0 mol 43 unq 0 iso 0 dist 9.74445 10.323 8.80331 13.9432 14.0634 9.89546 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.74445 14.445 6.20293 13.7462 6.09486 9.07906 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.59893 11.9881 9.5589 13.6741 15.2053 8.41018 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 5.59773 13.9079 9.5589 17.6999 15.2053 8.41018 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 5.83937 9.96073 6.43294 11.9098 8.04342 8.43677 numMergedOcc 0
5 mol 60 unq 1 iso 0 dist 5.83937 9.96073 6.43294 6.36945 4.32336 7.77255 numMergedOcc 0
6 mol 60 unq 2 iso 0 dist 8.82095 13.6099 6.43294 15.8378 8.04342 8.43677 numMergedOcc 0
7 mol 60 unq 3 iso 0 dist 8.82095 13.6099 6.43294 12.573 4.32336 7.77255 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.89722 13.9156 8.70481 16.6902 10.169 5.62694 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 7.26679 11.2674 8.70481 15.3401 10.169 5.62694 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.49205 5.19198 6.18601 9.58147 7.36889 6.16081 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 8.40046 9.75166 9.30299 16.9272 12.4721 8.82676 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.10619 13.9994 6.70283 13.6133 5.97115 8.86966 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 9.10619 14.2552 7.16148 13.6133 5.97115 5.7527 numMergedOcc 0
14 mol 152 unq 2 iso 0 dist 9.74498 10.7816 8.67331 8.61946 4.36394 8.86966 numMergedOcc 0
15 mol 152 unq 3 iso 0 dist 9.74498 7.26476 8.05741 8.61946 4.36394 5.7527 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 8.0974 12.2822 6.69288 10.7023 4.43082 8.4173 numMergedOcc 0
17 mol 178 unq 1 iso 0 dist 8.0974 13.9722 7.17202 10.7023 4.43082 6.55543 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 7.86625 5.40949 9.31746 11.6774 9.87473 9.07173 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 9.8711 4.90657 9.23153 9.29698 13.231 4.96654 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 7.29898 8.95486 6.18582 12.4628 5.40456 7.27415 numMergedOcc 0
21 mol 249 unq 1 iso 0 dist 8.91685 9.66184 6.18582 12.8833 5.40456 7.27415 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 9.73021 5.26867 7.19638 10.1823 6.56535 7.48298 numMergedOcc 0
23 mol 252 unq 1 iso 0 dist 9.73021 5.26867 7.19638 12.3184 4.51829 8.9483 numMergedOcc 0
