0 mol 7 unq 0 iso 0 dist 8.85869 14.1047 9.85726 14.9956 8.94586 16.4469 19.2577 11.5784 9.60499 12.4629 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.17472 5.3372 6.87871 6.10716 6.40741 8.04976 13.0456 8.95909 9.24927 12.8665 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.17472 5.3372 6.87871 5.61463 9.31366 9.01679 13.0456 8.95909 9.24927 16.1367 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.10175 5.65405 5.59773 5.01159 5.7405 4.29856 14.4402 13.9079 9.5589 10.6808 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.10175 5.65405 5.59773 5.01159 5.7405 4.29856 10.5929 10.4238 6.83299 6.14538 numMergedOcc 0
5 mol 54 unq 2 iso 0 dist 6.10175 5.65405 5.59773 5.01159 5.7405 4.29856 6.54183 10.1356 8.10861 10.4158 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.94756 18.7183 9.62468 14.4038 9.32664 15.5028 20.4711 10.7369 6.65721 14.6329 numMergedOcc 0
7 mol 61 unq 1 iso 0 dist 9.94756 18.7183 9.62468 14.4038 9.32664 15.5028 19.7171 11.5608 6.72123 18.8776 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.99156 5.33851 9.72442 10.38 9.53327 10.1488 10.1112 11.7069 9.38498 17.6546 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 7.21285 16.8585 9.72442 14.9324 9.53327 10.1488 16.3948 11.7069 9.38498 17.6546 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 4.85152 11.1785 9.514 5.47738 7.2131 8.55834 11.1915 11.8037 7.4729 10.5753 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 4.85152 11.1785 9.514 4.665 7.44343 9.50382 11.1915 11.8037 7.4729 6.95572 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 8.26291 10.9365 7.83619 9.33864 5.05277 7.11959 13.2314 10.0837 9.28393 13.5511 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 7.86001 5.63567 7.83619 5.6007 5.05277 7.11959 12.6804 10.0837 9.28393 13.5511 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 6.67598 5.66289 7.30021 5.02458 9.6281 5.4555 9.19499 5.0966 7.44554 9.44367 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 6.67598 5.66289 7.30021 5.02458 9.6281 5.4555 7.11647 5.75141 8.94056 7.90267 numMergedOcc 0
16 mol 156 unq 2 iso 0 dist 6.67598 5.66289 7.30021 5.02458 9.6281 5.4555 13.581 12.865 9.83699 10.3379 numMergedOcc 0
17 mol 156 unq 3 iso 0 dist 8.34508 12.7636 7.30021 17.0458 9.6281 5.4555 9.97623 5.0966 7.44554 9.44367 numMergedOcc 0
18 mol 156 unq 4 iso 0 dist 8.34508 12.7636 7.30021 17.0458 9.6281 5.4555 13.465 5.75141 8.94056 7.90267 numMergedOcc 0
19 mol 156 unq 5 iso 0 dist 8.34508 12.7636 7.30021 17.0458 9.6281 5.4555 16.944 12.865 9.83699 10.3379 numMergedOcc 0
20 mol 156 unq 6 iso 0 dist 8.79185 5.59399 6.71202 5.02458 6.22667 6.03934 7.11647 5.70205 7.66148 7.90267 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 5.77393 5.32859 6.00053 9.86163 5.67112 7.16549 11.0615 11.1879 8.03334 12.8648 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 7.46044 13.1803 9.75313 4.07416 6.48885 10.7174 10.6043 6.46679 6.61986 10.0553 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 6.36813 5.25583 6.23882 8.0412 8.81349 9.2363 13.0296 15.0038 8.95269 15.4463 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 9.16791 12.4673 6.77279 13.1939 9.69025 8.41846 14.3065 7.55268 8.53687 15.5791 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 9.16791 12.4673 6.77279 13.1939 9.69025 8.41846 13.8844 5.71237 8.13497 7.98231 numMergedOcc 0
26 mol 259 unq 2 iso 0 dist 9.16791 16.6792 9.58006 13.1939 9.69025 8.81835 13.8844 5.71237 7.88519 7.98231 numMergedOcc 0
27 mol 259 unq 3 iso 0 dist 9.16791 16.6792 9.58006 13.1939 9.69025 8.81835 18.1068 9.10984 7.84554 11.6972 numMergedOcc 0
28 mol 259 unq 4 iso 0 dist 9.16791 16.6792 9.58006 13.1939 9.69025 8.81835 18.6945 11.8501 7.46176 7.08526 numMergedOcc 0
29 mol 259 unq 5 iso 0 dist 9.16791 16.6792 9.58006 13.1939 9.69025 8.81835 22.9986 13.9868 9.18903 15.8414 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 8.17922 10.374 7.80446 4.48276 8.30714 13.0115 13.261 6.57235 9.10818 12.727 numMergedOcc 0
31 mol 277 unq 0 iso 0 dist 9.42812 16.2915 6.90434 13.008 5.92532 7.70529 20.3589 13.2927 9.7748 16.795 numMergedOcc 0
