0 mol 31 unq 0 iso 0 dist 8.54682 9.97586 3.57805 4.493 9.67338 9.95496 numMergedOcc 0
1 mol 31 unq 1 iso 0 dist 7.95952 9.97586 11.1064 4.493 11.5057 9.95496 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 8.91866 6.01188 3.23074 5.34283 11.219 8.14512 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 9.43008 7.96096 12.7651 15.4616 21.465 9.13228 numMergedOcc 0
4 mol 63 unq 2 iso 0 dist 7.63422 7.96096 14.1877 15.4616 22.6845 9.13228 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 8.14146 8.06999 3.56619 5.19109 9.87699 7.7485 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.25088 7.98399 6.29259 9.26558 7.40338 5.31126 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 6.25088 7.98399 6.29259 10.9453 10.4064 4.49669 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 6.25088 7.98399 6.29259 10.0348 11.5441 6.00221 numMergedOcc 0
9 mol 113 unq 3 iso 0 dist 6.25088 9.72242 5.40648 11.6507 9.34113 7.02358 numMergedOcc 0
10 mol 113 unq 4 iso 0 dist 8.23837 7.98399 8.17309 9.26558 6.23759 5.31126 numMergedOcc 0
11 mol 113 unq 5 iso 0 dist 8.23837 7.98399 8.17309 10.9453 11.148 4.49669 numMergedOcc 0
12 mol 113 unq 6 iso 0 dist 8.23837 7.98399 8.17309 10.0348 12.8832 6.00221 numMergedOcc 0
13 mol 113 unq 7 iso 0 dist 8.23837 9.72242 3.52111 11.6507 5.35711 7.02358 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 8.99506 8.35659 7.93893 5.97396 11.9578 6.55227 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 6.10988 9.7638 4.94367 8.42353 7.84546 7.53342 numMergedOcc 0
16 mol 169 unq 0 iso 0 dist 6.66976 7.5669 6.28646 9.08641 7.85698 5.10589 numMergedOcc 0
17 mol 169 unq 1 iso 0 dist 6.66976 7.5669 6.28646 10.9154 10.573 4.63336 numMergedOcc 0
18 mol 169 unq 2 iso 0 dist 6.66976 7.5669 6.28646 10.1806 11.9922 6.10715 numMergedOcc 0
19 mol 169 unq 3 iso 0 dist 8.36806 7.5669 7.83748 9.08641 6.35799 5.10589 numMergedOcc 0
20 mol 169 unq 4 iso 0 dist 8.36806 7.5669 7.83748 10.9154 10.8214 4.63336 numMergedOcc 0
21 mol 169 unq 5 iso 0 dist 8.36806 7.5669 7.83748 10.1806 12.7569 6.10715 numMergedOcc 0
22 mol 256 unq 0 iso 0 dist 8.96004 6.87466 3.96807 9.16839 6.96483 5.58222 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.94609 7.34607 14.8481 4.97876 10.6754 7.8598 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 7.94609 7.34607 14.8481 5.36572 10.0289 7.80711 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 7.12219 9.59154 7.78509 15.6368 11.7606 6.96692 numMergedOcc 0
26 mol 266 unq 3 iso 0 dist 7.12219 8.54753 4.60397 11.3236 11.5353 7.8598 numMergedOcc 0
27 mol 266 unq 4 iso 0 dist 7.12219 8.54753 4.60397 15.6368 11.7606 8.25286 numMergedOcc 0
28 mol 291 unq 0 iso 0 dist 7.14458 9.60522 14.4259 4.95812 11.5574 9.9815 numMergedOcc 0
