0 mol 34 unq 0 iso 0 dist 8.8717 4.81606 5.98267 8.36524 14.0576 9.44189 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 5.85932 5.40957 9.10516 8.23258 5.3502 8.08117 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.87921 4.02677 7.59119 9.00028 6.61767 5.75761 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 6.2442 8.22643 7.66662 9.32783 4.79817 6.33741 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 8.82052 9.37751 8.03724 9.9795 4.18004 9.30021 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 8.82052 9.37751 8.03724 11.5591 8.42713 5.62635 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.37793 12.9222 6.85886 8.66715 8.28698 9.64695 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.37793 12.9222 6.85886 9.00172 5.74088 4.51266 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 7.47477 5.02623 6.81389 9.90891 12.7863 6.29592 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 8.65572 8.98361 6.81389 11.1137 12.7863 6.29592 numMergedOcc 0
10 mol 206 unq 2 iso 0 dist 8.39332 8.98361 9.31865 11.1137 9.66559 6.29592 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 7.09453 5.01865 4.96527 10.1247 5.14473 7.77578 numMergedOcc 0
12 mol 229 unq 1 iso 0 dist 7.09453 5.01865 4.96527 11.2852 9.62106 7.38552 numMergedOcc 0
13 mol 229 unq 2 iso 0 dist 8.69109 10.4687 4.96527 12.013 5.14473 7.77578 numMergedOcc 0
14 mol 229 unq 3 iso 0 dist 8.69109 10.4687 4.96527 16.7227 9.62106 7.38552 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 9.44744 6.73456 7.19006 12.572 6.66384 6.68262 numMergedOcc 0
16 mol 270 unq 0 iso 0 dist 6.87859 5.72776 6.38788 13.5428 9.50664 8.34847 numMergedOcc 0
17 mol 270 unq 1 iso 0 dist 6.87859 5.72776 6.38788 10.1632 4.69698 9.73905 numMergedOcc 0
