%chk=000107859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107859

0 1
 O  -0.5741000      0.5452000       1.392400    
 O    3.526200      -1.278000     -6.8700001E-02
 N   -1.783700      1.0900000E-02  -1.069800    
 N    1.790800      0.3154000     -0.1966000    
 C  -0.4783000     -0.5873000     -0.6446000    
 C   0.4747000      0.5815000     -0.6985000    
 C  -0.7296000     -0.7922000      0.8478000    
 C  -0.3947000       1.398500      0.2337000    
 C   -1.734800       1.394900     -0.5050000    
 C   -2.178900      -1.232900      0.9521000    
 C   -2.793500     -0.8100000     -0.3797000    
 C    2.461800       1.365200      0.5686000    
 C    2.414000     -0.9111000     -0.4318000    
 H  -0.2534000      -1.491700      -1.213200    
 H   0.5718000       1.024100      -1.697400    
 H  -2.8999999E-02  -1.461400       1.354100    
 H  -4.7400001E-02   2.392400      0.5230000    
 H   -2.577600       1.624500      0.1563000    
 H   -1.725300       2.110600      -1.333900    
 H   -2.687600     -0.7547000       1.795300    
 H   -2.248700      -2.320500       1.059700    
 H   -2.996100      -1.699900     -0.9884000    
 H   -3.751800     -0.2934000     -0.2557000    
 H    2.410900       2.305100      1.1700000E-02
 H    3.512100       1.106700      0.7305000    
 H    1.981000       1.471400       1.544500    
 H    1.810500      -1.577500      -1.062300    


%chk=000107859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107859

0 1
O -0.597031 0.681997 1.393255
O 3.792736 -0.995825 -0.441994
N -1.823305 -0.071010 -1.084943
N 1.833904 0.290085 -0.202342
C -0.510468 -0.646312 -0.593296
C 0.480772 0.541196 -0.733459
C -0.765443 -0.756903 0.942966
C -0.422590 1.459578 0.132450
C -1.747806 1.395610 -0.658469
C -2.238754 -1.201237 1.070253
C -2.862535 -0.848604 -0.331286
C 2.440772 1.196757 0.792560
C 2.600343 -0.721739 -0.759647
H -0.252287 -1.588195 -1.098180
H 0.519783 0.894770 -1.781839
H -0.051622 -1.364034 1.523010
H -0.056014 2.458517 0.403154
H -2.596796 1.671880 -0.008319
H -1.742417 2.057975 -1.544051
H -2.718303 -0.661110 1.903608
H -2.301881 -2.283994 1.283813
H -3.088462 -1.769832 -0.898275
H -3.792425 -0.260877 -0.262079
H 2.579772 2.212771 0.375436
H 3.429431 0.784076 1.049181
H 1.809603 1.251661 1.694968
H 2.050324 -1.291403 -1.542376


