0 mol 4 unq 0 iso 0 dist 9.84876 10.8556 6.45344 13.8407 4.04276 8.35272 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.84674 7.31875 9.7218 11.6671 9.92539 5.2568 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.28883 5.82846 8.96621 12.6509 7.84827 9.77004 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.28883 5.82846 8.96621 12.303 14.1465 8.36323 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 6.01454 13.2371 8.96621 11.8063 6.38985 7.37491 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.41952 10.2713 7.62846 11.4214 5.67799 9.82679 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 7.25133 6.26197 9.93897 5.78493 4.32945 9.67741 numMergedOcc 0
7 mol 126 unq 1 iso 0 dist 9.33622 12.5693 9.93897 13.3358 4.32945 9.67741 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 9.33635 5.01943 8.82556 11.0888 4.91049 8.11959 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 9.71692 11.2206 6.58752 11.6654 5.6048 7.53552 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 9.73708 11.1844 6.62442 11.7448 5.53516 7.49948 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 8.64349 8.89762 5.5411 11.21 8.92393 5.03758 numMergedOcc 0
12 mol 165 unq 1 iso 0 dist 8.64349 8.89762 5.5411 13.2322 9.38939 4.63353 numMergedOcc 0
13 mol 165 unq 2 iso 0 dist 8.2197 13.2511 5.5411 15.7898 9.57484 9.93641 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.39345 8.42816 8.51847 6.97766 4.25519 6.7279 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.94142 12.085 8.51847 10.3073 4.41312 5.06194 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 7.62593 6.4556 5.90784 10.5322 4.04107 6.04509 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 9.58767 5.05272 5.80702 9.31626 7.64377 9.137 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 9.58767 5.05272 5.80702 9.77366 4.87368 8.0127 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 8.26333 12.9657 7.70185 21.2679 14.45 8.5948 numMergedOcc 0
