0 mol 88 unq 0 iso 0 dist 6.41105 9.0321 6.64721 6.65892 9.27633 6.1847 numMergedOcc 0
1 mol 88 unq 1 iso 0 dist 6.41105 9.0321 6.64721 4.55647 7.59715 10.5092 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 4.85152 7.36397 6.12826 7.81379 9.22123 13.9817 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 4.85152 7.36397 6.12826 4.65469 7.36335 5.32369 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 4.85152 6.58062 5.02124 7.81379 9.22123 10.4834 numMergedOcc 0
5 mol 92 unq 3 iso 0 dist 4.85152 6.58062 5.02124 4.65469 7.36335 7.03417 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 7.8034 6.66749 5.53162 5.0614 6.94015 9.24546 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 9.98097 8.12409 9.3538 5.76787 7.43587 10.0852 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 5.1557 9.93184 7.02723 6.61855 5.79144 11.257 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 6.67598 9.40225 10.3893 15.4738 9.15935 17.9361 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 8.98636 9.40225 13.7819 15.4738 8.24388 17.9361 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.03259 9.30874 9.80135 8.21964 6.19329 11.7261 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.03259 5.54873 4.97806 8.21964 6.19329 7.61421 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 5.13722 7.95111 11.1645 10.5517 8.98606 18.1373 numMergedOcc 0
14 mol 193 unq 0 iso 0 dist 9.16852 9.42057 14.5828 11.2707 6.63784 19.1859 numMergedOcc 0
15 mol 193 unq 1 iso 0 dist 9.16852 9.42057 14.5828 13.7744 9.00934 20.6226 numMergedOcc 0
16 mol 193 unq 2 iso 0 dist 5.19654 8.52642 10.9221 4.40965 6.63784 12.8903 numMergedOcc 0
17 mol 193 unq 3 iso 0 dist 5.19654 8.52642 10.9221 6.04442 9.00934 12.7976 numMergedOcc 0
18 mol 211 unq 0 iso 0 dist 7.73993 9.62163 11.7695 8.28079 8.13147 16.9931 numMergedOcc 0
19 mol 211 unq 1 iso 0 dist 7.73993 8.48297 9.96364 8.28079 8.13147 13.4529 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 8.34471 9.11168 10.1271 4.2886 9.33223 11.2924 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 9.42812 8.62043 8.46112 3.60894 9.48076 8.13595 numMergedOcc 0
