0 mol 4 unq 0 iso 0 dist 9.79054 13.8402 8.57798 22.4876 14.3678 9.71908 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.77648 5.19202 7.7393 10.1987 4.92824 8.23909 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.65729 9.93633 9.51574 15.9297 11.0043 8.47315 numMergedOcc 0
3 mol 16 unq 1 iso 0 dist 7.72142 10.1908 9.51574 10.991 5.58451 6.29703 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.87856 6.14241 7.59354 5.85841 6.83826 9.59261 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.87856 6.14241 7.59354 7.00285 9.94628 6.67936 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 8.87856 6.14241 7.59354 11.8527 7.53156 8.25817 numMergedOcc 0
7 mol 108 unq 0 iso 0 dist 9.24001 13.8402 7.84262 17.7472 12.0135 7.29462 numMergedOcc 0
8 mol 108 unq 1 iso 0 dist 9.24001 12.7621 9.29208 17.7472 12.0135 5.4057 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.2046 5.07258 9.0224 7.51061 10.6667 8.21889 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 9.2046 5.07258 9.0224 11.8872 15.1709 9.74643 numMergedOcc 0
11 mol 109 unq 2 iso 0 dist 9.2046 5.07258 9.0224 10.7963 10.3273 6.86702 numMergedOcc 0
12 mol 110 unq 0 iso 0 dist 8.97683 9.44492 7.24538 16.5819 12.0587 7.21229 numMergedOcc 0
13 mol 110 unq 1 iso 0 dist 8.97683 9.44492 7.24538 14.0808 8.6616 5.25492 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 9.07096 4.92027 8.09095 7.85527 11.2951 9.93703 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 9.29439 5.94065 9.22776 10.5947 5.90895 8.53368 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 9.04176 4.87536 8.24004 9.68507 4.08699 6.71202 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 9.41152 5.21836 9.61678 7.98018 4.7382 9.16591 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 7.08434 5.75463 7.69328 12.2584 15.6558 8.0974 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 6.41916 3.81896 9.12948 10.2077 10.7641 9.53824 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 9.64455 7.86766 9.03521 11.3827 13.0236 8.49704 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 8.58709 9.98645 9.58724 6.21273 4.90657 7.31105 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 4.3362 9.61081 9.58724 17.1012 14.6296 9.8711 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 4.99301 6.27118 5.90784 13.0296 14.2632 9.33771 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 4.99301 6.27118 5.90784 12.5914 13.2364 7.39839 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 9.26487 9.56106 7.66806 11.1385 5.09738 5.73296 numMergedOcc 0
26 mol 261 unq 0 iso 0 dist 9.56414 11.6193 9.50269 9.95681 4.50761 9.62828 numMergedOcc 0
27 mol 261 unq 1 iso 0 dist 9.64886 14.0506 9.50269 13.5404 4.50761 9.62828 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 8.87355 4.07526 9.77593 10.3817 10.2086 8.13489 numMergedOcc 0
29 mol 279 unq 1 iso 0 dist 8.18179 10.7449 9.77593 14.5769 10.2086 8.13489 numMergedOcc 0
30 mol 279 unq 2 iso 0 dist 9.51355 12.552 9.77593 17.6412 10.2086 8.13489 numMergedOcc 0
