0 mol 55 unq 0 iso 0 dist 6.32571 7.66306 6.71933 10.957 12.2626 6.13181 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 6.11881 6.17315 5.75015 6.59471 10.0706 7.51138 numMergedOcc 0
2 mol 90 unq 1 iso 0 dist 6.11881 6.17315 5.75015 12.5885 12.0159 9.86843 numMergedOcc 0
3 mol 90 unq 2 iso 0 dist 6.11881 6.17315 5.75015 9.78924 7.30343 6.86146 numMergedOcc 0
4 mol 90 unq 3 iso 0 dist 6.11881 6.17315 5.75015 14.6058 13.1089 8.83296 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.20639 7.01303 4.76302 9.92624 10.6302 8.48184 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.20639 7.01303 4.76302 7.6296 8.30176 9.01011 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 5.77804 8.21739 9.97157 3.74136 7.85041 5.51624 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 5.77804 4.78377 8.01991 3.74136 7.85041 7.8674 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 9.02541 5.61533 12.1933 7.46433 16.0246 8.77841 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.71611 6.97579 10.8642 6.54963 15.7467 8.26172 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 7.1093 6.97579 8.00633 6.54963 10.162 8.26172 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 6.36426 7.83509 6.29593 4.52246 5.1101 9.23528 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 7.06711 7.83509 11.2831 4.52246 7.01133 9.23528 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 7.6489 7.01483 6.29593 5.88056 5.1101 9.23528 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.55974 9.67802 6.20673 14.8027 14.1431 8.12349 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 8.03194 7.84953 8.21424 13.3105 16.9043 8.93185 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 8.03194 4.57726 10.1198 8.98232 17.0082 9.06334 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 8.94219 7.10883 7.15437 8.96094 12.5533 6.53728 numMergedOcc 0
