%chk=000112012.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112012

0 1
 O   0.6424000     -0.6931000     -0.2550000    
 O   -1.094200       1.465000     -0.6241000    
 N    2.856700       2.184300      0.1637000    
 C   -2.097000      0.6456000     -2.1600001E-02
 C   -1.791900     -0.8466000     -0.2906000    
 C  -0.4750000      -1.380900      0.2966000    
 C   -3.442800       1.019700     -0.6532000    
 C   -2.121600      0.9756000       1.471400    
 C  -0.3015000      -2.861300     -2.0900000E-02
 C    1.864500      -1.158000      0.2998000    
 C    3.028700     -0.3962000     -0.3180000    
 C    2.931600       1.046000     -4.8099998E-02
 H   -1.749200     -0.9867000      -1.379700    
 H   -2.624000      -1.455200      8.6000003E-02
 H  -0.4882000      -1.250700       1.385100    
 H   -4.265200      0.4377000     -0.2246000    
 H   -3.423600      0.8500000      -1.735800    
 H   -3.662500       2.084300     -0.5125000    
 H   -2.420200       2.017600       1.636700    
 H   -2.819500      0.3304000       2.014600    
 H   -1.127200      0.8770000       1.919600    
 H   -1.243500      -3.402400      0.1230000    
 H   2.9100001E-02  -3.020700      -1.053200    
 H   0.4200000      -3.343600      0.6467000    
 H   -1.317700       2.395500     -0.4510000    
 H    1.854600      -1.021400       1.388200    
 H    2.041900      -2.212500      7.1699999E-02
 H    3.031300     -0.5493000      -1.403600    
 H    3.974700     -0.7847000      7.4500002E-02


%chk=000112012-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000112012

0 1
O 0.538988 -0.765541 -0.354223
O -1.157700 1.278354 -1.121130
N 2.338893 2.190289 1.337857
C -2.047060 0.625399 -0.131950
C -1.891120 -0.921126 -0.249016
C -0.578657 -1.523752 0.286088
C -3.468918 1.038397 -0.554371
C -1.721945 1.152264 1.286546
C -0.476004 -3.029957 -0.012779
C 1.873889 -1.117742 0.127146
C 2.816306 0.061192 -0.194156
C 2.551700 1.245689 0.641230
H -1.995923 -1.186145 -1.319441
H -2.720192 -1.414728 0.295902
H -0.500008 -1.352339 1.382815
H -4.222056 0.693618 0.177612
H -3.713362 0.620170 -1.546777
H -3.521363 2.138229 -0.627073
H -1.895366 2.241765 1.316798
H -2.358763 0.674955 2.056396
H -0.661968 0.984470 1.547870
H -1.339470 -3.560273 0.428869
H -0.483920 -3.206764 -1.103232
H 0.440407 -3.478798 0.410951
H -0.267739 0.839361 -1.021560
H 1.857057 -1.313793 1.219922
H 2.245162 -2.024537 -0.391662
H 2.703915 0.332250 -1.260346
H 3.865915 -0.255509 -0.042584


