%chk=000088670.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088670

0 1
 O    3.086200      0.8249000      0.5141000    
 N    1.037800     -0.1215000     -0.1928000    
 N    1.221800       1.477300       1.604000    
 C  -0.3475000     -0.1619000     -1.5799999E-02
 C    1.700400     -0.9715000      -1.227000    
 C   -1.185400      0.6945000     -0.7301000    
 C  -0.8906000      -1.075000      0.8882000    
 C   -2.566100      0.6381000     -0.5403000    
 C    2.095800      -2.322800     -0.6560000    
 C  -0.6315000       1.682700      -1.704700    
 C    1.859800      0.7418000      0.6190000    
 C   -2.271500      -1.131600       1.077900    
 C   -3.109100     -0.2750000      0.3637000    
 H    1.014500      -1.097300      -2.071800    
 H    2.591700     -0.4486000      -1.589900    
 H  -0.2500000      -1.745500       1.455300    
 H   -3.233600       1.298000      -1.088200    
 H    2.756700      -2.207800      0.2091000    
 H    1.217500      -2.890500     -0.3337000    
 H    2.620700      -2.914300      -1.412500    
 H   4.2700000E-02   2.384100      -1.202900    
 H  -9.1399997E-02   1.171900      -2.508200    
 H   -1.423100       2.276700      -2.174700    
 H   -2.694200      -1.841600       1.782600    
 H   -4.184100     -0.3189000      0.5118000    
 H   0.2193000       1.460700       1.752500    
 H    1.754300       2.086600       2.216300    


%chk=000088670-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088670

0 1
O 3.193791 0.646966 0.743619
N 1.097337 0.014027 -0.101894
N 1.270589 1.369874 1.839560
C -0.335435 -0.082364 0.050325
C 1.754514 -0.753257 -1.190655
C -1.203428 0.624034 -0.837037
C -0.873963 -0.900042 1.078646
C -2.603440 0.473320 -0.660905
C 1.980134 -2.235686 -0.828309
C -0.655333 1.517347 -1.933545
C 1.925353 0.669263 0.829587
C -2.269813 -1.027203 1.241674
C -3.138468 -0.339966 0.362415
H 1.126366 -0.670715 -2.096610
H 2.723358 -0.264606 -1.389255
H -0.182483 -1.434417 1.739584
H -3.280983 1.013144 -1.333738
H 2.660099 -2.317423 0.037196
H 1.027054 -2.738159 -0.581960
H 2.439841 -2.770937 -1.680009
H 0.305817 1.969687 -1.634877
H -0.469408 0.946626 -2.864487
H -1.367426 2.323348 -2.180833
H -2.674303 -1.661946 2.037593
H -4.224234 -0.433870 0.475212
H 0.257113 1.417795 1.915732
H 1.858449 1.858661 2.508868


