0 mol 45 unq 0 iso 0 dist 5.90391 9.82412 4.65205 6.74686 8.82771 13.1413 numMergedOcc 0
1 mol 52 unq 0 iso 0 dist 5.95004 6.30728 9.23654 5.48316 7.24782 11.7833 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 7.86678 9.70578 5.93334 11.3476 9.27229 14.1757 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 8.26291 6.82882 8.07081 13.7304 7.86001 14.3925 numMergedOcc 0
4 mol 211 unq 0 iso 0 dist 9.45365 8.65518 11.8741 4.78922 7.15386 12.1645 numMergedOcc 0
5 mol 211 unq 1 iso 0 dist 9.45365 8.65518 11.8741 8.05917 7.73993 13.1024 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 5.51565 8.42093 6.80972 6.08531 9.74776 12.7796 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 9.92947 9.71948 6.83328 5.639 8.68767 11.6766 numMergedOcc 0
8 mol 260 unq 0 iso 0 dist 8.3298 9.16717 17.0106 10.3809 9.05149 17.8249 numMergedOcc 0
9 mol 261 unq 0 iso 0 dist 9.64886 7.59719 13.2446 9.90349 9.56414 16.7046 numMergedOcc 0
10 mol 274 unq 0 iso 0 dist 9.96645 8.44743 5.84383 7.90361 9.2447 11.7534 numMergedOcc 0
11 mol 274 unq 1 iso 0 dist 9.29005 8.44743 16.9961 7.42692 7.24089 13.9895 numMergedOcc 0
