0 mol 2 unq 0 iso 0 dist 9.74371 13.588 7.68766 11.5183 6.3286 11.854 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 9.89833 3.99762 9.65106 4.73815 9.21484 6.73124 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.25984 4.22382 5.51659 5.22412 6.95457 6.77798 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 8.23606 5.01475 9.73924 9.45345 8.96839 14.067 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 7.8986 12.4741 7.03264 6.19262 8.80748 14.4546 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 7.24183 8.05994 7.03264 10.0177 8.80748 14.4546 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 8.48435 5.61104 9.62885 5.82731 7.33646 4.49551 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.57285 4.57152 6.89622 5.29858 7.88147 6.41178 numMergedOcc 0
8 mol 152 unq 1 iso 0 dist 6.4737 10.8322 6.21275 13.0157 9.61301 4.0375 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 6.03184 4.40729 5.25888 7.64428 9.25721 4.71126 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.94671 9.4786 8.63031 5.38392 9.72584 6.2072 numMergedOcc 0
11 mol 206 unq 0 iso 0 dist 4.51269 8.44632 8.75397 4.91317 5.71819 9.59987 numMergedOcc 0
12 mol 206 unq 1 iso 0 dist 7.65323 9.10202 8.75124 4.91317 8.48679 9.82099 numMergedOcc 0
13 mol 206 unq 2 iso 0 dist 8.63033 10.2573 9.24348 9.30262 7.44186 13.5028 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 6.24111 12.1185 8.14122 10.6912 8.78286 15.1691 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 9.00343 13.3105 8.14122 15.1716 8.78286 15.1691 numMergedOcc 0
16 mol 210 unq 2 iso 0 dist 6.41444 7.35484 8.14122 11.533 8.78286 15.1691 numMergedOcc 0
17 mol 244 unq 0 iso 0 dist 6.51428 9.74679 8.95246 7.92205 6.26442 11.6866 numMergedOcc 0
18 mol 244 unq 1 iso 0 dist 6.51428 5.65728 5.97452 7.92205 6.26442 4.37768 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 8.13696 5.7487 8.28805 10.1869 7.76322 6.34839 numMergedOcc 0
20 mol 268 unq 0 iso 0 dist 6.74419 7.79979 5.46063 5.17126 6.14722 5.09882 numMergedOcc 0
