0 mol 0 unq 0 iso 0 dist 8.82102 9.66691 6.80481 8.21826 9.67081 14.3883 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.87871 9.45239 9.36867 15.1968 9.99939 10.8657 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 9.56737 8.63912 5.6823 13.6875 7.17488 12.5877 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 5.25492 9.24252 8.4494 7.32685 9.10911 9.25023 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 8.54461 8.15289 10.0101 4.81304 8.81797 11.8427 numMergedOcc 0
5 mol 130 unq 1 iso 0 dist 7.83619 8.15289 10.4339 4.81304 5.92733 11.8427 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 9.10619 8.78112 4.84714 17.3816 9.00072 12.4493 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 9.00898 8.87876 5.57734 10.8953 9.19156 12.1276 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 8.0974 7.97 9.4452 12.4011 4.72821 13.1149 numMergedOcc 0
9 mol 178 unq 1 iso 0 dist 8.0974 6.95432 6.42973 12.4011 4.72821 9.15383 numMergedOcc 0
10 mol 178 unq 2 iso 0 dist 8.0974 9.32853 10.8373 12.4011 4.72821 15.0797 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 7.31181 8.41645 12.5823 10.7786 9.96536 15.6569 numMergedOcc 0
12 mol 198 unq 0 iso 0 dist 6.47339 9.12973 8.80161 6.52619 6.77156 13.9691 numMergedOcc 0
13 mol 198 unq 1 iso 0 dist 6.47339 9.12973 8.80161 9.94769 7.97894 16.3196 numMergedOcc 0
14 mol 198 unq 2 iso 0 dist 6.47339 9.12973 8.80161 8.48501 8.08471 12.1529 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 9.72979 5.83021 7.89575 13.6373 9.4629 13.8095 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 9.67457 9.11574 13.1851 8.81074 6.85824 15.1051 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.37342 7.69491 10.6736 7.72768 4.43499 10.5638 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.02914 8.18813 4.40029 11.5613 7.42932 5.13533 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 6.90434 8.18813 3.97543 11.5613 4.9764 5.13533 numMergedOcc 0
20 mol 277 unq 2 iso 0 dist 6.90434 8.18813 3.97543 13.0566 6.36559 8.0969 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.53225 9.4181 7.83976 7.27864 9.07995 13.6064 numMergedOcc 0
