0 mol 69 unq 0 iso 0 dist 7.70037 13.7644 8.36667 7.45293 8.26633 12.6278 numMergedOcc 0
1 mol 69 unq 1 iso 0 dist 7.96207 4.70213 8.36667 14.6152 8.26633 12.6278 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.23755 12.5791 8.4438 7.65955 5.14178 5.7253 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 8.98532 12.3568 9.56884 9.93828 9.08316 3.74485 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 8.98532 5.38868 8.67865 9.93828 9.08316 11.741 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 8.98532 5.80362 8.40148 9.93828 9.08316 6.7118 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.88956 10.7167 7.57822 10.049 9.39702 8.20815 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 5.8915 8.5691 7.81042 8.18347 9.7695 9.85904 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.15949 5.67441 5.31281 6.51881 7.73842 10.9798 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 6.15949 10.0602 8.9922 6.51881 7.73842 15.009 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.99801 11.7811 9.45817 8.7763 4.97005 10.763 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 5.99801 11.7811 9.45817 8.86774 7.22 8.60943 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 5.99801 11.7811 9.45817 6.82464 6.81388 5.66068 numMergedOcc 0
13 mol 207 unq 0 iso 0 dist 4.70143 9.07366 8.84785 5.18702 9.22778 11.2432 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 5.99718 9.55761 8.23246 5.08437 7.60925 9.38497 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 9.53198 10.3887 7.38609 11.317 9.08444 4.73244 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.49961 13.8894 8.34832 5.39451 9.36997 12.8764 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 8.49961 13.8894 8.34832 11.0724 9.97907 14.9673 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 8.49961 13.8894 8.34832 17.1388 8.83751 8.27455 numMergedOcc 0
19 mol 239 unq 3 iso 0 dist 8.49961 13.8894 8.34832 16.0868 8.77688 13.5505 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 9.66298 17.0555 9.70222 12.3844 6.40153 7.25156 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.46926 11.7148 8.61786 14.9026 9.98606 11.1063 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 9.46926 7.8329 8.42706 14.9026 9.98606 17.6604 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 8.17214 14.6688 8.63954 10.471 7.06878 11.6511 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 8.17214 8.64319 4.74716 10.471 7.06878 6.93502 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 8.80626 10.6818 4.49185 6.09096 6.53393 5.97691 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.80626 10.6818 4.49185 6.09096 6.53393 5.97691 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 8.80626 10.6818 4.49185 6.09096 6.53393 5.97691 numMergedOcc 0
