0 mol 7 unq 0 iso 0 dist 7.32392 7.20175 7.5706 11.5036 5.38502 9.19844 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.28932 8.50298 5.61656 9.72314 10.6695 9.07692 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 7.53042 7.22668 5.61656 15.8201 10.6695 9.07692 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 6.83481 8.50298 6.95343 9.72314 6.40527 9.07692 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 5.26018 9.9383 5.75761 11.5124 6.55558 6.56768 numMergedOcc 0
5 mol 52 unq 1 iso 0 dist 7.1203 5.29002 5.75761 6.86785 6.55558 6.56768 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.124 16.278 9.79143 8.40844 5.44275 8.91833 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.16299 5.9581 6.43377 7.02351 11.2674 8.91833 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.27015 13.8631 6.43377 13.9009 11.2674 8.91833 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 9.89881 14.0959 8.76445 13.516 9.01856 4.9088 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.62648 10.2909 6.69217 18.7603 12.1168 8.82502 numMergedOcc 0
11 mol 219 unq 0 iso 0 dist 6.8424 10.7226 8.69579 14.8072 10.1098 7.44159 numMergedOcc 0
12 mol 230 unq 0 iso 0 dist 5.62804 6.73176 5.31963 12.0105 6.87235 7.63624 numMergedOcc 0
13 mol 230 unq 1 iso 0 dist 5.62804 6.73176 5.31963 13.9136 9.94041 9.95611 numMergedOcc 0
14 mol 230 unq 2 iso 0 dist 9.3619 6.73176 7.85632 12.0105 5.4427 7.63624 numMergedOcc 0
15 mol 230 unq 3 iso 0 dist 9.3619 6.73176 7.85632 13.9136 5.52842 9.95611 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.83046 5.86234 5.45139 4.21935 5.29737 7.84904 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 5.98967 8.0817 9.72168 8.11884 9.07441 6.5266 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.82899 7.42745 9.78482 15.5229 12.4605 9.25134 numMergedOcc 0
