46067 8.07308 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 6.01188 5.13554 5.89846 5.34283 8.14512 6.63195 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 6.01188 9.43483 8.06894 5.34283 8.14512 11.2724 numMergedOcc 0
4 mol 63 unq 2 iso 0 dist 7.96096 10.9533 9.56838 15.4616 9.13228 11.1855 numMergedOcc 0
5 mol 63 unq 3 iso 0 dist 7.63277 9.66038 9.56838 13.0363 9.13228 11.1855 numMergedOcc 0
6 mol 63 unq 4 iso 0 dist 6.29504 13.1211 9.56838 5.52932 9.13228 11.1855 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.04721 7.12769 9.46616 4.53269 9.51764 3.79265 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.04721 7.12769 9.46616 6.90764 9.29327 13.1376 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.28997 5.50743 9.44 9.40786 5.31126 12.8761 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.28997 5.50743 9.44 4.37694 4.49669 7.68828 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 8.28997 5.50743 9.44 6.31995 6.00221 8.44413 numMergedOcc 0
12 mol 113 unq 3 iso 0 dist 8.54311 5.50743 8.47634 9.40786 7.16619 12.8761 numMergedOcc 0
13 mol 113 unq 4 iso 0 dist 8.54311 5.50743 8.47634 4.37694 5.88896 7.68828 numMergedOcc 0
14 mol 113 unq 5 iso 0 dist 7.98399 16.4362 9.44 9.26558 5.31126 12.8761 numMergedOcc 0
15 mol 113 unq 6 iso 0 dist 7.98399 16.4362 9.44 10.9453 4.49669 7.68828 numMergedOcc 0
16 mol 113 unq 7 iso 0 dist 7.98399 16.4362 9.44 10.0348 6.00221 8.44413 numMergedOcc 0
17 mol 116 unq 0 iso 0 dist 8.35659 9.89845 6.98134 5.97396 6.55227 4.26914 numMergedOcc 0
18 mol 116 unq 1 iso 0 dist 8.35659 13.2796 8.55413 5.97396 6.55227 9.53399 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.39466 12.3382 8.7499 9.00401 9.80479 5.97893 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.32127 10.4474 7.43884 3.49908 7.80711 11.4637 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 9.32127 10.4474 7.43884 12.9447 9.9965 12.3524 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 7.55248 14.8067 9.05453 4.60355 7.90368 16.2801 numMergedOcc 0
23 mol 281 unq 1 iso 0 dist 7.55248 14.8067 9.05453 10.5706 6.69267 9.81081 numMergedOcc 0
24 mol 281 unq 2 iso 0 dist 6.50041 15.2665 9.05453 6.21647 7.90368 16.2801 numMergedOcc 0
25 mol 281 unq 3 iso 0 dist 6.50041 15.2665 9.05453 8.67682 6.69267 9.81081 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 8.42001 14.989 8.4625 4.0634 4.68668 11.4589 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 8.42001 14.989 8.4625 4.0634 4.68668 11.4589 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 8.42001 14.989 8.4625 4.0634 4.68668 11.4589 numMergedOcc 0
