0 mol 13 unq 0 iso 0 dist 8.05984 6.67016 9.11447 3.53348 7.98465 8.85788 numMergedOcc 0
1 mol 130 unq 0 iso 0 dist 9.03277 12.6692 6.42785 10.2401 8.9677 5.77497 numMergedOcc 0
2 mol 130 unq 1 iso 0 dist 9.03277 9.65804 6.82089 10.2401 8.9677 12.7192 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.25207 11.1685 9.4062 10.5534 9.10003 11.7892 numMergedOcc 0
4 mol 173 unq 0 iso 0 dist 9.25763 10.3324 7.54706 10.1842 8.62366 9.35572 numMergedOcc 0
5 mol 173 unq 1 iso 0 dist 9.25763 10.3324 7.54706 12.4786 9.44973 5.74438 numMergedOcc 0
6 mol 173 unq 2 iso 0 dist 9.25763 10.3324 7.54706 13.8624 6.52508 8.43374 numMergedOcc 0
7 mol 173 unq 3 iso 0 dist 9.63102 8.36814 7.54706 7.24163 8.62366 9.35572 numMergedOcc 0
8 mol 173 unq 4 iso 0 dist 9.63102 8.36814 7.54706 8.98989 9.44973 5.74438 numMergedOcc 0
9 mol 173 unq 5 iso 0 dist 9.63102 8.36814 7.54706 12.0865 6.52508 8.43374 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 6.84347 10.9098 7.01126 9.36968 9.76114 15.0659 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 6.84347 5.31207 6.58434 9.36968 9.76114 10.6405 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 5.59438 6.78683 6.21206 7.12599 7.59939 6.19242 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 8.55725 10.7217 9.79691 4.65091 9.32333 8.68163 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 6.35728 5.20422 5.10114 4.112 8.70987 5.73082 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 8.34104 7.69431 7.1372 15.7465 7.79951 11.2819 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 8.79054 4.7189 9.06084 12.7385 7.20293 11.7392 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 8.60471 10.9906 9.31673 13.3458 7.02029 9.78535 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 6.06557 7.32607 6.94131 5.35498 9.35749 6.87067 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 6.06557 9.28683 9.84628 5.35498 9.35749 5.81024 numMergedOcc 0
