%chk=000085454.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085454

0 1
 O   0.7150000     -0.2886000      0.8715000    
 O   -3.324500       1.925700     -7.7200003E-02
 C   -2.656500      -1.624200     -6.4300001E-02
 C   -1.130100      -1.598400     -6.7800000E-02
 C   -3.235000     -0.3825000     -0.7255000    
 C  -0.5885000     -0.2818000      0.4125000    
 C    3.036300     -3.9900001E-02  0.3669000    
 C    1.616100     -1.8000000E-03 -0.1792000    
 C   -2.680800      0.8782000     -9.8899998E-02
 C   -1.295300      0.8544000      0.4328000    
 C    4.064700      0.2778000     -0.7149000    
 C    5.478500      0.2811000     -0.1560000    
 H   -3.015500      -2.524600     -0.5752000    
 H   -3.013100      -1.682200      0.9727000    
 H  -0.7579000      -1.790800      -1.081000    
 H  -0.7614000      -2.408400      0.5724000    
 H   -4.323700     -0.3828000     -0.6061000    
 H   -3.003000     -0.3640000      -1.796000    
 H    3.234300      -1.028000      0.8010000    
 H    3.124600      0.6744000       1.195200    
 H    1.412000      0.9934000     -0.5950000    
 H    1.515500     -0.7439000     -0.9816000    
 H  -0.8795000       1.784200      0.8042000    
 H    3.852200       1.259000      -1.155200    
 H    3.997100     -0.4614000      -1.521500    
 H    5.588000       1.034900      0.6303000    
 H    5.735600     -0.6957000      0.2660000    
 H    6.198700      0.5093000     -0.9479000    


%chk=000085454-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085454

0 1
O 0.767815 -0.832260 0.070697
O -3.082057 1.833208 -1.179786
C -2.866458 -1.430530 0.564204
C -1.412523 -1.821391 0.214989
C -3.462187 -0.492282 -0.508826
C -0.586571 -0.597271 -0.114050
C 3.131837 -0.282442 0.008386
C 1.725691 0.256503 -0.254076
C -2.581003 0.739317 -0.766691
C -1.134843 0.589876 -0.549932
C 4.218080 0.781372 -0.279458
C 5.643389 0.249026 -0.019005
H -3.485060 -2.341642 0.662011
H -2.879964 -0.918879 1.545823
H -1.399639 -2.506115 -0.657896
H -0.927998 -2.364303 1.046692
H -4.470883 -0.139274 -0.232263
H -3.566101 -1.036425 -1.471184
H 3.302225 -1.175020 -0.623559
H 3.201742 -0.614878 1.061751
H 1.500424 1.133013 0.386390
H 1.590486 0.547238 -1.315402
H -0.527161 1.472601 -0.772074
H 4.036965 1.675340 0.351378
H 4.136381 1.119269 -1.332533
H 5.761658 -0.069152 1.033666
H 5.864848 -0.624124 -0.660783
H 6.404705 1.022624 -0.226267


