0 mol 24 unq 0 iso 0 dist 4.93188 8.23075 4.21283 12.3067 9.24958 10.551 9.48345 9.40479 13.1457 13.1456 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 4.93188 8.23075 4.21283 12.3067 9.24958 10.551 14.4162 9.58012 8.56274 10.0655 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 4.93188 4.7841 4.97191 12.3067 9.24958 14.1707 9.48345 9.40479 11.1639 13.1456 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 4.93188 4.7841 4.97191 12.3067 9.24958 14.1707 14.4162 9.58012 12.9621 10.0655 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.93832 7.39848 6.59887 8.13395 8.60739 11.4251 7.05402 7.31982 9.82307 5.48048 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 9.29384 8.80895 9.6795 13.2572 9.15431 17.4411 15.7796 7.76594 16.0842 7.21005 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 9.29384 8.80895 9.6795 6.63273 6.92648 12.9064 15.7796 7.76594 16.0842 11.5688 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 6.69515 7.46621 10.7652 6.21253 7.86572 13.6589 9.76015 8.26172 14.9214 8.24418 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 5.49226 8.39897 7.88487 7.15222 6.28351 12.4684 9.02993 9.23528 10.1908 14.4247 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.77552 7.55934 6.69469 7.65448 8.28642 11.2397 7.2238 6.39031 9.48674 5.59336 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.24795 5.90765 9.28201 9.41955 9.56197 14.8324 13.0197 7.55358 16.601 9.27818 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 7.24795 5.90765 9.28201 9.41955 9.56197 14.8324 12.9082 7.60991 15.3973 9.55926 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 7.24795 5.90765 9.28201 13.684 8.64409 17.3863 13.0197 7.55358 16.601 4.37002 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 7.24795 5.90765 9.28201 13.684 8.64409 17.3863 12.9082 7.60991 15.3973 4.64235 numMergedOcc 0
14 mol 186 unq 4 iso 0 dist 7.24795 5.90765 9.28201 9.45987 7.60202 13.011 13.0197 7.55358 16.601 9.72941 numMergedOcc 0
15 mol 186 unq 5 iso 0 dist 7.24795 5.90765 9.28201 9.45987 7.60202 13.011 12.9082 7.60991 15.3973 5.39885 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 6.26839 9.52922 7.82899 8.0179 8.12346 11.2599 6.66155 5.52678 5.13892 6.12973 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 6.26839 9.52922 7.82899 8.0179 8.12346 11.2599 5.4499 9.81666 8.2232 11.0239 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 6.26839 9.52922 7.82899 14.6506 8.83356 14.7152 6.66155 5.52678 5.13892 13.0333 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 6.26839 9.52922 7.82899 14.6506 8.83356 14.7152 5.4499 9.81666 8.2232 18.6469 numMergedOcc 0
20 mol 194 unq 4 iso 0 dist 6.26839 9.52922 7.82899 8.48054 8.2654 14.7929 6.66155 5.52678 5.13892 10.1796 numMergedOcc 0
21 mol 194 unq 5 iso 0 dist 6.26839 9.52922 7.82899 8.48054 8.2654 14.7929 5.4499 9.81666 8.2232 13.5457 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 5.76954 7.84952 11.2216 4.72474 6.29367 11.8692 10.4526 8.93185 18.1529 6.90702 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 5.76954 7.84952 11.2216 5.61978 9.20961 12.5146 10.4526 8.93185 18.1529 8.94041 numMergedOcc 0
24 mol 218 unq 2 iso 0 dist 6.29511 7.84952 5.46009 4.72474 8.86175 11.8692 11.438 9.06334 14.0126 9.46742 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 9.47583 5.77749 10.2659 4.28414 8.44909 9.30946 10.6074 9.53915 14.4602 9.23135 numMergedOcc 0
