0 mol 7 unq 0 iso 0 dist 8.85869 14.1047 9.85726 19.2577 11.5784 9.60499 18.4406 10.4728 8.43473 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.5298 14.06 7.21217 12.3221 6.09254 7.10621 18.4406 12.8055 13.8829 8.72114 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.94874 5.77391 7.21217 11.9671 6.09254 7.10621 18.7757 12.8055 13.8829 8.72114 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 7.65729 5.39064 6.29703 8.4361 5.64581 4.86568 5.06195 9.26933 5.39089 6.62144 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.10175 5.65405 5.59773 10.5929 10.4238 6.83299 5.01159 5.7405 4.29856 6.14538 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 6.85094 7.15161 5.92705 10.5531 5.4671 6.65721 13.5973 11.9267 13.5488 9.25641 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 9.94756 18.7183 9.62468 20.4711 10.7369 6.65721 29.2456 19.3555 13.5488 9.25641 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 4.85152 11.1785 9.514 11.1915 11.8037 7.4729 4.665 7.44343 9.50382 6.95572 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 4.85152 11.1785 9.514 11.1915 11.8037 7.4729 10.3867 13.7462 12.7565 7.38677 numMergedOcc 0
9 mol 101 unq 0 iso 0 dist 5.51185 9.11989 8.77773 8.97911 5.16122 6.57035 9.70552 9.83799 5.53055 6.98314 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 9.40608 5.50061 9.54928 6.24392 7.01529 6.06638 5.23583 12.4696 6.0268 6.30546 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 5.50364 5.29825 8.97145 12.0117 14.257 6.85062 18.1769 20.6764 13.7237 9.90168 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.7301 5.29825 6.5874 12.0117 7.60371 6.85062 18.1769 15.7544 13.7237 9.90168 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 6.67598 5.66289 7.30021 9.19499 5.0966 7.44554 5.02458 9.6281 5.4555 9.44367 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 6.67598 5.66289 7.30021 9.19499 5.0966 7.44554 15.8724 10.9903 11.9952 9.47433 numMergedOcc 0
15 mol 156 unq 2 iso 0 dist 6.67598 5.66289 7.30021 7.11647 5.75141 8.94056 5.02458 9.6281 5.4555 7.90267 numMergedOcc 0
16 mol 156 unq 3 iso 0 dist 8.34508 12.7636 7.30021 9.97623 5.0966 7.44554 17.0458 9.6281 5.4555 9.44367 numMergedOcc 0
17 mol 156 unq 4 iso 0 dist 8.34508 12.7636 7.30021 9.97623 5.0966 7.44554 6.89624 10.9903 11.9952 9.47433 numMergedOcc 0
18 mol 156 unq 5 iso 0 dist 8.34508 12.7636 7.30021 13.465 5.75141 8.94056 17.0458 9.6281 5.4555 7.90267 numMergedOcc 0
19 mol 156 unq 6 iso 0 dist 8.79185 5.59399 6.71202 7.11647 5.70205 7.66148 5.02458 6.22667 6.03934 7.90267 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 4.35909 5.32859 7.44191 11.0615 9.60754 8.03334 12.7855 13.0487 7.81713 6.2479 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 5.77393 5.32859 6.00053 11.0615 11.1879 8.03334 12.7855 12.5826 7.81713 6.2479 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 4.3362 9.20027 7.31105 17.1012 14.6296 9.23153 13.4847 12.6669 7.11498 6.59716 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 7.46044 13.1803 9.75313 10.6043 6.46679 6.61986 12.3328 13.8414 12.4692 9.51597 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 6.59521 5.13233 8.58088 10.7821 10.221 6.60405 9.76914 12.1556 5.63675 7.21311 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 9.16791 12.4673 6.77279 13.8844 5.71237 8.13497 13.1939 9.69025 8.41846 7.98231 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 9.16791 16.6792 9.58006 13.8844 5.71237 7.88519 13.1939 9.69025 8.81835 7.98231 numMergedOcc 0
27 mol 259 unq 2 iso 0 dist 9.16791 16.6792 9.58006 18.6945 11.8501 7.46176 13.1939 9.69025 8.81835 7.08526 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 9.96645 6.04536 9.696 12.1604 10.7962 7.56915 6.84952 13.0106 5.29529 8.52587 numMergedOcc 0
29 mol 274 unq 1 iso 0 dist 9.2447 6.12463 9.696 12.2117 10.7962 7.56915 11.0697 13.0106 5.29529 8.52587 numMergedOcc 0
