0 mol 2 unq 0 iso 0 dist 5.69072 4.72883 5.5745 11.8919 8.5893 8.75089 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.69072 4.72883 5.5745 12.2381 8.29974 8.39246 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 4.15066 4.90352 7.11633 8.09804 8.77401 9.24758 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.20409 9.7651 9.96265 8.82243 9.38647 14.5995 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.25884 5.82571 8.04256 12.47 6.59983 13.8724 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 8.25884 5.82571 8.04256 14.2906 9.92579 15.9935 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 8.94991 10.6508 8.86252 4.09058 8.6176 7.03963 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.08733 4.93421 7.91337 9.27744 8.04669 12.378 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.08733 4.93421 7.91337 12.1421 7.46162 12.5595 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 8.08733 9.5414 6.40546 9.27744 8.04669 8.87718 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.08733 9.5414 6.40546 12.1421 7.46162 4.72999 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 4.90449 7.79347 7.91337 4.66853 8.04669 12.378 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 4.90449 7.79347 7.91337 7.59918 7.46162 12.5595 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 4.90449 6.77381 6.40546 4.66853 8.04669 8.87718 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 4.90449 6.77381 6.40546 7.59918 7.46162 4.72999 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 9.27825 14.7753 9.878 11.343 6.83972 4.84598 numMergedOcc 0
16 mol 185 unq 1 iso 0 dist 9.27825 14.7753 9.878 11.5745 6.70069 7.73092 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 5.39622 5.01462 8.96988 7.22399 9.33272 5.88779 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 9.53121 4.77798 7.80299 6.16779 9.21553 5.04574 numMergedOcc 0
19 mol 187 unq 0 iso 0 dist 8.45366 10.7804 9.36086 9.93237 5.14547 6.93763 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 9.60654 5.78711 9.13552 9.53654 8.9785 4.04791 numMergedOcc 0
21 mol 251 unq 0 iso 0 dist 8.3966 4.80531 8.39644 10.3416 9.29007 7.41935 numMergedOcc 0
22 mol 251 unq 1 iso 0 dist 5.34851 5.60154 8.39644 5.97182 9.29007 7.41935 numMergedOcc 0
