0 mol 19 unq 0 iso 0 dist 9.23617 5.83115 8.41365 6.57527 7.69625 4.99617 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.59114 4.06798 8.41365 8.42839 7.69625 4.99617 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.63204 15.1867 8.41365 11.9235 7.69625 4.99617 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 4.61828 5.06937 5.78238 13.674 9.38831 13.3639 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.43154 11.7579 9.06172 8.45629 6.13181 6.01358 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.91206 6.93186 9.23537 16.3838 8.58543 15.2389 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.67513 7.21044 9.23537 10.3777 8.58543 15.2389 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 8.40669 5.47516 6.54474 10.5555 7.63127 5.72753 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 6.93136 5.73493 6.63984 6.36527 5.73236 6.40361 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 6.31314 6.14743 8.49918 11.8677 9.14458 11.3572 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 9.17868 4.94233 5.85349 7.59931 4.9941 6.00736 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 9.17868 4.94233 5.85349 17.1327 8.06913 13.0334 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 6.85463 3.96207 8.16601 8.07237 8.53374 5.16577 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 8.27428 7.76905 8.20587 11.3139 8.5865 8.00182 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 8.27428 15.212 7.67133 11.3139 8.5865 11.4235 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 4.97005 13.1124 9.05979 10.0516 7.55358 6.46459 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 4.97005 13.1124 9.05979 5.57831 7.60991 11.9182 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 8.63008 15.0013 9.13708 10.3444 5.52678 11.1809 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 8.63008 15.0013 9.13708 14.1482 9.81666 7.62027 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.33735 9.25003 5.05201 10.8608 9.56257 11.6645 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 9.21767 11.2697 8.11918 5.62181 7.41079 6.08162 numMergedOcc 0
21 mol 294 unq 1 iso 0 dist 6.16375 10.5231 8.11918 10.0223 7.41079 6.08162 numMergedOcc 0
