0 mol 8 unq 0 iso 0 dist 7.70793 14.1846 7.12263 15.7209 8.77457 7.35217 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.70793 6.1146 5.00267 15.7209 8.77457 11.1833 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 7.56303 5.97329 9.10587 11.5415 7.98679 15.0583 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 6.69917 9.89267 9.72965 7.11602 7.40415 12.67 numMergedOcc 0
4 mol 28 unq 1 iso 0 dist 6.69917 10.8377 5.63315 7.11602 7.40415 7.00226 numMergedOcc 0
5 mol 28 unq 2 iso 0 dist 6.69917 9.60903 9.8465 7.11602 7.40415 5.93722 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 8.64844 10.0435 8.63361 5.08831 6.15801 5.89577 numMergedOcc 0
7 mol 34 unq 1 iso 0 dist 8.64844 10.0435 8.63361 6.54316 9.63403 6.62645 numMergedOcc 0
8 mol 34 unq 2 iso 0 dist 8.64844 10.0435 8.63361 13.7964 8.07314 6.27366 numMergedOcc 0
9 mol 53 unq 0 iso 0 dist 7.61675 9.46892 4.75776 11.8798 7.75295 5.68983 numMergedOcc 0
10 mol 53 unq 1 iso 0 dist 9.64645 8.95538 4.75776 5.74596 7.75295 5.68983 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 9.26179 17.8038 8.58543 5.18957 7.62738 15.4757 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 7.56041 11.1848 7.63183 14.1479 6.62972 9.50457 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.89116 12.9632 8.03035 8.66162 8.8562 6.96805 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 9.89116 12.9632 8.03035 6.71925 7.91683 13.3975 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 9.89116 4.31572 7.6968 8.66162 8.8562 4.86811 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 9.89116 4.31572 7.6968 6.71925 7.91683 8.00229 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 6.78772 11.7112 8.26172 10.1812 4.46777 6.52248 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 6.78772 11.7112 8.26172 12.0778 6.94988 4.98952 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 7.52352 4.88215 5.73236 10.4027 6.95372 5.99865 numMergedOcc 0
20 mol 143 unq 1 iso 0 dist 7.23619 10.8542 5.73236 8.25297 6.95372 5.99865 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 7.77159 11.6972 9.71408 10.6473 6.51014 9.78297 numMergedOcc 0
22 mol 163 unq 0 iso 0 dist 7.64106 14.604 7.3546 10.013 9.79069 15.9955 numMergedOcc 0
23 mol 163 unq 1 iso 0 dist 7.64106 14.604 7.3546 16.2291 9.27496 5.87447 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 9.54732 5.9285 7.82546 5.86535 7.32555 6.29877 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 5.71854 10.5039 7.97588 8.14939 9.63007 16.5329 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 7.66625 9.06151 7.97588 9.94187 9.63007 16.5329 numMergedOcc 0
27 mol 286 unq 0 iso 0 dist 9.41529 5.12535 5.91064 5.45497 8.69826 7.09114 numMergedOcc 0
