%chk=000031433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031433

0 1
 O    1.838500      -1.400400      0.9619000    
 O   0.9042000       2.143500      0.6892000    
 C    1.939400     -4.4599999E-02  0.5278000    
 C   0.7090000      0.7604000      0.9939000    
 C    2.139600     -1.8999999E-02 -0.9916000    
 C  -0.6116000      0.3100000      0.4074000    
 C    3.346500     -0.8419000      -1.425000    
 C   -1.051400      0.8729000     -0.7781000    
 C   -1.350900     -0.6549000       1.069300    
 C   -2.268600      0.4578000      -1.318500    
 C   -2.567900      -1.070100      0.5288000    
 C   -3.026700     -0.5138000     -0.6652000    
 H    2.837500      0.3800000      0.9940000    
 H   0.6318000      0.6948000       2.087000    
 H    2.258400       1.011600      -1.343600    
 H    1.272300     -0.4514000      -1.501800    
 H    4.260200     -0.4804000     -0.9424000    
 H    3.483500     -0.7655000      -2.508600    
 H    3.221200      -1.900900      -1.179100    
 H  -0.4760000       1.624500      -1.310000    
 H   -1.002000      -1.094700       1.999100    
 H    1.745000      -1.391100       1.929700    
 H    1.727600       2.426100       1.122600    
 H   -2.625100      0.8895000      -2.249200    
 H   -3.158200      -1.826800       1.037400    
 H   -3.974000     -0.8375000      -1.086400    


%chk=000031433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031433

0 1
O 1.897860 -1.368745 1.229775
O 0.971110 2.223887 0.573842
C 1.947357 -0.053262 0.562179
C 0.724249 0.831419 0.985551
C 2.035727 -0.322206 -0.942951
C -0.604910 0.399147 0.380879
C 3.391757 -0.926375 -1.360255
C -1.212653 1.150892 -0.654111
C -1.242813 -0.778404 0.846237
C -2.437694 0.727917 -1.218281
C -2.464284 -1.203397 0.277613
C -3.067213 -0.451130 -0.757439
H 2.867216 0.489509 0.896249
H 0.653105 0.778953 2.098172
H 1.855865 0.632341 -1.474323
H 1.212023 -1.006421 -1.216733
H 4.226513 -0.232295 -1.142113
H 3.410180 -1.141984 -2.443988
H 3.579410 -1.869040 -0.817503
H -0.726265 2.069245 -0.993661
H -0.778025 -1.372020 1.640761
H 1.983029 -1.242461 2.209589
H 1.845123 2.516952 0.936295
H -2.901399 1.320929 -2.015092
H -2.945336 -2.117891 0.642998
H -4.017631 -0.777463 -1.195091


