0 mol 46 unq 0 iso 0 dist 8.99557 15.9669 9.31292 9.89704 8.55031 13.8587 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.05165 6.39142 8.05728 8.77048 7.40694 6.39496 numMergedOcc 0
2 mol 51 unq 0 iso 0 dist 7.20455 11.1328 8.55004 5.86458 6.50216 13.7524 numMergedOcc 0
3 mol 51 unq 1 iso 0 dist 7.20455 11.1328 8.55004 12.1777 9.83073 10.3853 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 7.2833 10.6122 6.97882 8.1075 5.87906 5.6513 numMergedOcc 0
5 mol 87 unq 1 iso 0 dist 7.2833 14.6808 9.4868 8.1075 5.87906 7.41574 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 9.31914 7.97502 9.83596 10.1282 6.81489 5.13142 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.75007 6.92975 9.96416 16.1672 9.63488 15.8182 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 8.75007 6.53637 7.17051 16.1672 9.63488 13.6469 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 8.75007 11.1722 5.9962 16.1672 9.63488 6.63023 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.40514 8.76824 5.31333 6.99364 9.89709 9.79728 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 7.95977 5.5367 8.40718 8.91299 5.67196 11.2342 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 8.17025 15.6599 8.40718 6.42715 5.67196 11.2342 numMergedOcc 0
13 mol 217 unq 0 iso 0 dist 6.00351 6.94126 8.72578 5.51329 5.89788 10.8948 numMergedOcc 0
14 mol 217 unq 1 iso 0 dist 6.00351 8.73011 8.80103 5.51329 5.89788 5.21449 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 7.49227 14.4022 9.87685 9.22288 6.14732 8.98279 numMergedOcc 0
16 mol 227 unq 1 iso 0 dist 8.09975 10.1619 9.87685 10.3528 6.14732 8.98279 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 9.70244 5.81104 7.47179 10.9593 8.34389 10.9407 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.70244 5.81104 7.47179 10.9593 8.34389 10.9407 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 9.70244 5.81104 7.47179 10.9593 8.34389 10.9407 numMergedOcc 0
