%chk=000077662.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077662

0 1
 O    1.400600      0.4493000     -0.8800000    
 O    1.872000     -0.5097000       1.185000    
 N    3.522000     -0.3018000     -0.4325000    
 C   -2.154700     -0.1772000     -0.2863000    
 C   -3.172100      -1.238900     -0.5339000    
 C  -0.8367000     -0.3634000     -0.7036000    
 C   -2.521100       1.002300      0.3620000    
 C   0.1148000      0.6302000     -0.4725000    
 C   -3.257400      -2.240900      0.6147000    
 C   -1.569700       1.995700      0.5930000    
 C  -0.2518000       1.809700      0.1757000    
 C    2.244200     -0.1609000      6.8599999E-02
 C    4.610000     -0.8944000      0.3099000    
 H   -4.157500     -0.7834000     -0.6931000    
 H   -2.939000      -1.771300      -1.464500    
 H  -0.5448000      -1.281200      -1.208400    
 H   -3.544300       1.158800      0.6935000    
 H   -2.298600      -2.747000      0.7706000    
 H   -4.012600      -3.002400      0.3963000    
 H   -3.533600      -1.746300       1.552000    
 H   -1.854800       2.914000       1.098100    
 H   0.4842000       2.587900      0.3583000    
 H    3.707600      2.9200001E-02  -1.374300    
 H    4.983900      -1.750000     -0.2577000    
 H    4.286100      -1.219700       1.301200    
 H    5.403600     -0.1493000      0.4049000    


%chk=000077662-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077662

0 1
O 1.529762 0.710256 0.008882
O 1.875608 -1.648342 -0.204841
N 3.628615 -0.097423 -0.010803
C -2.145427 -0.182948 -0.248777
C -3.061638 -1.387167 -0.424177
C -0.738053 -0.369805 -0.229281
C -2.679482 1.116180 -0.064064
C 0.103911 0.744861 -0.021100
C -3.310588 -2.136184 0.912785
C -1.821052 2.221001 0.142100
C -0.423307 2.043222 0.165175
C 2.308307 -0.476689 -0.082483
C 4.721058 -1.070390 -0.077357
H -4.032837 -1.060697 -0.842532
H -2.618575 -2.093269 -1.152228
H -0.306727 -1.362768 -0.370869
H -3.765990 1.262349 -0.084387
H -2.358858 -2.496137 1.343222
H -3.971234 -3.009060 0.757882
H -3.785782 -1.470080 1.655659
H -2.239014 3.224136 0.281247
H 0.261914 2.881944 0.319400
H 3.823949 0.898518 0.091360
H 5.377278 -0.877483 -0.946051
H 4.277302 -2.072555 -0.186334
H 5.331161 -1.052170 0.844573


