0 mol 26 unq 0 iso 0 dist 9.61029 6.32127 10.9837 9.77186 8.44506 9.5053 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.16036 9.52676 4.55437 9.32021 7.52117 7.03307 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.28737 6.25276 4.3931 6.38454 4.79949 6.66954 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 5.09688 8.22984 9.75737 6.16378 7.12017 9.5669 numMergedOcc 0
4 mol 100 unq 1 iso 0 dist 9.26343 6.6157 9.75737 5.69359 7.12017 9.5669 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 7.65229 6.73172 5.39346 12.468 8.729 9.77017 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.38977 8.74658 7.7567 6.53994 8.86329 5.56627 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 9.69757 8.74658 8.23791 6.53994 8.71039 5.56627 numMergedOcc 0
8 mol 131 unq 2 iso 0 dist 9.69757 8.74658 8.23791 13.4383 6.92648 8.50562 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 4.93035 9.14007 7.42649 5.74529 6.69515 6.94988 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.75558 9.14007 9.43674 5.74529 7.86572 6.94988 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.25528 5.6688 5.6044 6.09526 6.51749 7.11785 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 7.92766 6.21588 5.86489 10.2224 6.85441 5.91727 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 6.18486 8.85568 6.67321 5.98086 5.87815 7.95359 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 5.76077 7.06589 5.78064 5.37783 7.77998 8.15091 numMergedOcc 0
15 mol 253 unq 1 iso 0 dist 7.0247 8.70383 5.78064 14.5125 7.77998 8.15091 numMergedOcc 0
