%chk=000092814.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092814

0 1
 O  -0.1019000      0.2049000     -1.7500000E-02
 O    3.438800     -0.2363000     -0.3916000    
 O    1.207100      -1.693200     -6.8899997E-02
 C   -2.503200      0.3021000      0.2519000    
 C   -1.265000     -0.5937000      0.1567000    
 C   -2.694500       1.125900      -1.023400    
 C   -3.747500     -0.5372000      0.5333000    
 C    2.231500      0.4994000     -0.2681000    
 C    1.082100     -0.4764000     -0.1177000    
 C    2.352600       1.404600      0.9453000    
 H   -2.359500       1.008300       1.079600    
 H   -1.161100      -1.178100       1.079100    
 H   -1.362200      -1.286000     -0.6888000    
 H   -3.583800       1.760300     -0.9449000    
 H   -2.816800      0.4790000      -1.898700    
 H   -1.836400       1.781500      -1.203700    
 H   -4.632300      0.1003000      0.6337000    
 H   -3.634400      -1.099800       1.466000    
 H   -3.935800      -1.253200     -0.2740000    
 H    2.093300       1.074800      -1.188300    
 H    3.245100       2.034800      0.8682000    
 H    1.477200       2.052600       1.052800    
 H    2.453700      0.8190000       1.866200    
 H    3.597600     -0.7025000      0.4471000    


%chk=000092814-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092814

0 1
O -0.105723 0.270674 0.036199
O 3.496207 -0.123169 -0.491724
O 1.268643 -1.614112 0.032768
C -2.547849 0.308646 0.207436
C -1.313825 -0.601826 0.209335
C -2.706855 1.046649 -1.140935
C -3.798198 -0.541811 0.539340
C 2.281813 0.616768 -0.165765
C 1.113741 -0.367151 -0.030387
C 2.466022 1.441678 1.128923
H -2.409682 1.061850 1.009134
H -1.201101 -1.153923 1.160437
H -1.334761 -1.331695 -0.621917
H -3.571363 1.734341 -1.109339
H -2.878171 0.326197 -1.964148
H -1.805104 1.635975 -1.380682
H -4.700693 0.094545 0.563324
H -3.707872 -1.039559 1.522907
H -3.960580 -1.323955 -0.226948
H 2.068322 1.299309 -1.009333
H 3.359802 2.077023 1.014217
H 1.586921 2.082833 1.315890
H 2.623043 0.778188 1.997625
H 3.321863 -1.086375 -0.302056


