0 mol 12 unq 0 iso 0 dist 5.44478 9.41745 6.9065 7.00079 8.18296 14.7405 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 5.44478 9.41745 6.9065 6.50215 7.99569 13.8238 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 9.1487 9.38611 5.38234 4.91428 8.54555 6.76508 numMergedOcc 0
3 mol 65 unq 1 iso 0 dist 9.1487 9.38611 5.38234 7.66509 7.0386 8.22785 numMergedOcc 0
4 mol 125 unq 0 iso 0 dist 4.81596 8.38646 6.06241 6.24872 7.00113 7.73435 numMergedOcc 0
5 mol 125 unq 1 iso 0 dist 4.81596 8.38646 6.06241 10.4668 9.85979 9.3778 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 7.80819 9.2806 4.57807 10.2784 6.62527 11.1956 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 7.48833 8.14071 5.99695 9.81728 7.32407 9.36851 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 7.48833 8.14071 5.99695 6.95825 6.48695 4.97175 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 8.60157 9.7168 5.77745 6.57631 6.86997 9.99156 numMergedOcc 0
10 mol 148 unq 1 iso 0 dist 8.60157 9.7168 5.77745 8.40891 7.46919 8.18085 numMergedOcc 0
11 mol 148 unq 2 iso 0 dist 8.60157 9.7168 5.77745 11.7674 8.24581 10.4289 numMergedOcc 0
12 mol 148 unq 3 iso 0 dist 8.60157 7.38138 11.2162 6.57631 6.86997 12.1227 numMergedOcc 0
13 mol 148 unq 4 iso 0 dist 8.60157 7.38138 11.2162 8.40891 7.46919 11.2961 numMergedOcc 0
14 mol 148 unq 5 iso 0 dist 8.60157 7.38138 11.2162 11.7674 8.24581 15.2307 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 8.59359 9.61132 5.71213 6.56068 6.79381 9.8656 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 8.59359 9.61132 5.71213 8.32178 7.36989 7.94889 numMergedOcc 0
17 mol 150 unq 2 iso 0 dist 8.59359 9.61132 5.71213 11.7699 8.17805 10.2188 numMergedOcc 0
18 mol 150 unq 3 iso 0 dist 8.59359 7.34423 11.2566 6.56068 6.79381 12.1516 numMergedOcc 0
19 mol 150 unq 4 iso 0 dist 8.59359 7.34423 11.2566 8.32178 7.36989 11.2313 numMergedOcc 0
20 mol 150 unq 5 iso 0 dist 8.59359 7.34423 11.2566 11.7699 8.17805 15.2191 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 6.45502 8.1504 5.16728 7.33177 8.07946 11.931 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 8.89382 8.98617 4.68085 10.0326 7.82708 11.4364 numMergedOcc 0
23 mol 241 unq 1 iso 0 dist 8.89382 6.74552 10.8729 10.0326 7.82708 15.4938 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 9.31855 9.78185 13.943 7.27483 7.60896 15.9791 numMergedOcc 0
