0 mol 56 unq 0 iso 0 dist 6.80741 4.7418 8.63486 12.7165 18.2661 9.78177 numMergedOcc 0
1 mol 56 unq 1 iso 0 dist 6.80741 4.7418 8.63486 9.45622 10.6193 7.03635 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.02288 6.28525 8.03303 11.7159 5.4527 8.39494 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.58544 5.32605 8.03303 11.9404 5.4527 8.39494 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 6.31633 5.70461 8.67766 11.8441 9.09837 8.71813 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 7.21115 5.70461 8.0831 11.8441 10.9676 8.71813 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 8.42445 10.9798 6.34525 10.5582 4.77991 5.5606 numMergedOcc 0
7 mol 124 unq 0 iso 0 dist 9.91381 8.19216 8.80896 14.5714 9.28205 7.28496 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 6.42756 8.81081 6.69515 16.174 14.4768 8.02258 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.82249 5.16577 6.20182 13.6775 6.22059 8.6792 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 9.00898 13.624 9.17364 12.132 7.12332 7.05288 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.66381 5.77691 6.258 6.94326 5.5366 9.39908 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 7.66381 5.77691 6.258 10.2224 7.39708 9.14238 numMergedOcc 0
13 mol 230 unq 0 iso 0 dist 8.49299 11.9554 6.41286 18.7753 12.2372 6.86851 numMergedOcc 0
14 mol 230 unq 1 iso 0 dist 8.49299 11.9554 6.41286 14.105 9.33469 9.88392 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 9.71281 6.09244 6.39158 14.2083 5.01259 9.49829 numMergedOcc 0
16 mol 235 unq 1 iso 0 dist 9.2433 6.09244 7.75722 14.2083 15.1887 9.49829 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.18901 10.5747 9.69696 12.1393 6.25954 9.81316 numMergedOcc 0
