%chk=000050223.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050223

0 1
 O   -2.083800      -1.244300     -0.5672000    
 N  -0.5015000     -0.1378000      0.2789000    
 N  -0.9263000     -0.8474000     -0.7477000    
 C   0.9219000     -0.3061000      0.5794000    
 C  -0.8061000       1.289000      0.1177000    
 C    1.215300      -1.789400      0.8036000    
 C    1.766900      0.2247000     -0.5464000    
 C   -2.241900       1.595500      0.4905000    
 C    2.655400       1.215900     -0.4088000    
 H    1.155800      0.2125000       1.519100    
 H  -0.1916000       1.890500      0.8022000    
 H  -0.5964000       1.659600     -0.8957000    
 H    2.245000      -1.919200       1.158800    
 H   0.5569000      -2.212100       1.571900    
 H    1.116400      -2.396000     -0.1044000    
 H    1.671800     -0.2326000      -1.529200    
 H   -2.954700       1.163500     -0.2187000    
 H   -2.482800       1.225000       1.492900    
 H   -2.404100       2.678800      0.4918000    
 H    3.243600       1.548300      -1.257200    
 H    2.810400       1.710500      0.5436000    


%chk=000050223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050223

0 1
O -2.275199 -0.959128 -1.244982
N -0.471551 -0.100228 -0.216154
N -1.133700 -1.215027 -0.697565
C 0.853262 -0.311849 0.441171
C -1.042415 1.263145 -0.331403
C 1.109078 -1.799221 0.768155
C 1.961987 0.257296 -0.436467
C -1.958684 1.619511 0.860347
C 2.795818 1.259942 -0.066828
H 0.827288 0.260945 1.390783
H -0.198879 1.970311 -0.413668
H -1.625813 1.290293 -1.269245
H 2.057227 -1.875087 1.328133
H 0.292538 -2.217773 1.380165
H 1.187075 -2.407221 -0.147294
H 2.062537 -0.217014 -1.424174
H -2.817257 0.928761 0.907631
H -1.412875 1.571417 1.820207
H -2.346711 2.646982 0.739359
H 3.593967 1.616573 -0.726970
H 2.712507 1.746271 0.913899


