0 mol 7 unq 0 iso 0 dist 7.15434 10.7937 8.72114 12.8628 11.8172 6.02702 16.7503 15.861 13.7145 8.23909 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.15434 10.7937 8.72114 12.8628 11.8172 6.02702 16.4484 12.8863 6.11915 6.72215 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 4.92734 7.97177 8.53529 6.57999 8.4069 7.18019 5.24855 9.49106 7.07501 7.45487 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 7.3795 5.3298 8.44009 6.4754 6.23795 7.18019 6.06114 11.9557 7.07501 7.45487 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 8.59049 5.11248 6.72833 8.82587 10.4852 6.93532 10.2769 16.4381 10.2885 8.33883 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.85841 4.81103 5.78706 7.00285 10.6225 5.59328 6.14241 9.59261 5.24592 6.67936 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.85841 4.81103 5.78706 11.8527 12.7411 7.5242 6.14241 9.59261 5.24592 8.25817 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 6.78839 7.22196 5.78706 8.02354 10.6225 5.59328 10.8152 9.59261 5.24592 6.67936 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 6.78839 7.22196 5.78706 13.7128 12.7411 7.5242 10.8152 9.59261 5.24592 8.25817 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 7.00285 4.81103 5.59328 5.85841 10.6225 5.78706 6.14241 6.67936 5.24592 9.59261 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 7.00285 4.81103 5.59328 11.8527 7.72877 7.5242 6.14241 6.67936 5.24592 8.25817 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 8.02354 7.22196 5.59328 6.78839 10.6225 5.78706 10.8152 6.67936 5.24592 9.59261 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 8.02354 7.22196 5.59328 13.7128 7.72877 7.5242 10.8152 6.67936 5.24592 8.25817 numMergedOcc 0
13 mol 125 unq 0 iso 0 dist 7.76202 7.74181 7.47069 13.0388 11.8325 9.3778 17.5863 19.5018 14.8614 8.84867 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 9.79004 13.2968 7.71248 14.9707 6.761 9.97654 19.9412 14.1743 11.7748 9.48243 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 5.57904 12.4426 7.80532 11.3191 5.79898 5.83771 16.4412 11.4625 4.15314 7.78849 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 9.19499 15.8724 9.47433 14.1844 5.76755 6.30021 14.1794 10.3078 4.1075 8.81169 numMergedOcc 0
17 mol 231 unq 0 iso 0 dist 8.91036 9.83598 6.98875 12.2364 4.06055 6.54852 14.3729 7.79865 7.00432 6.14348 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 5.67917 5.11183 7.57812 12.6253 10.0191 9.24557 19.4619 15.7202 16.7165 9.31417 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 5.67917 5.11183 7.57812 12.6253 10.0191 9.24557 14.6163 11.1188 11.9863 5.56719 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 7.58272 4.36832 6.62841 8.83775 8.29447 8.00673 14.331 15.9748 11.9007 9.82774 numMergedOcc 0
