0 mol 24 unq 0 iso 0 dist 8.0319 11.4109 6.86014 15.5112 10.0952 8.86116 9.57964 6.00575 6.60423 5.97304 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.03754 13.1056 6.20293 12.7352 5.06502 5.73819 16.8389 9.06158 8.60739 5.64171 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.03754 13.1056 6.20293 10.5813 6.45462 8.93915 16.8389 9.06158 8.60739 11.3891 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 9.47348 9.92508 8.93915 12.0317 5.89973 5.73819 16.976 11.3891 8.60739 5.64171 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 9.47348 9.92508 8.93915 12.0919 6.45462 6.20293 16.976 11.3891 8.60739 9.06158 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.23812 12.8453 9.96396 14.8693 15.7123 9.38498 12.238 8.26458 7.04044 15.7304 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.23812 12.8453 9.96396 10.5158 12.016 9.75218 12.238 8.26458 7.04044 8.35241 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.67557 9.9705 6.19965 14.3639 5.42586 7.97049 9.27584 5.08358 7.1589 6.37974 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.22737 12.9061 7.47343 14.2807 5.33144 6.45675 21.0071 14.9392 9.00544 11.8512 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 9.22737 12.9061 7.47343 14.2807 5.33144 6.45675 18.3923 12.6602 7.12017 9.52882 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 9.22737 12.9061 7.47343 15.6365 10.1407 8.86688 21.0071 14.9392 9.00544 9.01214 numMergedOcc 0
11 mol 100 unq 3 iso 0 dist 9.22737 12.9061 7.47343 15.6365 10.1407 8.86688 18.3923 12.6602 7.12017 14.8674 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 7.9258 4.75197 5.83991 9.26923 10.8507 7.30858 9.32933 6.4497 5.72642 5.61704 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 7.9258 4.75197 5.83991 12.4685 8.02349 7.88312 9.32933 6.4497 5.72642 7.3094 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 8.41774 13.793 6.70283 13.7313 5.42328 5.87555 17.4405 9.35627 8.28642 5.70788 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 8.41774 13.793 6.70283 12.3711 6.4896 8.67331 17.4405 9.35627 8.28642 11.2078 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 8.27093 10.9396 7.22101 14.9014 6.99063 9.34734 13.2994 10.5813 8.03442 10.2525 numMergedOcc 0
17 mol 227 unq 1 iso 0 dist 8.27093 10.9396 7.22101 9.02226 5.22356 8.65997 13.2994 10.5813 8.03442 7.22396 numMergedOcc 0
18 mol 227 unq 2 iso 0 dist 8.27093 10.9396 7.22101 16.5135 10.8658 7.56888 13.2994 10.5813 8.03442 6.10296 numMergedOcc 0
19 mol 227 unq 3 iso 0 dist 8.27093 10.9396 7.22101 18.1901 12.4689 7.55216 13.2994 10.5813 8.03442 9.69537 numMergedOcc 0
20 mol 227 unq 4 iso 0 dist 9.02226 10.9396 8.65997 14.9014 7.60506 9.34734 13.2994 7.22396 8.03442 10.2525 numMergedOcc 0
21 mol 227 unq 5 iso 0 dist 9.02226 10.9396 8.65997 8.27093 5.22356 7.22101 13.2994 7.22396 8.03442 10.5813 numMergedOcc 0
22 mol 227 unq 6 iso 0 dist 9.02226 10.9396 8.65997 16.5135 9.70012 7.56888 13.2994 7.22396 8.03442 6.10296 numMergedOcc 0
23 mol 227 unq 7 iso 0 dist 9.02226 10.9396 8.65997 18.1901 12.9332 7.55216 13.2994 7.22396 8.03442 9.69537 numMergedOcc 0
24 mol 227 unq 8 iso 0 dist 9.78611 9.775 7.55216 16.5049 9.51866 9.34734 16.2404 9.69537 8.03442 10.2525 numMergedOcc 0
25 mol 227 unq 9 iso 0 dist 9.78611 9.775 7.55216 15.8356 12.4689 7.22101 16.2404 9.69537 8.03442 10.5813 numMergedOcc 0
26 mol 227 unq 10 iso 0 dist 9.78611 9.775 7.55216 18.3506 12.9332 8.65997 16.2404 9.69537 8.03442 7.22396 numMergedOcc 0
27 mol 227 unq 11 iso 0 dist 9.78611 9.775 7.55216 13.4874 4.48529 7.56888 16.2404 9.69537 8.03442 6.10296 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.83023 9.15968 7.03423 10.7513 5.57838 8.22528 16.592 9.62106 8.92743 11.6847 numMergedOcc 0
29 mol 236 unq 0 iso 0 dist 6.61371 9.63949 7.68742 10.4172 5.79505 9.81562 14.7009 9.05842 8.50331 7.22918 numMergedOcc 0
30 mol 236 unq 1 iso 0 dist 6.61371 9.63949 7.68742 14.1598 11.3368 6.27581 14.7009 9.05842 8.50331 7.00028 numMergedOcc 0
31 mol 236 unq 2 iso 0 dist 5.90804 7.45579 6.27581 11.8908 9.90963 9.81562 5.6241 7.00028 8.50331 7.22918 numMergedOcc 0
32 mol 236 unq 3 iso 0 dist 5.90804 7.45579 6.27581 12.0498 11.3368 7.68742 5.6241 7.00028 8.50331 9.05842 numMergedOcc 0
