0 mol 48 unq 0 iso 0 dist 7.49678 4.27513 7.78899 11.6027 8.10222 10.6357 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 7.65728 4.28494 7.86285 7.09591 9.52717 7.02963 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.6702 3.7742 9.56474 9.27313 7.89643 11.5819 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 8.21972 11.7423 9.56474 7.78337 7.89643 11.5819 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.68303 6.98599 8.52421 3.97203 5.26566 3.73169 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.68303 6.98599 8.52421 3.90966 6.27118 7.15831 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.08674 4.05111 6.97936 6.27527 5.91098 3.35924 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.33694 4.05111 5.00466 6.27527 4.86523 3.35924 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.83241 5.71616 9.31543 9.45041 4.4077 9.74071 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 9.83241 5.71616 9.31543 5.50122 8.4874 6.92699 numMergedOcc 0
10 mol 129 unq 2 iso 0 dist 9.83241 11.0564 8.85652 9.45041 4.4077 9.87781 numMergedOcc 0
11 mol 129 unq 3 iso 0 dist 9.83241 11.0564 8.85652 5.50122 8.4874 9.93375 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.78385 9.6256 5.27578 15.1362 8.99777 12.7357 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.17789 6.70611 5.27578 16.123 8.99777 12.7357 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.73513 4.60102 5.63283 12.1876 8.83628 8.93955 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 9.63094 4.74035 9.52528 12.4587 8.99666 15.3449 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.92271 14.6762 9.91103 9.69757 4.1545 5.9732 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 6.92271 14.6762 9.91103 10.2113 4.25172 8.61922 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 6.92271 11.68 7.0603 9.69757 4.1545 3.79766 numMergedOcc 0
19 mol 277 unq 3 iso 0 dist 6.92271 11.68 7.0603 10.2113 4.25172 7.07613 numMergedOcc 0
20 mol 277 unq 4 iso 0 dist 8.62666 11.3103 9.91103 7.55695 4.1545 5.9732 numMergedOcc 0
21 mol 277 unq 5 iso 0 dist 8.62666 11.3103 9.91103 6.26644 4.25172 8.61922 numMergedOcc 0
22 mol 277 unq 6 iso 0 dist 8.62666 10.5734 7.0603 7.55695 4.1545 3.79766 numMergedOcc 0
23 mol 277 unq 7 iso 0 dist 8.62666 10.5734 7.0603 6.26644 4.25172 7.07613 numMergedOcc 0
