%chk=000023014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023014

0 1
 O   0.4803000     -0.3384000      0.8955000    
 O  -0.3370000       2.612200     -0.6128000    
 C    2.795500     -0.1052000      0.3311000    
 C    1.502400     -0.8600000      5.7599999E-02
 C    3.937100     -0.6052000     -0.5494000    
 C  -0.8039000     -0.4077000      0.4210000    
 C   -1.550600      0.7509000      0.2353000    
 C    5.215400      0.1802000     -0.3038000    
 C   -1.347200      -1.654300      0.1284000    
 C   -2.855800      0.6618000     -0.2488000    
 C  -0.9774000       2.094100      0.5461000    
 C   -2.652300      -1.743200     -0.3558000    
 C   -3.406500     -0.5852000     -0.5443000    
 H    3.060000     -0.2059000       1.391200    
 H    2.629600      0.9667000      0.1644000    
 H    1.232300     -0.7522000      -1.001000    
 H    1.634000      -1.925400      0.2787000    
 H    3.660000     -0.5152000      -1.606300    
 H    4.121900      -1.667400     -0.3517000    
 H    5.072200       1.242500     -0.5263000    
 H    5.538300      8.7499999E-02  0.7381000    
 H    6.019900     -0.1954000     -0.9436000    
 H  -0.7744000      -2.565000      0.2787000    
 H   -3.454100       1.556000     -0.4024000    
 H   -1.764100       2.792500      0.8533000    
 H  -0.2512000       2.046000       1.364500    
 H   -3.082000      -2.714200     -0.5840000    
 H   -4.422600     -0.6546000     -0.9213000    
 H   2.0800000E-02   3.484500     -0.3748000    


%chk=000023014-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023014

0 1
O 0.564465 0.276396 0.144892
O -1.273408 3.113994 -0.532404
C 2.962044 -0.001702 0.026705
C 1.617467 -0.701142 -0.184434
C 4.157641 -0.922272 -0.312104
C -0.775738 -0.115641 -0.006049
C -1.749795 0.883031 0.289878
C 5.516380 -0.218836 -0.105991
C -1.173043 -1.413606 -0.412601
C -3.115494 0.543859 0.172295
C -1.332834 2.276168 0.695299
C -2.547946 -1.719565 -0.529318
C -3.526750 -0.745923 -0.236922
H 3.032729 0.335125 1.078986
H 2.994099 0.906415 -0.605333
H 1.502155 -1.028756 -1.238927
H 1.522743 -1.589596 0.475342
H 4.074898 -1.263803 -1.364094
H 4.114566 -1.834329 0.317816
H 5.598913 0.677379 -0.748869
H 5.637960 0.108504 0.943556
H 6.359144 -0.890463 -0.351022
H -0.430588 -2.184101 -0.638846
H -3.864566 1.313265 0.394625
H -2.080769 2.702568 1.396486
H -0.342355 2.245026 1.187455
H -2.848422 -2.724482 -0.847286
H -4.591342 -0.985067 -0.326497
H -0.761551 3.937953 -0.325038


