0 mol 10 unq 0 iso 0 dist 9.1125 13.4978 9.44938 4.55975 8.03458 13.5354 19.1898 11.8048 9.29504 17.1184 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.1125 13.4978 9.44938 11.8229 8.2106 4.82016 19.1898 11.8048 9.29504 8.64111 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.41842 12.6461 7.99091 10.8869 8.04019 10.4304 14.817 7.07421 8.37901 8.07619 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 8.41842 12.6461 7.99091 10.1727 7.44828 9.147 14.817 7.07421 8.37901 12.7461 numMergedOcc 0
4 mol 132 unq 0 iso 0 dist 7.16287 11.926 7.73306 4.21327 6.94745 8.91031 15.2267 8.41467 9.39389 13.8199 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 5.01269 6.58277 8.54607 6.65104 9.23104 7.21249 10.0988 11.5137 5.79195 12.8531 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 9.96416 14.7367 8.54607 5.9683 5.79195 11.5137 17.023 7.21249 9.23104 12.8531 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 9.8446 7.28318 9.13163 4.08841 6.85551 4.81643 9.63241 5.54803 5.99596 6.89325 numMergedOcc 0
8 mol 165 unq 1 iso 0 dist 9.8446 16.8597 7.74717 4.08841 6.85551 14.2908 24.0207 14.5599 7.21397 21.2763 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 9.60268 8.67578 9.95547 9.78459 9.11481 13.7959 15.2335 10.7219 8.72323 18.5286 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 8.79954 5.21399 9.95547 9.70858 9.11481 13.7959 12.7519 10.7219 8.72323 18.5286 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 8.57123 13.5306 9.38418 7.68439 9.38188 13.9005 21.468 17.6365 9.52029 23.2898 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 8.57123 12.4109 8.0795 7.68439 9.38188 6.98747 13.5158 5.75487 9.23039 12.746 numMergedOcc 0
13 mol 229 unq 0 iso 0 dist 5.75755 5.17118 5.22312 3.99138 7.39596 5.39195 9.98251 4.88762 7.48693 11.6255 numMergedOcc 0
14 mol 276 unq 0 iso 0 dist 9.5388 15.2084 9.15041 17.4715 9.87655 8.99762 14.403 7.75603 7.60807 13.1857 numMergedOcc 0
15 mol 280 unq 0 iso 0 dist 6.0218 6.77825 6.88553 4.65268 4.45141 4.68825 12.0631 13.219 9.76967 13.3526 numMergedOcc 0
16 mol 293 unq 0 iso 0 dist 6.83404 6.89397 9.15753 5.86662 6.42608 11.0181 8.04021 4.88851 9.65156 10.2129 numMergedOcc 0
