%chk=000153574.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153574

0 1
 O   -2.447100       2.122200      0.4111000    
 N   -1.359800       1.535100      0.1334000    
 N  -0.3087000       2.350600     -7.6099999E-02
 N    2.353800     -6.1999999E-02 -0.7979000    
 N    3.003700     -0.2545000      0.2351000    
 N    3.640500     -0.4464000       1.162800    
 C  -8.0000004E-03 -0.4263000     -0.2636000    
 C   -1.255100      0.1492000      5.0299998E-02
 C    1.077200      0.4164000     -0.4799000    
 C   9.2299998E-02  -1.824200     -0.3465000    
 C   -2.375500     -0.6618000      0.2762000    
 C   -1.027600      -2.627800     -0.1205000    
 C   -2.257400      -2.048200      0.1900000    
 C   0.8717000       1.777600     -0.3744000    
 H    1.032600      -2.313200     -0.5895000    
 H   -3.345000     -0.2358000      0.5194000    
 H  -0.9402000      -3.708600     -0.1877000    
 H   -3.124700      -2.678400      0.3645000    
 H    1.683600       2.481200     -0.5347000    


%chk=000153574-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153574

0 1
O -2.522292 2.136593 0.119278
N -1.366503 1.528724 0.062520
N -0.225995 2.292053 0.042715
N 2.373598 -0.448339 -0.132806
N 3.476436 0.177763 -0.127086
N 4.601369 0.554167 -0.147922
C -0.058549 -0.577185 -0.041804
C -1.323116 0.093341 0.022958
C 1.129755 0.234087 -0.064388
C -0.049093 -2.005300 -0.076483
C -2.543198 -0.630559 0.051417
C -1.252550 -2.717360 -0.046386
C -2.503246 -2.029775 0.016950
C 0.973911 1.629024 -0.019261
H 0.915606 -2.518486 -0.125260
H -3.478683 -0.068068 0.100491
H -1.238460 -3.811924 -0.070416
H -3.436866 -2.600920 0.039349
H 1.834175 2.307264 -0.031863


