%chk=000000063.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000063

0 1
 O    2.026800       1.542000     -0.4155000    
 O    2.817800     -0.3524000      0.5459000    
 N   -2.378400     -7.6200001E-02  -1.266100    
 N   0.6033000      -1.754100      3.3700000E-02
 C  -0.5645000      0.3694000      0.3852000    
 C   -1.980300     -0.1891000      0.1369000    
 C   0.5617000     -0.3468000     -0.3757000    
 C   -3.003700      0.5637000      0.9877000    
 C    1.917400      0.2436000     -3.2099999E-02
 H  -0.5500000       1.435800      0.1202000    
 H  -0.3521000      0.3368000       1.463500    
 H   -2.014000      -1.246600      0.4210000    
 H   0.4226000     -0.2907000      -1.460000    
 H   -3.029400       1.631000      0.7399000    
 H   -4.011800      0.1584000      0.8446000    
 H   -2.761400      0.4724000       2.052100    
 H   -2.374200      0.9031000      -1.549400    
 H   -3.337800     -0.4008000      -1.381000    
 H   0.7729000      -1.824100       1.036300    
 H    1.378700      -2.227400     -0.4285000    
 H    2.900200       1.920700     -0.1790000    


%chk=000000063-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000000063

0 1
O 1.895159 1.525287 -0.758658
O 2.893855 -0.118179 0.540999
N -2.156547 0.161014 -1.320394
N 0.588873 -1.813051 0.263496
C -0.564124 0.378111 0.548212
C -1.969614 -0.112781 0.127385
C 0.537140 -0.421106 -0.204510
C -3.065586 0.507434 1.031306
C 1.888680 0.293306 -0.083338
H -0.461738 1.456545 0.317469
H -0.435027 0.250575 1.640699
H -1.972455 -1.212812 0.247080
H 0.224100 -0.406137 -1.267306
H -3.054815 1.613062 0.959490
H -4.069616 0.156071 0.728496
H -2.914967 0.235303 2.093492
H -2.241737 1.163207 -1.532680
H -2.918203 -0.376220 -1.748164
H 1.073004 -1.906529 1.164906
H 0.982350 -2.461603 -0.426299
H 2.785070 1.957203 -0.641982


