0 mol 2 unq 0 iso 0 dist 8.5893 10.3714 6.53554 4.00237 5.74846 8.52972 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.88525 3.61797 6.53554 6.42073 5.74846 8.52972 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.11934 4.16267 8.72277 4.82623 6.10199 4.50866 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 8.18695 3.55079 7.11174 5.82911 5.2168 4.52409 numMergedOcc 0
4 mol 81 unq 1 iso 0 dist 8.18695 9.50386 6.98944 5.82911 5.2168 5.89527 numMergedOcc 0
5 mol 81 unq 2 iso 0 dist 7.82027 9.95888 7.11174 7.93947 5.2168 4.52409 numMergedOcc 0
6 mol 81 unq 3 iso 0 dist 7.82027 11.1271 6.98944 7.93947 5.2168 5.89527 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 4.83495 11.5593 9.24615 7.62353 5.16779 5.833 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 4.78944 9.25148 8.39825 8.19217 9.60854 12.0235 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.43487 10.8339 8.34228 3.74516 8.46167 12.55 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 9.43487 10.8339 8.34228 7.32784 6.13175 10.1562 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 9.43487 10.8339 8.34228 8.46561 4.34107 6.82721 numMergedOcc 0
12 mol 113 unq 3 iso 0 dist 9.97052 5.76996 8.34228 11.4966 8.46167 12.55 numMergedOcc 0
13 mol 113 unq 4 iso 0 dist 9.97052 5.76996 8.34228 11.9142 6.13175 10.1562 numMergedOcc 0
14 mol 113 unq 5 iso 0 dist 9.97052 5.76996 8.34228 9.75283 4.34107 6.82721 numMergedOcc 0
15 mol 113 unq 6 iso 0 dist 7.3324 8.96484 8.34228 13.8072 8.46167 12.55 numMergedOcc 0
16 mol 113 unq 7 iso 0 dist 7.3324 8.96484 8.34228 8.67805 6.13175 10.1562 numMergedOcc 0
17 mol 113 unq 8 iso 0 dist 7.3324 8.96484 8.34228 6.03962 4.34107 6.82721 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 6.94771 8.78097 8.00234 6.66492 9.63062 12.5318 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 9.91856 8.93866 7.01576 3.67805 9.16774 5.99287 numMergedOcc 0
20 mol 282 unq 0 iso 0 dist 6.96758 6.10471 5.22629 3.81283 7.89625 7.00662 numMergedOcc 0
21 mol 282 unq 1 iso 0 dist 6.96758 5.96331 6.16433 3.81283 7.89625 8.72511 numMergedOcc 0
22 mol 286 unq 0 iso 0 dist 9.96295 5.22428 6.02223 8.1401 6.87255 3.54121 numMergedOcc 0
23 mol 286 unq 1 iso 0 dist 8.95266 8.14896 6.02223 9.30848 6.87255 3.54121 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 8.25719 10.8721 8.91842 12.3674 9.66129 6.23192 numMergedOcc 0
