%chk=000113189.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113189

0 1
 O    3.430200     -0.2911000       1.264500    
 N    1.541800     -0.5612000     -0.7551000    
 N    2.427200      0.4686000     -0.7035000    
 N   -3.836200      0.3904000      0.5285000    
 C   0.1901000     -0.3219000     -0.4317000    
 C  -0.2874000      0.9863000     -0.3538000    
 C  -0.6695000      -1.393600     -0.1904000    
 C   -2.484000      0.1513000      0.2067000    
 C   -1.624500       1.223000     -3.4499999E-02
 C   -2.006600      -1.157000      0.1287000    
 C    3.318800      0.5051000      0.3406000    
 H   0.3470000       1.848100     -0.5414000    
 H  -0.3091000      -2.417500     -0.2482000    
 H   -1.985400       2.246800      2.1700000E-02
 H   -2.666600      -2.000600      0.3143000    
 H    1.904600      -1.505600     -0.7777000    
 H    2.406300       1.135300      -1.467200    
 H   -4.182700       1.338700      0.5864000    
 H   -4.459600     -0.3862000      0.7045000    
 H    3.978800       1.383900      0.2538000    


%chk=000113189-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113189

0 1
O 3.466620 -0.113234 1.293404
N 1.553001 -0.622264 -0.768011
N 2.488743 0.430419 -0.766000
N -3.913131 0.385315 0.503443
C 0.192806 -0.327901 -0.402354
C -0.290004 0.993208 -0.248106
C -0.714976 -1.408394 -0.258513
C -2.563757 0.152212 0.205275
C -1.648800 1.229565 0.048086
C -2.067749 -1.174827 0.049246
C 3.410603 0.602292 0.257193
H 0.397919 1.840141 -0.337588
H -0.361523 -2.438602 -0.389506
H -2.000256 2.261925 0.168389
H -2.748790 -2.027020 0.165103
H 1.947834 -1.465662 -0.335567
H 2.583953 0.951135 -1.641871
H -4.260199 1.329776 0.636621
H -4.557340 -0.387402 0.637680
H 4.118247 1.432119 0.029273


