0 mol 18 unq 0 iso 0 dist 7.66002 6.83177 14.1353 10.4274 8.60149 16.1425 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 6.56878 6.56395 8.0979 4.76335 8.30431 4.628 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 6.56395 6.56878 8.0979 4.76335 4.628 8.30431 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.69782 7.69888 3.83043 6.34034 7.09393 3.87167 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 7.69888 8.69782 3.83043 6.34034 3.87167 7.09393 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 9.35592 9.6155 3.83043 8.85272 7.09393 3.87167 numMergedOcc 0
6 mol 69 unq 3 iso 0 dist 9.6155 9.35592 3.83043 8.85272 3.87167 7.09393 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.27446 9.76332 4.4628 14.5698 9.27355 8.60363 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.76332 8.27446 4.4628 14.5698 8.60363 9.27355 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 9.76332 8.27446 4.4628 6.15303 9.27331 10.0291 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.11757 9.4667 10.1168 11.8426 8.67865 8.40148 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.4667 8.11757 10.1168 11.8426 8.40148 8.67865 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.63311 8.0631 10.9911 12.4507 9.95726 18.3686 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 9.63311 8.90273 13.2561 12.4507 9.95726 18.4955 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 9.64202 7.08772 7.85056 12.4213 6.33658 13.0963 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 6.65408 8.61631 5.26568 4.10951 8.34883 11.7388 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.13354 9.90375 5.24285 5.7425 9.09835 7.21466 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 9.90375 9.13354 5.24285 5.7425 7.21466 9.09835 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 9.46904 6.05785 11.6633 5.55077 8.34832 10.0784 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 8.05967 9.62613 5.2966 4.7367 6.18866 9.3807 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 9.62613 8.05967 5.2966 4.7367 9.3807 6.18866 numMergedOcc 0
21 mol 249 unq 2 iso 0 dist 8.75137 7.82699 5.2966 13.7221 6.18866 9.3807 numMergedOcc 0
22 mol 249 unq 3 iso 0 dist 7.82699 8.75137 5.2966 13.7221 9.3807 6.18866 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 4.1077 8.78344 5.54154 7.32832 9.18439 12.6528 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 9.51551 8.25956 7.82127 5.09576 6.5072 4.03921 numMergedOcc 0
25 mol 265 unq 1 iso 0 dist 8.25956 9.51551 7.82127 5.09576 4.03921 6.5072 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 5.73065 7.64708 11.4925 8.3109 6.23539 14.8085 numMergedOcc 0
