0 mol 2 unq 0 iso 0 dist 6.89072 9.78005 10.5078 5.67638 6.90295 10.9877 11.5155 5.74846 14.9062 8.75089 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 6.89072 9.78005 10.5078 5.67638 6.90295 10.9877 8.29487 4.93584 15.0413 8.39246 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 7.17695 9.33207 3.39356 6.21227 6.09002 9.45204 3.78294 9.38691 10.9625 9.17494 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 7.17695 9.33207 3.39356 6.21227 6.09002 9.45204 6.48654 8.65986 9.39462 10.5109 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 7.17695 9.33207 3.39356 6.21227 6.09002 9.45204 8.39164 9.74724 9.13347 13.0651 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 4.90216 9.84217 10.472 10.9658 8.30217 17.5124 6.8954 6.10199 15.652 5.43926 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.40699 8.56269 12.9011 12.0948 7.74064 16.8258 9.38171 9.06249 13.7401 4.79268 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 9.16089 9.58434 5.7181 5.89379 6.42623 10.2878 9.38441 9.43682 13.9772 4.98499 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 8.76449 8.36182 3.6066 6.91778 6.73617 9.03544 12.2295 9.28718 9.68833 9.58148 numMergedOcc 0
9 mol 283 unq 0 iso 0 dist 9.35302 8.85163 13.4236 4.44211 9.07995 12.3883 3.27256 9.74797 9.90494 6.79513 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 7.84189 9.1471 9.30266 7.19628 5.30118 13.0643 14.42 9.97939 19.2174 7.57364 numMergedOcc 0
11 mol 287 unq 1 iso 0 dist 7.84189 9.1471 9.30266 11.7959 8.98698 17.6905 14.42 9.97939 19.2174 3.99731 numMergedOcc 0
12 mol 288 unq 0 iso 0 dist 7.84189 9.1471 9.30266 7.19628 5.30118 13.0643 14.42 9.97939 19.2174 7.57364 numMergedOcc 0
13 mol 288 unq 1 iso 0 dist 7.84189 9.1471 9.30266 11.7959 8.98698 17.6905 14.42 9.97939 19.2174 3.99731 numMergedOcc 0
14 mol 289 unq 0 iso 0 dist 7.84189 9.1471 9.30266 7.19628 5.30118 13.0643 14.42 9.97939 19.2174 7.57364 numMergedOcc 0
15 mol 289 unq 1 iso 0 dist 7.84189 9.1471 9.30266 11.7959 8.98698 17.6905 14.42 9.97939 19.2174 3.99731 numMergedOcc 0
