%chk=000097119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097119

0 1
 O   -1.730800      0.2067000     -0.9343000    
 O   -4.152000      -1.368700      0.1550000    
 O   -2.309200       2.932700     -0.7108000    
 N   0.1790000     -0.9821000     -0.1815000    
 N    2.285300      -1.728900     -0.1219000    
 N   0.5844000       1.402200      5.6699999E-02
 N   0.4870000      -3.307100     -0.3691000    
 N    2.968800       1.887700      0.2426000    
 N    4.637000      0.1725000      0.1915000    
 C   -1.276800     -0.9833000     -0.2666000    
 C   -1.982700      -1.026100       1.081000    
 C   -3.310300     -0.3834000      0.7499000    
 C   -2.938400      0.6668000     -0.2915000    
 C   -2.654600       2.029700      0.3249000    
 C   0.9758000      0.1223000     -3.4800000E-02
 C    1.017700      -2.069200     -0.2279000    
 C    2.273700     -0.3620000     -6.9999998E-04
 C    3.291300      0.5756000      0.1439000    
 C    1.654800       2.214700      0.1936000    
 H   -1.578300      -1.817800     -0.9075000    
 H   -1.447800     -0.4205000       1.822200    
 H   -2.064800      -2.048900       1.461400    
 H   -3.832500      1.7000001E-02   1.622700    
 H   -3.698900      0.7619000      -1.074800    
 H   -1.824500       1.990600       1.035700    
 H   -3.542100       2.413100      0.8382000    
 H   -3.776800      -1.629300     -0.7025000    
 H   -2.135000       3.793800     -0.2940000    
 H  -0.5081000      -3.498000     -0.4072000    
 H    1.084000      -4.127100     -0.4123000    
 H    1.433000       3.273400      0.2754000    
 H    4.880000     -0.8062000      0.1191000    
 H    5.358400      0.8726000      0.2984000    


%chk=000097119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097119

0 1
O -2.226402 -1.258254 -0.585766
O -4.483029 -0.617571 1.381801
O -2.037103 0.863648 -2.544132
N 0.027741 -0.766078 0.148675
N 1.992301 -0.832338 -1.082245
N 0.833412 0.709308 2.020409
N 0.069450 -2.054413 -1.912713
N 3.187096 1.356443 1.751374
N 4.497326 0.649358 -0.090734
C -1.302091 -1.270117 0.572911
C -1.991031 -0.411573 1.667043
C -3.284156 0.141883 0.998263
C -3.009176 0.011489 -0.517149
C -2.268077 1.202293 -1.134098
C 0.978892 0.011897 0.857050
C 0.707541 -1.245346 -1.006279
C 2.166909 -0.060414 0.081001
C 3.296600 0.649123 0.574938
C 1.984877 1.348182 2.396948
H -1.199258 -2.338372 0.833388
H -1.317820 0.385048 2.023583
H -2.266560 -1.025227 2.539933
H -3.514482 1.171651 1.312131
H -3.933168 -0.182675 -1.085835
H -1.315902 1.401193 -0.602667
H -2.921241 2.097405 -1.042787
H -4.362893 -1.556095 1.081593
H -1.433860 1.533802 -2.951560
H -0.952152 -1.992686 -1.966708
H 0.613038 -2.356355 -2.717884
H 1.935521 1.921702 3.327103
H 4.593047 0.124236 -0.956747
H 5.281250 1.163554 0.303961


