0 mol 7 unq 0 iso 0 dist 9.8603 9.30196 7.15434 16.6461 9.67164 8.75346 20.3971 12.2041 11.9621 5.99459 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.91301 11.375 6.4754 13.8883 9.01112 4.67793 16.9088 10.9495 10.2567 6.56356 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.91301 11.375 6.4754 13.8883 9.01112 4.67793 15.6504 6.23795 7.3795 7.62333 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.91301 3.69663 6.57999 13.8883 9.01112 11.5556 16.9088 10.9495 13.8619 6.56356 numMergedOcc 0
4 mol 8 unq 3 iso 0 dist 9.91301 3.69663 6.57999 13.8883 9.01112 11.5556 15.6504 6.23795 12.3088 7.62333 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 8.609 4.64354 6.83481 3.65941 6.74179 6.01658 9.44073 5.34368 9.28932 6.07517 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 9.8809 8.50061 7.62791 4.69809 6.9362 6.98976 5.47319 8.99811 11.7488 5.99857 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.18305 12.2435 8.124 5.65986 7.4369 15.2252 11.0671 5.4148 10.1112 9.73086 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.58841 13.4991 5.56964 16.3337 9.85905 6.65453 17.86 10.2879 8.41567 6.72869 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 5.63005 11.5865 8.62648 5.92411 7.64052 12.6962 6.18763 9.93257 17.5132 8.95212 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 5.63005 11.5865 8.62648 5.92411 7.64052 12.6962 8.44385 4.85907 11.5266 6.99446 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.60411 13.5049 7.27598 3.76211 7.93372 12.487 13.0095 10.7144 16.7211 9.66543 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 9.60411 13.5049 7.27598 3.76211 7.93372 12.487 9.92932 5.49782 12.3933 7.21868 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.58911 7.56512 6.58792 17.3349 8.59874 11.9701 9.86845 6.01247 8.90247 9.76212 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 7.41378 8.14699 9.18245 4.76079 5.05973 5.68795 10.8641 11.5866 13.2054 9.01624 numMergedOcc 0
15 mol 218 unq 0 iso 0 dist 6.9398 6.7488 4.851 3.5359 6.67404 6.13691 7.0843 6.17651 9.89546 8.75536 numMergedOcc 0
16 mol 218 unq 1 iso 0 dist 6.9398 6.7488 4.851 3.5359 6.67404 6.13691 7.73315 5.61978 9.66527 7.33709 numMergedOcc 0
