%chk=000014683.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014683

0 1
 O   -5.445200      0.7156000      4.8999999E-02
 N   0.8166000      0.8542000      6.0699999E-02
 N   -2.336200     -0.9191000     -6.0699999E-02
 N    1.253500      -1.497400     -0.1114000    
 N   -1.352800       1.660800      0.1242000    
 N  -0.5534000      -3.016000     -0.2177000    
 N   -3.576000       2.495500      0.1907000    
 N   -4.948500      -1.518400     -9.7700000E-02
 C   -1.013400     -0.6666000     -4.5600001E-02
 C  -0.5029000      0.6298000      4.7300000E-02
 C    1.628600     -0.2167000     -1.8900000E-02
 C  -7.9099998E-02  -1.681800     -0.1217000    
 C    3.043800      4.4500001E-02 -3.0000000E-03
 C   -3.162800      0.1350000      1.7999999E-02
 C   -2.676200       1.410100      0.1095000    
 C    3.545600       1.242300     -0.5227000    
 C    3.928600     -0.8971000      0.5323000    
 C    4.917200       1.495600     -0.5071000    
 C    5.300200     -0.6438000      0.5480000    
 C   -4.582300     -0.1788000     -1.4000000E-03
 C    5.794500      0.5525000      2.8200001E-02
 H    2.889500       1.993900     -0.9557000    
 H    3.574800      -1.835200      0.9537000    
 H    5.302800       2.426100     -0.9136000    
 H    5.983500      -1.377000      0.9666000    
 H   0.1428000      -3.748200     -0.2822000    
 H   -1.459900      -3.172800     -0.6409000    
 H    6.862400      0.7497000      4.0300000E-02
 H   -3.164500       3.418000      0.2672000    
 H   -4.467800       2.423900     -0.2827000    
 H   -4.260700      -2.263200     -0.1477000    
 H   -5.925200      -1.791800     -0.1217000    


%chk=000014683-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014683

0 1
O -5.591727 0.749675 -0.140149
N 0.829415 0.896639 -0.073017
N -2.392899 -0.950920 -0.026049
N 1.250153 -1.520351 0.041514
N -1.382904 1.728171 -0.136027
N -0.511000 -3.069422 0.092223
N -3.577099 2.530567 -0.197307
N -5.052127 -1.513304 -0.032877
C -1.049362 -0.694501 -0.022351
C -0.526535 0.657520 -0.077996
C 1.647580 -0.190509 -0.013637
C -0.079938 -1.773025 0.037374
C 3.111440 0.061063 -0.007941
C -3.242491 0.098319 -0.083255
C -2.723658 1.469691 -0.139493
C 3.601180 1.394744 -0.062690
C 4.032576 -1.019603 0.052028
C 4.988627 1.640584 -0.057413
C 5.420175 -0.768991 0.056993
C -4.714941 -0.184128 -0.087933
C 5.903164 0.560670 0.002285
H 2.872178 2.209241 -0.108171
H 3.637211 -2.038411 0.094021
H 5.360030 2.670495 -0.099571
H 6.125985 -1.605912 0.103241
H 0.176440 -3.818718 0.133749
H -1.510156 -3.262324 0.089563
H 6.982123 0.753777 0.006229
H -3.175786 3.466820 -0.235824
H -4.589163 2.334065 -0.199996
H -4.306447 -2.208329 0.007455
H -6.034541 -1.779993 -0.031677


