0 mol 0 unq 0 iso 0 dist 7.65806 9.19007 9.64573 7.02374 12.7627 7.92928 10.5603 10.5877 4.62412 8.31596 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.65806 9.19007 9.64573 7.02374 12.7627 7.92928 10.4406 14.2251 5.96303 6.3267 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.6994 6.26831 6.34883 10.3034 10.9812 7.48645 15.944 11.4775 12.5081 8.31596 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 9.6994 6.26831 6.34883 10.3034 10.9812 7.48645 9.23213 5.08793 4.04089 6.3267 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 7.15528 6.26831 9.19662 10.3034 14.3013 7.48645 15.944 16.5028 12.5081 8.31596 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 7.15528 6.26831 9.19662 10.3034 14.3013 7.48645 9.23213 10.4498 4.04089 6.3267 numMergedOcc 0
6 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 4.85329 10.2611 9.07858 8.33604 8.27181 11.705 6.26865 numMergedOcc 0
7 mol 9 unq 0 iso 0 dist 8.57077 9.78006 3.98483 5.60154 8.47421 8.04924 6.85412 8.27962 7.98363 9.29529 numMergedOcc 0
8 mol 9 unq 1 iso 0 dist 8.57077 9.78006 3.98483 5.60154 8.47421 8.04924 6.33889 11.4878 10.4204 7.2199 numMergedOcc 0
9 mol 94 unq 0 iso 0 dist 7.89459 9.97569 5.60279 11.997 10.3578 5.18655 12.0145 7.39788 5.64735 7.38914 numMergedOcc 0
10 mol 94 unq 1 iso 0 dist 7.89459 9.97569 5.60279 11.997 10.3578 5.18655 16.0621 10.9341 6.93872 7.0529 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 7.5732 6.34525 11.128 5.31367 12.383 8.06525 10.6048 13.7307 8.36453 9.86739 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 7.5732 6.34525 11.128 5.31367 12.383 8.06525 10.3172 16.696 6.18257 9.49413 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.29945 7.35824 12.5754 11.1651 15.9448 7.01126 11.8821 14.52 5.95187 4.79852 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 9.29945 9.17364 10.0424 11.1651 15.9448 6.58434 11.8821 14.52 5.46129 4.79852 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 9.34734 8.03442 10.2525 6.43754 12.4085 7.1372 12.3856 14.7498 5.95112 7.95168 numMergedOcc 0
16 mol 227 unq 1 iso 0 dist 7.22101 8.38865 11.0628 13.3557 12.3856 7.89801 13.4493 14.6185 5.23507 6.152 numMergedOcc 0
17 mol 227 unq 2 iso 0 dist 7.22101 8.38865 11.0628 13.3557 12.3856 7.89801 8.17891 6.43754 5.92529 7.95168 numMergedOcc 0
18 mol 227 unq 3 iso 0 dist 7.22101 8.03442 10.5813 6.43754 8.17891 7.1372 12.3856 13.3557 5.95112 7.95168 numMergedOcc 0
19 mol 227 unq 4 iso 0 dist 8.65997 5.4694 11.0628 8.8709 12.3856 7.89801 9.62609 14.6185 5.23507 6.152 numMergedOcc 0
20 mol 227 unq 5 iso 0 dist 8.65997 5.4694 11.0628 8.8709 12.3856 7.89801 6.95902 6.43754 5.92529 7.95168 numMergedOcc 0
21 mol 227 unq 6 iso 0 dist 8.65997 8.03442 7.22396 6.43754 6.95902 7.1372 12.3856 8.8709 5.95112 7.95168 numMergedOcc 0
22 mol 227 unq 7 iso 0 dist 7.56888 8.03442 6.10296 6.43754 11.004 7.1372 12.3856 12.0094 5.95112 7.95168 numMergedOcc 0
23 mol 227 unq 8 iso 0 dist 7.55216 8.03442 9.69537 6.43754 12.8864 7.1372 12.3856 15.5877 5.95112 7.95168 numMergedOcc 0
24 mol 227 unq 9 iso 0 dist 7.09863 8.38865 12.9587 13.3557 16.1617 7.89801 13.4493 17.2469 5.23507 6.152 numMergedOcc 0
25 mol 227 unq 10 iso 0 dist 7.09863 8.38865 12.9587 13.3557 16.1617 7.89801 8.17891 9.13836 5.92529 7.95168 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 6.22714 5.64181 10.216 11.2717 12.1784 7.47235 9.38422 12.1252 5.8041 6.65088 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 6.22714 5.64181 10.216 5.17471 7.49471 6.44735 9.38422 12.1252 5.8041 6.17025 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 6.22714 5.64181 10.216 5.03393 10.9946 5.91208 9.38422 12.1252 5.8041 9.0378 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 7.31233 5.64181 7.83352 11.2717 7.02475 7.47235 9.38422 8.82861 5.8041 6.65088 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 7.31233 5.64181 7.83352 5.17471 7.19008 6.44735 9.38422 8.82861 5.8041 6.17025 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 7.31233 5.64181 7.83352 5.03393 11.3465 5.91208 9.38422 8.82861 5.8041 9.0378 numMergedOcc 0
32 mol 272 unq 0 iso 0 dist 8.48753 9.05222 6.59863 5.7074 10.597 7.35433 7.67853 6.64985 6.3139 6.75716 numMergedOcc 0
33 mol 294 unq 0 iso 0 dist 8.15665 9.13907 5.25615 6.17102 9.03492 8.32473 10.1651 6.46298 8.98519 7.72845 numMergedOcc 0
