0 mol 4 unq 0 iso 0 dist 8.67449 7.53929 12.6637 9.31285 7.74662 11.5093 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.67449 7.53929 12.6637 8.66947 5.99401 10.8758 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.42122 9.073 15.8904 5.9651 10.9128 5.71797 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 7.84978 9.91797 6.3403 9.49626 5.89083 5.6722 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 6.98402 9.31349 9.30139 9.86416 9.30646 5.66477 numMergedOcc 0
5 mol 83 unq 1 iso 0 dist 6.98402 7.61666 5.88118 9.86416 9.30646 4.09882 numMergedOcc 0
6 mol 94 unq 0 iso 0 dist 6.65564 7.81363 11.6496 8.01724 4.44456 9.47607 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.0609 9.35364 13.1033 7.90775 13.7041 15.7022 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 8.0609 9.35364 13.1033 8.49531 11.0293 3.96825 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.77672 6.26722 12.3638 8.66715 6.49804 12.7925 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.77672 6.26722 12.3638 9.00172 13.4603 12.7637 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 8.64725 6.26722 10.4416 8.66715 11.7832 12.7925 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 8.64725 6.26722 10.4416 9.00172 5.0869 12.7637 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 9.37167 9.19569 7.68205 6.28961 4.99603 4.34424 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 5.80406 6.28071 5.41712 9.36732 5.71443 9.8977 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 5.80406 6.28071 5.41712 9.79271 7.87147 4.59462 numMergedOcc 0
16 mol 207 unq 0 iso 0 dist 9.41313 9.13327 9.10283 5.18312 5.71205 5.66029 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.50656 6.58667 7.14793 9.38793 6.64972 4.84657 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.50656 6.01542 10.0999 9.38793 6.64972 13.791 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 8.81918 8.79625 12.5874 9.91518 10.6848 13.5373 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 8.81918 9.9609 7.70601 9.91518 10.6848 11.4765 numMergedOcc 0
