0 mol 44 unq 0 iso 0 dist 9.96265 8.17152 7.52117 11.0726 14.5415 9.16411 numMergedOcc 0
1 mol 44 unq 1 iso 0 dist 9.70459 10.0357 7.52117 15.7014 14.5415 9.16411 numMergedOcc 0
2 mol 44 unq 2 iso 0 dist 7.78905 7.37043 7.52117 15.0311 14.5415 9.16411 numMergedOcc 0
3 mol 44 unq 3 iso 0 dist 9.44909 6.36853 7.52117 15.1114 14.5415 9.16411 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.5819 7.07175 8.65802 9.29249 9.40813 6.40964 numMergedOcc 0
5 mol 140 unq 0 iso 0 dist 9.6224 5.62223 8.64368 13.4216 6.69824 9.38985 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 9.97921 5.5367 6.20182 9.74749 6.22059 8.6792 numMergedOcc 0
7 mol 162 unq 1 iso 0 dist 8.25167 5.49559 8.00506 8.03695 5.00649 4.49707 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 8.14096 4.90755 9.94125 9.63473 8.90206 9.94406 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 8.43038 10.8056 9.94125 15.61 8.90206 9.94406 numMergedOcc 0
10 mol 167 unq 2 iso 0 dist 9.87966 13.8234 9.94125 18.1415 8.90206 9.94406 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.03995 11.8884 6.258 12.6396 5.5366 9.39908 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.03995 11.8884 6.258 14.1744 7.39708 9.14238 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 7.63036 6.90444 6.60567 13.0457 9.70055 7.92844 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 5.87223 6.8255 6.29767 8.09185 5.3615 4.72269 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 8.062 11.009 6.29767 7.27225 5.3615 4.72269 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 8.70011 8.66123 6.29767 8.14212 5.3615 4.72269 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 4.84709 6.83037 8.46327 12.2006 14.3395 5.96047 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 7.0843 13.9605 8.86175 10.5441 7.34507 5.8679 numMergedOcc 0
19 mol 218 unq 1 iso 0 dist 7.73315 13.9605 6.29511 10.5441 4.79566 5.8679 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 9.5822 6.08522 7.42587 13.3682 12.5237 7.61091 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 9.83721 11.6666 9.69696 14.4981 6.25954 9.81316 numMergedOcc 0
