0 mol 8 unq 0 iso 0 dist 7.70793 12.2971 8.3997 15.7209 8.77457 6.65707 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 7.56303 13.9946 8.81649 11.5415 7.98679 15.4372 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 6.69917 11.8001 8.32784 7.11602 7.40415 8.56657 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 8.96804 9.33879 7.59119 12.1241 9.80143 10.1588 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 7.23669 4.84074 7.59119 7.37655 9.80143 10.1588 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.58057 8.63505 8.76402 13.7728 6.99108 8.84582 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 8.58057 11.7433 5.6727 13.7728 6.99108 5.2676 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 7.56041 10.9574 8.12456 14.1479 6.62972 10.1557 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.89116 5.02823 9.69257 8.66162 8.8562 7.03042 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.89116 5.02823 9.69257 6.71925 7.91683 10.0127 numMergedOcc 0
10 mol 153 unq 0 iso 0 dist 7.87611 9.55655 8.5566 5.84134 7.3061 5.19383 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 7.77159 5.2708 9.79706 10.6473 6.51014 12.5387 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 7.77159 6.77899 9.31487 10.6473 6.51014 7.22175 numMergedOcc 0
13 mol 247 unq 0 iso 0 dist 8.54443 11.089 8.02157 11.3019 9.84493 17.2299 numMergedOcc 0
14 mol 247 unq 1 iso 0 dist 6.18656 13.6562 8.02157 6.25568 9.84493 17.2299 numMergedOcc 0
15 mol 247 unq 2 iso 0 dist 7.38791 12.6358 8.02157 6.81664 9.84493 17.2299 numMergedOcc 0
16 mol 247 unq 3 iso 0 dist 8.96185 13.1929 8.02157 13.0997 9.84493 17.2299 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 7.47128 4.33005 8.9477 5.22125 8.13034 5.85562 numMergedOcc 0
