%chk=000163545.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163545

0 1
 O    5.410600     -0.3106000      0.3657000    
 O    2.006100     -0.5963000     -0.1999000    
 C    4.242700      -1.112100      0.4697000    
 C    4.479400      1.5900001E-02   1.405500    
 C    3.298900     -0.9182000     -0.6978000    
 C  -0.2444000     -7.0000000E-02 -0.6047000    
 C    1.074000     -0.4020000      -1.251100    
 C  -0.5623000       1.272900     -0.3413000    
 C   -1.131000      -1.109600     -0.2779000    
 C   -1.799200       1.584300      0.2647000    
 C   -2.368000     -0.7981000      0.3280000    
 C   -2.685900      0.5447000      0.5914000    
 C   0.3237000       2.313000     -0.6678000    
 C  -0.8138000      -2.452500     -0.5409000    
 C   -2.116300       2.927300      0.5280000    
 C   -3.254200      -1.838200      0.6544000    
 C  -6.6000000E-03   3.641500     -0.3997000    
 C   -1.705100      -3.473500     -0.2103000    
 C   -1.225000       3.948300      0.1975000    
 C   -2.923700      -3.166700      0.3866000    
 H    4.319500      -2.126900      0.8298000    
 H    3.906200      0.9270000       1.293600    
 H    4.768100     -0.2143000       2.422800    
 H    3.254700      -1.846000      -1.279100    
 H    3.651000     -0.1108000      -1.351400    
 H    1.022700      -1.284300      -1.896400    
 H    1.417800      0.3749000      -1.940800    
 H   -3.640800      0.7851000       1.059100    
 H    1.302100       2.152100      -1.107200    
 H   0.1264000      -2.772900     -0.9763000    
 H   -3.063400       3.190200      0.9947000    
 H   -4.212400      -1.621400       1.122000    
 H   0.6901000       4.436100     -0.6509000    
 H   -1.445200      -4.508500     -0.4127000    
 H   -1.482200       4.982300      0.4081000    
 H   -3.617500      -3.961200      0.6456000    


%chk=000163545-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163545

0 1
O 5.810714 -0.945586 0.240692
O 2.077829 -0.537290 -0.072078
C 4.336460 -0.998437 0.579198
C 5.166465 0.143302 1.071559
C 3.413609 -0.841413 -0.608883
C -0.280883 -0.125877 -0.552535
C 1.067603 -0.450865 -1.154895
C -0.612978 1.238005 -0.274347
C -1.225845 -1.165463 -0.280156
C -1.945200 1.573474 0.219264
C -2.555672 -0.817285 0.217071
C -2.883500 0.539453 0.439680
C 0.326554 2.320007 -0.450450
C -0.930397 -2.568128 -0.458994
C -2.282357 2.951540 0.473953
C -3.515223 -1.861887 0.474377
C -0.030856 3.639324 -0.189566
C -1.878463 -3.550907 -0.191726
C -1.353021 3.964520 0.271024
C -3.191830 -3.197845 0.273140
H 4.064891 -1.792948 1.285329
H 5.085165 1.116044 0.570177
H 5.480751 0.169175 2.121459
H 3.387298 -1.781468 -1.204060
H 3.774776 -0.023993 -1.270917
H 1.045668 -1.409474 -1.710638
H 1.377092 0.333467 -1.877538
H -3.887669 0.794878 0.801566
H 1.350328 2.094796 -0.762418
H 0.068527 -2.872112 -0.784927
H -3.290520 3.184153 0.837330
H -4.509478 -1.577897 0.839575
H 0.702742 4.442049 -0.324384
H -1.622965 -4.607646 -0.327972
H -1.616520 5.009271 0.468341
H -3.926097 -3.985438 0.473750


