0 mol 7 unq 0 iso 0 dist 9.58865 7.32392 8.54694 10.4879 16.2694 9.85726 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.46837 6.84569 6.43294 9.57729 9.57392 8.67719 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.39015 8.44515 10.4263 11.6592 17.114 7.49054 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.87856 5.85841 6.83826 6.14241 7.59354 9.59261 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 8.87856 7.00285 9.94628 6.14241 7.59354 6.67936 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 6.2491 5.85841 9.30656 6.14241 10.0393 9.59261 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 6.2491 7.00285 5.39087 6.14241 10.0393 6.67936 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 3.59451 6.78839 9.30656 10.8152 10.0393 9.59261 numMergedOcc 0
8 mol 98 unq 5 iso 0 dist 3.59451 8.02354 5.39087 10.8152 10.0393 6.67936 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 7.73836 9.84673 6.42572 12.6508 14.2643 9.10229 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.2046 7.51061 10.6667 5.07258 9.0224 8.21889 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 8.30003 7.0318 10.4589 10.7285 12.9519 7.70533 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 9.07096 7.85527 11.2951 4.92027 8.09095 9.93703 numMergedOcc 0
13 mol 125 unq 0 iso 0 dist 9.64304 6.03557 9.19339 7.09758 15.4084 8.84867 numMergedOcc 0
14 mol 126 unq 0 iso 0 dist 9.40608 6.24392 7.01529 5.28929 14.0431 9.06961 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 8.51265 7.34465 13.1327 3.81784 12.3049 6.42756 numMergedOcc 0
16 mol 147 unq 0 iso 0 dist 4.95086 6.87299 5.90364 11.6781 13.996 9.18866 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 9.04176 9.68507 4.08699 4.87536 8.24004 6.71202 numMergedOcc 0
18 mol 156 unq 1 iso 0 dist 9.41152 7.98018 4.7382 5.21836 9.61678 9.16591 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.58709 6.21273 4.90657 9.98645 9.58724 7.31105 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 8.68767 9.73411 14.3302 13.9782 18.5355 9.33771 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 7.7163 7.07564 5.63485 14.788 11.1636 9.33771 numMergedOcc 0
22 mol 224 unq 2 iso 0 dist 9.2 7.07564 4.8786 14.788 12.5889 9.33771 numMergedOcc 0
23 mol 230 unq 0 iso 0 dist 5.00735 5.62804 7.07028 5.24985 10.1534 8.49299 numMergedOcc 0
24 mol 230 unq 1 iso 0 dist 6.73755 5.62804 5.26217 5.24985 11.3498 8.49299 numMergedOcc 0
25 mol 231 unq 0 iso 0 dist 6.73226 8.91036 11.548 14.3729 18.6746 7.79865 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 6.04688 7.72708 9.50161 7.82195 11.8673 5.78121 numMergedOcc 0
27 mol 251 unq 0 iso 0 dist 8.84041 7.54763 6.07836 9.21736 13.5711 9.94161 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 8.34471 8.40766 9.45618 9.93782 14.3981 5.73296 numMergedOcc 0
29 mol 261 unq 0 iso 0 dist 9.56414 9.95681 4.50761 11.6193 9.50269 9.62828 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 9.94705 6.36173 4.54581 4.84163 13.2163 9.02749 numMergedOcc 0
