0 mol 7 unq 0 iso 0 dist 8.88982 16.991 9.67164 23.2551 14.6751 9.96415 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 5.33843 5.99459 12.5865 7.15287 9.96415 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.99509 11.0512 6.66407 11.027 10.1001 9.0979 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.92438 3.73561 8.66539 6.95021 5.46061 6.88243 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 7.66055 3.73561 5.38524 6.95021 7.93761 6.88243 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 8.25679 5.7326 7.51139 7.09464 6.06775 9.76849 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 8.13273 3.84897 8.27883 11.0204 7.95165 8.23073 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.29852 3.84897 7.7152 11.0204 6.67589 8.23073 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 7.55822 8.3164 8.28795 8.49761 6.57937 8.33185 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 6.47346 4.0844 5.58833 10.8239 6.29782 9.71342 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 6.47346 4.0844 5.58833 11.2025 5.99695 8.57774 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 7.24965 3.75935 9.04757 6.70014 12.8565 5.50187 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.16369 14.8867 8.73533 15.2241 8.24478 6.49577 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.16369 14.8867 8.73533 16.626 10.0248 9.76574 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 6.44896 4.77116 9.78634 9.37214 6.34098 9.63224 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 6.44896 4.65378 5.64942 9.37214 6.34098 6.98794 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.64889 15.23 8.9682 14.8656 5.77904 9.91103 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 9.64889 15.0167 6.92711 14.8656 5.77904 7.0603 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 6.70123 15.3157 9.57499 20.6197 16.3552 9.91103 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 9.0021 9.81388 6.02353 10.0528 6.07005 7.4869 numMergedOcc 0
