0 mol 91 unq 0 iso 0 dist 9.60916 8.57379 8.94991 14.369 6.44712 9.27894 numMergedOcc 0
1 mol 91 unq 1 iso 0 dist 9.44798 15.9821 8.94991 15.599 6.44712 9.27894 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 6.26722 9.59447 6.34149 16.7909 13.8717 8.25027 numMergedOcc 0
3 mol 133 unq 1 iso 0 dist 8.78 12.9102 6.34149 20.991 13.8717 8.25027 numMergedOcc 0
4 mol 171 unq 0 iso 0 dist 9.53702 12.999 7.7195 20.1155 13.0669 7.87612 numMergedOcc 0
5 mol 171 unq 1 iso 0 dist 9.53702 15.5015 8.30819 18.8706 9.74745 5.98495 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 6.22466 8.50695 5.39622 8.9388 3.6848 5.09756 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 6.22466 8.50695 5.39622 11.1116 5.33968 7.44523 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 6.88947 11.943 7.83389 9.76512 3.81315 7.1329 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 8.22331 7.6839 8.05227 12.7386 10.9673 5.65314 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 4.38586 11.2221 8.17234 5.96615 3.72432 9.69367 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 9.40399 7.36484 8.17234 12.5048 3.72432 9.69367 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 7.55878 8.39255 7.09902 6.0751 3.98113 7.79426 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 4.91191 6.69492 7.09902 8.51852 3.98113 7.79426 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 5.65943 6.00606 5.67249 8.56943 4.86668 4.37501 numMergedOcc 0
15 mol 248 unq 0 iso 0 dist 8.4908 4.54692 7.6899 5.65458 3.67057 6.79869 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 7.46 4.12383 4.76689 6.19564 6.73886 6.54521 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 7.46 11.9912 8.79012 14.8324 9.0549 7.97307 numMergedOcc 0
18 mol 260 unq 2 iso 0 dist 7.46 11.9912 8.79012 18.614 17.1277 8.52702 numMergedOcc 0
19 mol 260 unq 3 iso 0 dist 6.71406 4.12383 7.26455 6.19564 5.38205 6.54521 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 8.99187 14.1982 6.84909 19.1775 11.4255 8.51266 numMergedOcc 0
