0 mol 4 unq 0 iso 0 dist 8.39239 5.30385 7.27909 6.97734 11.837 5.39676 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.39239 9.77024 5.61191 6.97734 11.837 12.9411 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 8.58982 8.37816 5.65356 4.07334 6.86666 5.48483 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 7.89705 9.18836 6.32189 8.45859 10.6149 15.3135 numMergedOcc 0
4 mol 41 unq 1 iso 0 dist 7.89705 6.07294 4.85777 8.45859 10.6149 6.00929 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 7.31914 6.42242 9.51443 5.43913 7.04689 10.8889 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 7.31914 6.42242 9.51443 8.26877 12.5922 13.697 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 7.44442 6.8073 9.59823 7.49794 12.2222 13.357 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 7.44442 5.60663 7.89394 7.49794 12.2222 6.34854 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 9.16658 5.55574 12.5323 6.89855 8.45456 7.1742 numMergedOcc 0
10 mol 63 unq 1 iso 0 dist 8.94047 5.55574 9.63391 6.89855 3.4677 7.1742 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 6.07578 7.99438 10.3996 6.65972 5.47798 10.2709 numMergedOcc 0
12 mol 79 unq 1 iso 0 dist 6.07578 7.99438 10.3996 4.2253 7.86805 6.1647 numMergedOcc 0
13 mol 79 unq 2 iso 0 dist 6.07578 6.64915 11.2341 6.65972 5.47798 9.87964 numMergedOcc 0
14 mol 79 unq 3 iso 0 dist 6.07578 6.64915 11.2341 4.2253 7.86805 4.31939 numMergedOcc 0
15 mol 79 unq 4 iso 0 dist 9.56449 7.99438 6.74663 6.65972 11.1553 10.2709 numMergedOcc 0
16 mol 79 unq 5 iso 0 dist 9.56449 7.99438 6.74663 4.2253 9.97886 6.1647 numMergedOcc 0
17 mol 79 unq 6 iso 0 dist 9.56449 6.64915 10.4197 6.65972 11.1553 9.87964 numMergedOcc 0
18 mol 79 unq 7 iso 0 dist 9.56449 6.64915 10.4197 4.2253 9.97886 4.31939 numMergedOcc 0
19 mol 92 unq 0 iso 0 dist 7.36744 5.74593 5.32989 4.91714 5.36443 3.98877 numMergedOcc 0
20 mol 92 unq 1 iso 0 dist 7.36744 8.02376 5.84351 4.91714 5.36443 8.90513 numMergedOcc 0
21 mol 92 unq 2 iso 0 dist 6.97288 7.31426 7.75408 6.34669 8.36026 3.77771 numMergedOcc 0
22 mol 92 unq 3 iso 0 dist 9.08316 6.15654 5.43086 6.61645 5.35821 3.87825 numMergedOcc 0
23 mol 92 unq 4 iso 0 dist 9.08316 7.89887 6.04936 6.61645 5.35821 8.8033 numMergedOcc 0
24 mol 124 unq 0 iso 0 dist 4.83761 9.18949 5.6462 8.50362 5.46636 9.91987 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 8.63008 8.09776 7.50057 7.56217 7.82899 12.7379 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 8.63008 8.09776 7.50057 9.81055 10.0237 15.4151 numMergedOcc 0
27 mol 194 unq 2 iso 0 dist 8.63008 5.4455 5.92931 7.56217 7.82899 3.7326 numMergedOcc 0
28 mol 194 unq 3 iso 0 dist 8.63008 5.4455 5.92931 9.81055 10.0237 7.29209 numMergedOcc 0
29 mol 204 unq 0 iso 0 dist 9.42862 9.23676 7.34336 8.77524 9.89696 3.85186 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 8.29649 8.89981 14.012 5.19729 5.22417 8.82573 numMergedOcc 0
31 mol 253 unq 0 iso 0 dist 9.92698 8.64294 6.41774 9.80396 3.15936 5.35601 numMergedOcc 0
32 mol 253 unq 1 iso 0 dist 9.92698 8.64294 6.41774 6.3093 5.26612 6.06804 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 7.5355 9.29922 8.43508 9.98182 11.5492 18.0446 numMergedOcc 0
34 mol 284 unq 0 iso 0 dist 5.68818 4.87349 9.97867 8.2236 9.00846 9.94624 numMergedOcc 0
