0 mol 21 unq 0 iso 0 dist 6.97295 8.33265 10.4247 4.96524 7.30397 11.4253 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 5.1232 6.9902 5.46236 6.41735 7.98039 4.96613 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 4.76168 8.33541 5.46236 11.1359 7.98039 4.96613 numMergedOcc 0
3 mol 102 unq 0 iso 0 dist 5.90675 6.00241 6.43211 7.2492 8.62829 12.6609 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 7.88328 6.00571 11.1968 4.03003 9.00087 9.90296 numMergedOcc 0
5 mol 127 unq 1 iso 0 dist 5.33851 6.00571 6.02157 4.03003 8.66991 9.90296 numMergedOcc 0
6 mol 168 unq 0 iso 0 dist 8.66519 6.8754 11.0283 9.98154 6.33621 13.076 numMergedOcc 0
7 mol 168 unq 1 iso 0 dist 8.35731 9.08545 11.0283 6.8148 6.33621 13.076 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 5.34307 6.98498 5.36423 7.32033 9.2802 12.2297 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 5.34307 6.98498 5.36423 6.52597 7.2843 11.8551 numMergedOcc 0
10 mol 254 unq 0 iso 0 dist 8.22257 6.45323 12.4851 4.72583 7.28781 11.0121 numMergedOcc 0
11 mol 254 unq 1 iso 0 dist 5.91549 6.45323 8.16645 4.72583 7.00841 11.0121 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 5.50553 8.94629 11.8626 5.0607 8.51736 11.9529 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 5.59641 9.62474 14.4541 4.82331 6.77259 10.3937 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 5.59641 8.01441 8.9894 4.82331 6.77259 9.85331 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 5.10476 6.20852 9.06411 4.75743 7.14502 6.1268 numMergedOcc 0
