0 mol 8 unq 0 iso 0 dist 9.11545 10.9865 8.68949 12.1654 8.89145 13.2274 16.8517 10.8849 9.42634 18.4744 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.11545 10.9865 8.68949 13.8674 6.92865 8.33226 16.8517 10.8849 9.42634 11.7054 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 9.83301 5.6382 5.52834 7.92237 8.52254 4.38082 7.73997 10.1829 9.39402 10.8878 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.49678 5.37112 5.06188 5.50758 8.89758 4.6365 14.0783 9.57893 9.40291 13.4419 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 7.49678 5.37112 5.06188 5.50758 8.89758 4.6365 13.1628 7.88988 7.94814 11.4393 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 7.49678 5.37112 5.06188 5.50758 8.89758 4.6365 14.3835 8.00934 9.55632 12.9043 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 9.67476 4.85065 5.80736 13.4853 8.64208 11.8891 9.88566 8.43533 9.10001 14.1749 numMergedOcc 0
7 mol 67 unq 1 iso 0 dist 9.67476 4.85065 5.80736 6.50049 7.9572 6.3173 9.88566 8.43533 9.10001 12.4147 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.08674 4.77004 7.48127 9.08836 4.83274 10.6009 8.26805 11.6853 9.50939 10.985 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 7.88346 5.57673 5.40826 12.628 7.5984 9.02772 11.6503 5.80693 9.31435 12.2091 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 7.88346 5.57673 5.40826 12.628 7.5984 9.02772 5.24882 5.08025 6.38786 8.99891 numMergedOcc 0
11 mol 198 unq 0 iso 0 dist 8.35833 11.9993 9.87574 5.85344 7.24395 10.0277 12.7335 5.46544 7.95437 10.9115 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 7.7874 5.43552 4.36421 4.71355 7.77535 7.98893 14.9048 9.91172 9.96715 16.974 numMergedOcc 0
13 mol 256 unq 0 iso 0 dist 9.34785 6.09764 6.45473 5.59478 7.54586 4.99605 13.9175 6.51471 9.49634 9.59773 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 6.92271 4.00063 8.15119 6.29035 9.84188 10.2486 7.34927 5.11865 9.07744 9.54359 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 6.92271 4.00063 8.15119 4.83355 8.35794 7.94155 7.34927 5.11865 9.07744 5.69112 numMergedOcc 0
16 mol 277 unq 2 iso 0 dist 8.62666 9.31316 8.15119 15.7541 9.84188 10.2486 7.54315 5.11865 9.07744 9.54359 numMergedOcc 0
17 mol 277 unq 3 iso 0 dist 8.62666 9.31316 8.15119 11.2857 8.35794 7.94155 7.54315 5.11865 9.07744 5.69112 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 8.80931 3.90611 6.58925 11.2855 9.48968 9.49279 7.82358 14.7035 9.39268 18.3627 numMergedOcc 0
19 mol 281 unq 1 iso 0 dist 9.83857 5.78711 6.58925 7.12638 9.48968 9.49279 13.2642 14.7035 9.39268 18.3627 numMergedOcc 0
