0 mol 26 unq 0 iso 0 dist 9.32113 8.08257 6.74848 4.56199 7.90721 10.0347 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 7.61675 11.8798 7.75295 5.8992 6.2676 6.81798 numMergedOcc 0
2 mol 53 unq 1 iso 0 dist 9.64645 5.74596 7.75295 6.05689 6.2676 6.81798 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.57633 11.7158 6.62229 7.43516 6.87028 5.45005 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 7.65992 6.13443 6.40693 8.42586 8.05514 10.3533 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.26179 5.18957 7.62738 15.7193 7.69861 13.0054 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.89116 8.66162 8.8562 15.7791 9.6121 12.8661 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 9.89116 8.66162 8.8562 13.4766 9.57341 5.37917 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 9.89116 6.71925 7.91683 15.7791 9.6121 13.3563 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 9.89116 6.71925 7.91683 13.4766 9.57341 15.7711 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.78772 10.1812 4.46777 12.017 6.77921 3.98068 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.78772 12.0778 6.94988 12.017 6.77921 10.1551 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.52352 10.4027 6.95372 10.8782 7.16698 6.11087 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.52352 10.4027 6.95372 9.42107 8.68663 4.06908 numMergedOcc 0
14 mol 143 unq 2 iso 0 dist 7.23619 8.25297 6.95372 12.018 8.68663 4.06908 numMergedOcc 0
15 mol 143 unq 3 iso 0 dist 7.23619 8.25297 6.95372 6.75596 7.16698 6.11087 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 8.15524 13.3358 6.76055 3.96267 6.11331 11.3715 numMergedOcc 0
17 mol 158 unq 1 iso 0 dist 8.15524 14.2466 9.36343 3.96267 6.11331 14.1217 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.8747 10.038 5.95375 8.66359 7.53395 7.25932 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 7.47128 5.22125 8.13034 16.7369 9.30437 16.0925 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 5.71854 8.14939 9.63007 10.3623 9.07503 14.7394 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 5.71854 8.14939 9.63007 7.89015 7.63256 14.5604 numMergedOcc 0
22 mol 284 unq 2 iso 0 dist 7.66625 9.94187 9.63007 5.26543 9.07503 14.7394 numMergedOcc 0
23 mol 284 unq 3 iso 0 dist 7.66625 9.94187 9.63007 6.6556 7.63256 14.5604 numMergedOcc 0
