0 mol 14 unq 0 iso 0 dist 6.89209 6.09608 8.39221 11.6708 9.18933 7.54797 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.59049 10.2869 8.47315 17.6717 11.0043 9.51574 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 8.59049 10.2869 8.47315 13.2878 6.73304 9.39137 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 5.2422 5.41061 6.87871 13.0074 10.4854 9.52614 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.44515 11.6592 7.49054 14.5561 6.23291 8.21858 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 9.41382 5.79126 7.49054 11.0362 6.23291 8.21858 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.85841 6.14241 9.59261 8.87856 6.83826 7.59354 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 6.78839 10.8152 9.59261 11.3126 6.83826 7.59354 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 7.00285 6.14241 6.67936 8.87856 9.94628 7.59354 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 8.02354 10.8152 6.67936 11.3126 9.94628 7.59354 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 7.51061 5.07258 8.21889 9.2046 10.6667 9.0224 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 9.71948 9.93247 7.21229 17.1242 12.0587 7.24538 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 7.85527 4.92027 9.93703 9.07096 11.2951 8.09095 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 8.62648 10.604 9.42766 14.4891 7.09701 9.95698 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 9.68507 4.87536 6.71202 9.04176 4.08699 8.24004 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 7.98018 5.21836 9.16591 9.41152 4.7382 9.61678 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 6.21273 9.98645 7.31105 8.58709 4.90657 9.58724 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.73411 13.9782 9.33771 18.7994 14.2632 5.90784 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 9.73411 13.9782 9.33771 18.4968 9.59595 8.50322 numMergedOcc 0
19 mol 224 unq 2 iso 0 dist 7.07564 14.788 9.33771 18.3068 14.2632 5.90784 numMergedOcc 0
20 mol 224 unq 3 iso 0 dist 7.07564 14.788 9.33771 14.6367 9.59595 8.50322 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 8.8557 9.61847 9.84492 14.1998 7.49004 9.92855 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.40766 9.93782 5.73296 11.1104 5.09738 7.66806 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 9.95681 11.6193 9.62828 9.56414 4.50761 9.50269 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.83775 14.331 9.82774 16.6033 9.40662 5.12827 numMergedOcc 0
