%chk=000142227.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142227

0 1
 O   0.6049000      -1.772700       1.233400    
 O   -2.369700     -0.4510000      -1.044000    
 N  -0.7223000      0.4805000      0.3125000    
 N    1.228800      -2.219900     -0.9306000    
 C    1.647000      0.9454000     -0.3055000    
 C   0.4272000      6.3999998E-03 -0.4151000    
 C    2.185700       1.067600       1.123900    
 C    1.321800       2.336400     -0.8588000    
 C   0.7405000      -1.405100      6.8700001E-02
 C   -2.028500      0.2097000     -6.6399999E-02
 C   -3.035500      0.8028000      0.8820000    
 H    2.454000      0.5235000     -0.9194000    
 H   0.1352000     -5.7500001E-02  -1.472100    
 H    1.444200       1.488200       1.809700    
 H    3.060900       1.726900       1.144100    
 H    2.507300      9.8499998E-02   1.516700    
 H   0.5658000       2.848000     -0.2540000    
 H    2.218900       2.964800     -0.8720000    
 H   0.9491000       2.268800      -1.886300    
 H  -0.5688000      0.9733000       1.187100    
 H    1.485700      -3.182400     -0.7381000    
 H    1.354500      -1.898100      -1.884900    
 H   -4.026200      0.7940000      0.4193000    
 H   -3.060700      0.2114000       1.801300    
 H   -2.771400       1.837000       1.121100    


%chk=000142227-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000142227

0 1
O 0.612208 -1.923699 1.355291
O -2.049355 0.998431 -1.302637
N -0.754263 0.227814 0.472311
N 1.712017 -2.242881 -0.662417
C 1.536220 0.884615 -0.418142
C 0.375528 -0.177291 -0.368915
C 2.166630 1.122085 0.972683
C 1.035321 2.207772 -1.038746
C 0.893950 -1.523999 0.183615
C -1.926288 0.737179 -0.064685
C -3.055236 0.974572 0.933909
H 2.316961 0.461710 -1.087043
H -0.014652 -0.300788 -1.399280
H 1.412656 1.522914 1.675045
H 2.984351 1.861750 0.898919
H 2.580308 0.195382 1.409531
H 0.278290 2.679401 -0.387350
H 1.876079 2.916243 -1.156292
H 0.564286 2.046008 -2.024109
H -0.734530 -0.143444 1.428942
H 2.103557 -3.125183 -0.332702
H 1.904563 -1.938692 -1.615131
H -3.317114 2.047038 0.934897
H -3.950466 0.421481 0.601626
H -2.802621 0.668082 1.963279


