%chk=000080297.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080297

0 1
 O   0.7711000      -1.959900     -0.2656000    
 O   -1.847600      -2.119100      0.4328000    
 C    2.155900      0.5960000      2.8999999E-02
 C   0.6620000      0.3998000      0.1686000    
 C    2.887500     -0.3234000      0.9938000    
 C    2.587400      0.3510000      -1.409000    
 C   5.9799999E-02 -0.7949000     -2.0800000E-02
 C  -2.0000001E-03   1.622200      0.5942000    
 C   -1.413600      -1.035600      4.4199999E-02
 C   -1.256500       2.010400      0.3445000    
 C   -2.355300     -3.6400001E-02 -0.5101000    
 C   -2.248700       1.290000     -0.4015000    
 H    2.444200       1.625500      0.2796000    
 H    2.889100      -1.373000      0.6866000    
 H    2.474900     -0.2595000       2.007100    
 H    3.940900     -2.4900001E-02   1.057900    
 H    2.035100      0.9949000      -2.102900    
 H    2.446900     -0.6865000      -1.728500    
 H    3.652600      0.5807000      -1.528000    
 H   0.6013000       2.306600       1.189600    
 H   -1.581200       2.975900      0.7266000    
 H   -3.226300     -0.4519000      -1.010700    
 H   -3.033800       1.904400     -0.8366000    
 H   0.1358000      -2.690300     -0.3600000    


%chk=000080297-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080297

0 1
O 0.777082 -1.833384 -0.468540
O -1.626844 -2.307654 -0.606925
C 2.229944 0.570129 0.035015
C 0.690544 0.525228 0.000030
C 2.821573 -0.297314 1.180026
C 2.862840 0.206756 -1.336209
C 0.036244 -0.695552 -0.254343
C 0.013584 1.765286 0.236080
C -1.418046 -1.041573 -0.350061
C -1.348205 2.095292 0.278346
C -2.509836 -0.122269 -0.185581
C -2.476538 1.245283 0.088280
H 2.504808 1.622193 0.250682
H 2.615237 -1.366103 1.009894
H 2.399515 -0.009635 2.160398
H 3.917415 -0.155918 1.223899
H 2.479231 0.860327 -2.140996
H 2.647155 -0.840323 -1.602589
H 3.959904 0.334976 -1.284262
H 0.693891 2.610117 0.416332
H -1.576062 3.148814 0.485063
H -3.491680 -0.599282 -0.298277
H -3.456153 1.735825 0.168868
H 0.033898 -2.549219 -0.624329


