%chk=000043132.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043132

0 1
 O   0.3742000     -0.3964000       1.975300    
 N   -3.523600      0.1812000      0.1367000    
 C   -4.020100       1.538800     -8.6400002E-02
 C   -4.316200     -0.6643000     -0.7556000    
 C   -5.527400       1.343600     -0.1580000    
 C   -5.722000     -0.1053000     -0.5943000    
 C   -2.094300      6.4400002E-02 -0.1115000    
 C   -1.626700      -1.367700      0.1556000    
 C  -0.1253000      -1.543500     -8.8399999E-02
 C   0.7405000     -0.7094000      0.8451000    
 C    2.087500     -0.2778000      0.3742000    
 C    2.763600      -1.079200     -0.5183000    
 C    2.605400      0.9069000      0.8478000    
 C    4.574200      0.5202000     -0.4980000    
 C    4.023400     -0.6751000     -0.9602000    
 C    3.865200       1.311200      0.4060000    
 C    5.921300      0.9524000     -0.9700000    
 H   -3.655600       1.954800      -1.034600    
 H   -3.739900       2.219600      0.7235000    
 H   -4.300400      -1.721500     -0.4739000    
 H   -3.997200     -0.5700000      -1.801700    
 H   -5.989800       2.044100     -0.8607000    
 H   -5.987700       1.499900      0.8247000    
 H   -6.274100     -0.6535000      0.1784000    
 H   -6.291300     -0.1747000      -1.526800    
 H   -1.842100      0.3508000      -1.141000    
 H   -1.564000      0.7556000      0.5532000    
 H   -1.868200      -1.652000       1.187700    
 H   -2.137400      -2.078700     -0.5032000    
 H   8.9199997E-02  -1.276200      -1.129300    
 H   0.1430000      -2.595600      6.1000001E-02
 H    2.365100      -2.021500     -0.8798000    
 H    2.062100       1.534600       1.547500    
 H    4.568500      -1.302500      -1.660400    
 H    4.284000       2.244200      0.7738000    
 H    6.696300      0.5611000     -0.3034000    
 H    6.118200      0.5934000      -1.985900    
 H    5.999100       2.044700     -0.9959000    


%chk=000043132-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043132

0 1
O 0.281140 0.670441 1.480639
N -3.782708 0.139086 0.036477
C -4.496239 1.432405 -0.117837
C -4.568098 -0.833613 -0.767597
C -5.982214 1.034335 0.035512
C -6.052025 -0.417794 -0.546222
C -2.340494 0.194031 -0.266885
C -1.589621 -1.063580 0.220911
C -0.103008 -1.074273 -0.186935
C 0.767799 -0.057313 0.564092
C 2.222866 0.048493 0.202107
C 2.829150 -0.756024 -0.799701
C 3.029745 0.993554 0.893394
C 5.008945 0.323166 -0.407540
C 4.200524 -0.617345 -1.097556
C 4.396249 1.128720 0.591482
C 6.490289 0.451688 -0.709583
H -4.320898 1.888805 -1.128133
H -4.155932 2.155453 0.644599
H -4.366878 -1.870272 -0.444912
H -4.304956 -0.760342 -1.856311
H -6.654356 1.735992 -0.488936
H -6.259210 1.030057 1.103669
H -6.555329 -1.096861 0.162806
H -6.613393 -0.454057 -1.496533
H -2.163585 0.325109 -1.371110
H -1.913119 1.074564 0.244298
H -1.680221 -1.113244 1.320753
H -2.072234 -1.969018 -0.194841
H -0.003887 -0.891788 -1.277542
H 0.332222 -2.080125 -0.011936
H 2.235571 -1.491740 -1.352053
H 2.552415 1.610196 1.662516
H 4.652966 -1.244295 -1.875229
H 5.002478 1.865944 1.131840
H 7.092382 -0.122590 0.021424
H 6.735830 0.066302 -1.714216
H 6.825333 1.502534 -0.651709


