%chk=000029487.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029487

0 1
 O    6.735200     -0.8612000     -2.4700001E-02
 O   -7.542800      1.2600000E-02 -6.2600002E-02
 O   -1.287700       1.714400      0.2213000    
 N   -2.020700     -0.5001000     -4.6000000E-02
 C    2.769400      0.3585000      9.5100001E-02
 C   -3.431300     -0.3693000     -5.0400000E-02
 C    3.099200     -0.9696000      0.3651000    
 C    3.772400       1.276900     -0.2151000    
 C    1.379700      0.7850000      0.1358000    
 C    5.434900     -0.4611000      1.4900000E-02
 C    4.431800      -1.379500      0.3250000    
 C    5.105200      0.8671000     -0.2552000    
 C   -4.214900      -1.501600     -0.1920000    
 C   -3.993800      0.8880000      8.6900003E-02
 C   0.3087000     -3.5000000E-02  3.9799999E-02
 C   -1.081100      0.5143000      8.4100001E-02
 C   -5.603700      -1.372500     -0.1966000    
 C   -5.382700       1.017000      8.2400002E-02
 C   -6.187700     -0.1133000     -5.9400000E-02
 C    7.709800      0.1293000     -0.3484000    
 H    2.355700      -1.715200      0.6313000    
 H    3.533500       2.315800     -0.4299000    
 H    1.224300       1.856400      0.2425000    
 H    4.683600      -2.414400      0.5405000    
 H    5.833500       1.631600     -0.5032000    
 H   -1.683900      -1.454900     -0.1517000    
 H   -3.770100      -2.486900     -0.2995000    
 H   -3.441500       1.808700      0.2008000    
 H   0.4123000      -1.106000     -9.4899997E-02
 H   -6.219800      -2.260900     -0.3076000    
 H   -5.833200       2.000200      0.1899000    
 H    7.741100      0.9243000      0.4045000    
 H    7.564000      0.5216000      -1.360500    
 H    8.687900     -0.3627000     -0.3342000    
 H   -7.940800     -0.8685000     -0.1698000    


%chk=000029487-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029487

0 1
O 6.900960 -0.821914 -0.061974
O -7.733749 0.115848 -0.001058
O -1.307941 1.687576 -0.100281
N -2.105786 -0.526645 0.000461
C 2.792739 0.264932 -0.067221
C -3.514141 -0.331302 -0.001099
C 3.233269 -1.094656 -0.025004
C 3.790303 1.278163 -0.108515
C 1.382443 0.658614 -0.071445
C 5.572280 -0.385380 -0.066113
C 4.595537 -1.417842 -0.024327
C 5.166552 0.972045 -0.108472
C -4.340744 -1.484478 0.059933
C -4.122349 0.954994 -0.061361
C 0.281010 -0.153705 -0.032685
C -1.084194 0.434582 -0.047869
C -5.744866 -1.367746 0.061393
C -5.524737 1.068391 -0.059804
C -6.339508 -0.084700 0.001312
C 7.954393 0.198350 -0.103946
H 2.498987 -1.906908 0.006647
H 3.476898 2.328672 -0.141640
H 1.168138 1.737281 -0.111197
H 4.938204 -2.456551 0.007439
H 5.899916 1.783018 -0.141343
H -1.800291 -1.501710 0.042429
H -3.887142 -2.482916 0.107121
H -3.485750 1.840026 -0.108189
H 0.377236 -1.247611 0.009144
H -6.366382 -2.271145 0.109187
H -6.004076 2.050672 -0.105943
H 7.903959 0.862396 0.780206
H 7.890213 0.801995 -1.029555
H 8.898412 -0.365272 -0.092295
H -8.213289 -0.748072 0.044263


