%chk=000033804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033804

0 1
 O    1.756100     -0.3024000     -0.4533000    
 N   -7.220400     -0.4730000      0.3339000    
 N   -4.028200       2.609000     -0.1634000    
 C    2.503900     -0.1056000      0.7459000    
 C    3.954500      5.5500001E-02  0.3975000    
 C   0.4082000     -0.4408000     -0.3271000    
 C   -2.355200     -0.7241000     -7.0000000E-02
 C    4.776200      -1.064500      0.3357000    
 C    4.464000       1.323300      0.1393000    
 C  -0.3815000     -0.6359000      -1.460300    
 C  -0.1839000     -0.3873000      0.9348000    
 C   -1.763200     -0.7775000      -1.331800    
 C   -1.565700     -0.5290000       1.063300    
 C    6.124600     -0.9149000      1.1800000E-02
 C    5.812500       1.472800     -0.1847000    
 C    6.642700      0.3536000     -0.2486000    
 C   -3.795900     -0.8714000      6.5099999E-02
 C   -4.716600      0.1244000      6.2300000E-02
 C   -6.097400     -0.2064000      0.2125000    
 C   -4.334700       1.494000     -6.2899999E-02
 H    2.397100     -0.9682000       1.417000    
 H    2.172800      0.8013000       1.269500    
 H    4.383000      -2.057800      0.5340000    
 H    3.826300       2.201800      0.1835000    
 H   7.4199997E-02 -0.6783000      -2.445800    
 H   0.3658000     -0.2415000       1.858100    
 H   -2.365100     -0.9292000      -2.224700    
 H   -2.013200     -0.4863000       2.053600    
 H    6.771000      -1.786200     -3.8600001E-02
 H    6.215900       2.460400     -0.3881000    
 H    7.692500      0.4701000     -0.5012000    
 H   -4.124300      -1.904800      0.1707000    


%chk=000033804-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033804

0 1
O 1.811734 -0.260699 -0.437685
N -7.400235 -0.632998 -0.314051
N -4.558404 0.882346 2.761566
C 2.582740 0.287456 0.724827
C 4.049478 0.194001 0.388432
C 0.425356 -0.285517 -0.347607
C -2.427215 -0.431503 -0.375838
C 4.788514 -0.968453 0.722112
C 4.703456 1.263126 -0.273400
C -0.247994 -0.822159 -1.479774
C -0.326546 0.177559 0.769137
C -1.643701 -0.890611 -1.486551
C -1.728162 0.103536 0.749980
C 6.159551 -1.063273 0.396748
C 6.074410 1.171532 -0.600058
C 6.804851 0.007530 -0.264889
C -3.870216 -0.551210 -0.492744
C -4.893964 -0.203351 0.384737
C -6.263126 -0.437124 0.005046
C -4.700630 0.389149 1.679477
H 2.331447 -0.312200 1.621204
H 2.266865 1.336436 0.886356
H 4.288328 -1.800633 1.232171
H 4.137300 2.164659 -0.537097
H 0.348940 -1.172373 -2.326472
H 0.170164 0.593623 1.649769
H -2.154180 -1.306256 -2.363616
H -2.278961 0.466244 1.621026
H 6.722960 -1.965237 0.659231
H 6.571781 2.003067 -1.110978
H 7.869168 -0.063542 -0.515183
H -4.217709 -0.992024 -1.437878


