0 mol 5 unq 0 iso 0 dist 7.89217 6.81899 9.39982 12.5519 7.94007 15.9268 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.89217 9.22198 6.78181 12.5519 7.94007 12.5941 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 7.89217 8.91509 7.02829 12.5519 7.94007 14.8914 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 5.87633 7.09381 9.40652 4.76657 9.29131 11.1419 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.45684 7.66372 4.78627 11.7446 7.32896 10.9975 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 7.76644 9.99743 4.78627 12.8925 7.32896 10.9975 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.85356 6.7939 4.56026 11.9879 8.31425 9.55957 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 7.32265 5.68894 4.56026 9.90214 8.31425 9.55957 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 9.39801 4.82346 9.73996 10.1135 8.6681 13.8069 numMergedOcc 0
9 mol 99 unq 1 iso 0 dist 9.39801 8.89165 10.6378 10.1135 8.6681 16.7127 numMergedOcc 0
10 mol 99 unq 2 iso 0 dist 6.02154 8.07233 9.73996 5.75293 8.6681 13.8069 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 6.45169 9.14809 10.7259 4.71928 6.27699 10.9463 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 7.08934 8.87346 4.82565 5.20508 9.07511 12.5308 numMergedOcc 0
13 mol 172 unq 0 iso 0 dist 7.44084 9.21942 13.7364 7.84368 8.43951 10.3285 numMergedOcc 0
14 mol 172 unq 1 iso 0 dist 7.44084 7.77643 10.1227 7.84368 8.43951 14.6725 numMergedOcc 0
15 mol 172 unq 2 iso 0 dist 5.28889 4.90175 10.1227 10.7644 8.43951 14.6725 numMergedOcc 0
16 mol 203 unq 0 iso 0 dist 5.46529 7.72215 5.73409 5.8706 7.06171 11.0624 numMergedOcc 0
17 mol 203 unq 1 iso 0 dist 9.47882 8.60067 11.2093 5.11784 9.74862 8.8586 numMergedOcc 0
18 mol 203 unq 2 iso 0 dist 8.60067 9.47882 11.2093 5.11784 8.8586 9.74862 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 9.57625 8.08702 11.0459 10.5985 9.51136 15.4986 numMergedOcc 0
20 mol 228 unq 0 iso 0 dist 9.63694 8.06909 8.75984 5.44117 8.44525 11.6384 numMergedOcc 0
21 mol 228 unq 1 iso 0 dist 9.64659 8.22515 8.70123 5.21826 8.17701 11.3862 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 6.50985 8.40277 7.08033 12.654 9.38691 15.9163 numMergedOcc 0
23 mol 254 unq 0 iso 0 dist 5.73448 9.54526 7.61007 5.12074 8.73899 14.2556 numMergedOcc 0
24 mol 261 unq 0 iso 0 dist 6.99444 8.25759 5.29945 12.9946 8.50063 10.8849 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 6.51248 8.30313 5.72971 12.9014 8.99154 11.5081 numMergedOcc 0
