0 mol 71 unq 0 iso 0 dist 5.75102 6.01135 9.02337 5.31671 9.3877 10.6762 12.2856 8.92529 17.433 12.1458 numMergedOcc 0
1 mol 71 unq 1 iso 0 dist 8.80254 9.08264 9.02337 7.01416 9.3877 10.6762 14.1584 8.92529 17.433 12.1458 numMergedOcc 0
2 mol 132 unq 0 iso 0 dist 7.14447 9.7415 8.45021 4.73274 5.52837 12.0514 9.07803 9.39389 16.827 4.8602 numMergedOcc 0
3 mol 136 unq 0 iso 0 dist 9.67457 8.17454 14.4862 13.4598 8.99371 17.921 6.29723 8.41727 13.5665 8.89786 numMergedOcc 0
4 mol 136 unq 1 iso 0 dist 9.67457 9.2549 14.1732 13.4598 8.99371 20.4813 6.29723 8.41727 15.2282 8.89786 numMergedOcc 0
5 mol 165 unq 0 iso 0 dist 3.87901 9.14728 8.46989 6.29065 8.19939 15.3279 8.4352 7.21397 14.4639 7.20315 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 6.6514 9.08844 13.8546 6.25478 7.04009 13.9797 8.3419 7.20545 17.3046 4.91302 numMergedOcc 0
7 mol 246 unq 0 iso 0 dist 4.7583 8.29801 5.54599 4.96684 8.94816 11.6014 4.50365 8.16617 12.677 5.32561 numMergedOcc 0
8 mol 252 unq 0 iso 0 dist 9.31855 6.35781 7.39922 12.2252 8.85493 14.561 11.2871 8.19645 12.9505 5.07471 numMergedOcc 0
9 mol 252 unq 1 iso 0 dist 9.31855 8.06117 10.7426 12.2252 8.85493 17.6793 11.2871 8.19645 16.81 5.07471 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 7.31462 8.40726 13.7115 4.23467 numMergedOcc 0
11 mol 287 unq 1 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 6.64598 5.15923 9.82863 5.71189 numMergedOcc 0
12 mol 287 unq 2 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 7.31462 8.40726 13.7115 10.478 numMergedOcc 0
13 mol 287 unq 3 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 6.64598 5.15923 9.82863 8.049 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 7.31462 8.40726 13.7115 4.23467 numMergedOcc 0
15 mol 288 unq 1 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 6.64598 5.15923 9.82863 5.71189 numMergedOcc 0
16 mol 288 unq 2 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 7.31462 8.40726 13.7115 10.478 numMergedOcc 0
17 mol 288 unq 3 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 6.64598 5.15923 9.82863 8.049 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 7.31462 8.40726 13.7115 4.23467 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 9.11602 7.17626 13.3487 9.45859 7.64715 14.3812 6.64598 5.15923 9.82863 5.71189 numMergedOcc 0
20 mol 289 unq 2 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 7.31462 8.40726 13.7115 10.478 numMergedOcc 0
21 mol 289 unq 3 iso 0 dist 9.11602 7.17626 13.3487 14.2612 8.50508 17.4716 6.64598 5.15923 9.82863 8.049 numMergedOcc 0
