0 mol 21 unq 0 iso 0 dist 9.3973 4.80464 6.70786 13.2502 11.1907 8.85347 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 7.01513 6.91363 7.30688 7.48808 7.08873 8.85347 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 8.09082 12.1396 7.30688 15.1785 7.08873 8.85347 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.6834 13.9612 8.14598 9.88461 5.69214 6.85331 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.72041 5.64505 9.87963 6.72872 4.02037 8.62769 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 7.72041 9.04212 8.67352 6.72872 4.02037 6.09782 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 8.15039 10.5251 8.25594 18.216 13.2675 8.125 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 9.71155 10.3808 6.51243 5.21803 5.65603 9.42819 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 8.46046 5.43254 6.95244 13.4401 7.73027 8.84671 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 7.48065 5.43254 6.11224 13.4401 8.97627 8.84671 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.04336 7.52575 8.25953 15.6913 15.9879 8.32829 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 5.56977 8.09631 8.89981 9.43611 8.48942 9.4835 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 8.28155 12.5047 6.58871 11.6369 4.64118 5.10683 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 7.64563 5.68847 7.9987 11.5222 6.04002 9.88212 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 8.12236 5.94768 7.9987 12.9413 6.04002 9.88212 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 7.88009 10.1327 9.91103 15.6716 19.0436 9.84188 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 7.88009 10.1327 9.91103 16.2514 17.6038 8.35794 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 5.80061 10.1327 7.0603 15.6716 15.7645 9.84188 numMergedOcc 0
18 mol 277 unq 3 iso 0 dist 5.80061 10.1327 7.0603 16.2514 14.772 8.35794 numMergedOcc 0
