0 mol 95 unq 0 iso 0 dist 9.17862 15.821 7.27724 18.9084 12.0894 9.64673 15.8862 8.41707 8.03644 16.4832 numMergedOcc 0
1 mol 95 unq 1 iso 0 dist 8.27456 9.7565 7.27724 9.11115 12.0894 9.64673 15.5421 8.41707 8.03644 16.4832 numMergedOcc 0
2 mol 95 unq 2 iso 0 dist 8.13273 14.1434 8.03644 21.2506 16.4832 9.64673 15.9036 8.41707 7.27724 12.0894 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.22628 10.0419 9.33865 14.5366 10.9791 7.9258 11.2519 7.69052 5.83991 4.75197 numMergedOcc 0
4 mol 178 unq 0 iso 0 dist 5.41229 4.51874 6.69288 14.1123 14.4816 9.63185 8.57378 5.34677 6.43573 10.2893 numMergedOcc 0
5 mol 178 unq 1 iso 0 dist 5.41229 4.51874 6.69288 14.1123 14.4816 9.63185 10.1979 11.7381 7.17202 9.7684 numMergedOcc 0
6 mol 178 unq 2 iso 0 dist 5.41229 4.51874 6.69288 14.1123 14.4816 9.63185 13.0631 14.0703 8.81551 5.37264 numMergedOcc 0
7 mol 178 unq 3 iso 0 dist 8.57378 4.51874 6.43573 14.1123 10.2893 9.63185 5.41229 5.34677 6.69288 14.4816 numMergedOcc 0
8 mol 178 unq 4 iso 0 dist 8.57378 4.51874 6.43573 14.1123 10.2893 9.63185 10.1979 9.89739 7.17202 9.7684 numMergedOcc 0
9 mol 178 unq 5 iso 0 dist 8.57378 4.51874 6.43573 14.1123 10.2893 9.63185 13.0631 10.5529 8.81551 5.37264 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 17.207 11.993 8.52924 13.1824 7.38516 6.03031 7.17157 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 6.04106 12.9245 7.26832 17.207 11.993 8.52924 19.8591 13.8543 7.80463 9.67882 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 8.52933 10.568 9.06952 14.9118 10.6678 8.83023 13.4598 6.84129 7.03423 9.15968 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 7.17032 5.44278 6.56247 5.68265 4.93623 5.46736 10.3795 6.29886 8.34494 4.82695 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 7.17032 5.44278 6.56247 5.68265 4.93623 5.46736 12.069 7.82322 9.36357 11.7817 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.99137 13.3575 7.68742 14.5792 9.63949 6.61371 11.0371 7.28249 6.84306 5.03564 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 5.99137 5.03598 6.27581 7.61854 7.45579 5.90804 11.0371 7.28249 9.99038 13.6195 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 7.87577 5.90131 9.04358 11.1218 7.26417 6.60405 8.81588 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 6.85589 4.31412 8.43057 5.74302 5.09097 5.00128 10.2299 10.0727 8.02547 9.40373 numMergedOcc 0
19 mol 261 unq 1 iso 0 dist 6.85589 4.31412 8.43057 5.74302 5.09097 5.00128 6.68878 4.63549 6.05727 4.86901 numMergedOcc 0
20 mol 261 unq 2 iso 0 dist 6.85589 4.31412 8.43057 10.4193 11.9784 6.58604 10.2299 10.0727 8.02547 10.3517 numMergedOcc 0
21 mol 261 unq 3 iso 0 dist 6.85589 4.31412 8.43057 10.4193 11.9784 6.58604 6.68878 4.63549 6.05727 9.47323 numMergedOcc 0
22 mol 261 unq 4 iso 0 dist 6.85589 4.31412 8.43057 11.2165 11.6843 7.30472 10.2299 10.0727 8.02547 6.43209 numMergedOcc 0
23 mol 261 unq 5 iso 0 dist 6.85589 4.31412 8.43057 11.2165 11.6843 7.30472 6.68878 4.63549 6.05727 7.78464 numMergedOcc 0
24 mol 261 unq 6 iso 0 dist 6.68878 4.31412 6.05727 5.74302 4.86901 5.00128 10.2299 5.51688 8.02547 9.40373 numMergedOcc 0
25 mol 261 unq 7 iso 0 dist 6.68878 4.31412 6.05727 5.74302 4.86901 5.00128 6.85589 4.63549 8.43057 5.09097 numMergedOcc 0
26 mol 261 unq 8 iso 0 dist 6.68878 4.31412 6.05727 10.4193 9.47323 6.58604 10.2299 5.51688 8.02547 10.3517 numMergedOcc 0
27 mol 261 unq 9 iso 0 dist 6.68878 4.31412 6.05727 10.4193 9.47323 6.58604 6.85589 4.63549 8.43057 11.9784 numMergedOcc 0
28 mol 261 unq 10 iso 0 dist 6.68878 4.31412 6.05727 11.2165 7.78464 7.30472 10.2299 5.51688 8.02547 6.43209 numMergedOcc 0
29 mol 261 unq 11 iso 0 dist 6.68878 4.31412 6.05727 11.2165 7.78464 7.30472 6.85589 4.63549 8.43057 11.6843 numMergedOcc 0
30 mol 282 unq 0 iso 0 dist 7.34596 4.36798 8.76532 11.5041 11.2986 7.71088 10.5849 10.0156 8.04483 5.86383 numMergedOcc 0
31 mol 282 unq 1 iso 0 dist 7.34596 4.36798 8.76532 11.5041 11.2986 7.71088 7.12228 4.66602 6.33524 7.46064 numMergedOcc 0
32 mol 282 unq 2 iso 0 dist 7.12228 4.36798 6.33524 11.5041 7.46064 7.71088 10.5849 5.39891 8.04483 5.86383 numMergedOcc 0
33 mol 282 unq 3 iso 0 dist 7.12228 4.36798 6.33524 11.5041 7.46064 7.71088 7.34596 4.66602 8.76532 11.2986 numMergedOcc 0
