0 mol 48 unq 0 iso 0 dist 7.31914 5.43913 7.04689 5.39197 12.1333 8.65524 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 7.31914 5.43913 7.04689 9.53255 15.3402 8.96151 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 7.31914 5.43913 7.04689 7.75132 14.5108 9.02535 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 7.31914 8.26877 12.5922 5.39197 12.1333 8.22812 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 7.31914 8.26877 12.5922 9.53255 15.3402 4.22002 numMergedOcc 0
5 mol 48 unq 5 iso 0 dist 7.31914 8.26877 12.5922 7.75132 14.5108 5.77855 numMergedOcc 0
6 mol 48 unq 6 iso 0 dist 7.31914 8.26877 12.5922 14.2848 19.973 8.10774 numMergedOcc 0
7 mol 48 unq 7 iso 0 dist 7.31914 8.26877 12.5922 12.4977 16.4142 6.5241 numMergedOcc 0
8 mol 48 unq 8 iso 0 dist 7.44442 7.49794 12.2222 13.819 19.8995 8.14245 numMergedOcc 0
9 mol 48 unq 9 iso 0 dist 7.44442 7.49794 12.2222 11.8742 16.3 6.36817 numMergedOcc 0
10 mol 48 unq 10 iso 0 dist 7.44442 7.49794 12.2222 5.44298 12.3629 8.0812 numMergedOcc 0
11 mol 48 unq 11 iso 0 dist 7.44442 7.49794 12.2222 9.10301 15.3021 4.17933 numMergedOcc 0
12 mol 48 unq 12 iso 0 dist 7.44442 7.49794 12.2222 7.24268 14.2913 5.54893 numMergedOcc 0
13 mol 63 unq 0 iso 0 dist 9.16658 6.89855 8.45456 5.04771 4.92457 8.14512 numMergedOcc 0
14 mol 63 unq 1 iso 0 dist 9.16658 6.89855 8.45456 9.54378 15.1387 9.13228 numMergedOcc 0
15 mol 63 unq 2 iso 0 dist 8.94047 6.89855 3.4677 5.04771 8.18666 8.14512 numMergedOcc 0
16 mol 63 unq 3 iso 0 dist 8.94047 6.89855 3.4677 9.54378 12.2421 9.13228 numMergedOcc 0
17 mol 79 unq 0 iso 0 dist 6.07578 4.2253 7.86805 8.65653 13.6854 6.20144 numMergedOcc 0
18 mol 79 unq 1 iso 0 dist 9.56449 4.2253 9.97886 8.65653 15.5647 6.20144 numMergedOcc 0
19 mol 92 unq 0 iso 0 dist 7.36744 4.91714 5.36443 3.63696 10.8995 8.10623 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 6.93136 9.99012 5.42311 11.9534 5.66207 4.3855 numMergedOcc 0
21 mol 194 unq 0 iso 0 dist 8.63008 7.56217 7.82899 11.7008 12.7017 5.10542 numMergedOcc 0
22 mol 194 unq 1 iso 0 dist 8.63008 9.81055 10.0237 11.7008 12.7017 4.68722 numMergedOcc 0
23 mol 194 unq 2 iso 0 dist 8.63008 9.81055 10.0237 14.7138 12.8499 5.18325 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.42862 8.77524 9.89696 10.6524 16.8649 8.32259 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 9.42862 8.77524 9.89696 9.88337 17.469 9.93489 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 8.768 7.78392 14.4576 13.4414 20.2865 9.54529 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 8.54084 6.90472 4.05076 11.9315 11.0937 8.62655 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 5.68818 8.2236 9.00846 8.4652 11.4853 5.6964 numMergedOcc 0
