0 mol 17 unq 0 iso 0 dist 7.30541 8.58468 5.67737 5.22923 8.55161 6.64199 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 7.30541 7.95007 8.04504 5.22923 8.55161 8.90155 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.88399 9.08536 6.08168 3.94196 5.65754 7.61183 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.66461 7.99735 10.9256 3.42062 12.6509 7.90416 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 9.66461 7.99735 10.9256 13.5492 12.303 9.74553 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 8.81136 9.7516 10.9256 12.971 12.6509 7.90416 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 8.81136 9.7516 10.9256 4.70736 12.303 9.74553 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.22704 6.00684 10.1574 6.02092 7.75543 6.64921 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 6.27877 9.37034 4.74629 3.81285 7.51319 8.67342 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 6.27877 9.37034 4.74629 6.17121 8.49887 8.60062 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 6.27877 6.60091 7.39588 3.81285 7.51319 5.73739 numMergedOcc 0
11 mol 85 unq 3 iso 0 dist 6.27877 6.60091 7.39588 6.17121 8.49887 5.16225 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 4.95077 9.07154 10.8322 5.0146 9.71586 8.52131 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 6.74185 9.05572 5.94269 3.52268 7.29985 9.84239 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 6.74185 9.05572 5.94269 7.39809 7.58281 9.1728 numMergedOcc 0
15 mol 176 unq 2 iso 0 dist 6.74185 9.05572 5.94269 8.44347 8.8756 8.0255 numMergedOcc 0
16 mol 203 unq 0 iso 0 dist 9.44579 6.79769 5.76556 4.67056 10.2242 9.91254 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.27169 7.91999 12.4027 10.0567 17.9405 8.70416 numMergedOcc 0
18 mol 233 unq 1 iso 0 dist 8.27169 7.91999 12.4027 5.97893 14.2027 8.18379 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 6.17408 6.70738 10.3685 3.65952 8.99104 4.37138 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 6.17602 8.55314 10.3685 7.05149 8.99104 4.37138 numMergedOcc 0
21 mol 248 unq 0 iso 0 dist 9.82116 9.37614 5.26794 15.6281 14.2989 9.99025 numMergedOcc 0
22 mol 251 unq 0 iso 0 dist 7.73217 8.08045 4.72905 3.46172 8.15014 7.90148 numMergedOcc 0
