0 mol 4 unq 0 iso 0 dist 9.15878 10.6508 9.12428 7.64358 5.93454 12.0855 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.73363 10.009 6.12361 4.04528 5.56687 7.23703 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.72594 4.29643 5.40582 4.30233 9.0338 6.05872 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 5.16531 10.0961 8.59695 7.03404 6.52844 4.55551 numMergedOcc 0
4 mol 129 unq 1 iso 0 dist 6.65878 5.56946 8.00624 6.15789 9.7113 4.92472 numMergedOcc 0
5 mol 129 unq 2 iso 0 dist 6.65878 6.10584 8.42289 6.15789 9.7113 12.263 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 5.47265 6.91778 9.88662 4.31702 7.08651 8.57132 numMergedOcc 0
7 mol 147 unq 1 iso 0 dist 5.47265 6.91778 9.88662 6.78733 6.78887 13.3253 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 8.65008 5.5065 6.36439 9.10645 8.60004 7.51976 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 5.96301 5.73422 8.50926 8.92612 8.75305 10.8404 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 5.96301 5.73422 8.50926 4.24324 5.13522 5.18356 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 5.60956 6.59758 8.41715 6.62718 5.24076 11.7533 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 5.60956 5.81821 7.79893 6.62718 5.24076 7.32989 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.09185 6.89695 9.55058 9.39384 6.80332 10.5131 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 8.09185 6.89695 9.55058 5.94698 7.64336 10.3396 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 7.27225 13.2173 9.55058 4.69067 6.80332 10.5131 numMergedOcc 0
16 mol 212 unq 3 iso 0 dist 7.27225 13.2173 9.55058 4.18086 7.64336 10.3396 numMergedOcc 0
17 mol 212 unq 4 iso 0 dist 8.14212 7.25611 9.55058 5.37854 6.80332 10.5131 numMergedOcc 0
18 mol 212 unq 5 iso 0 dist 8.14212 7.25611 9.55058 3.74692 7.64336 10.3396 numMergedOcc 0
19 mol 241 unq 0 iso 0 dist 8.48816 14.2691 7.73213 9.73806 5.6297 4.90279 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.99435 4.84657 6.03235 10.7055 9.95217 6.61689 numMergedOcc 0
