%chk=000022600.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022600

0 1
 O  -0.8927000       1.010800       1.185100    
 N    1.393900      0.7955000     -0.3687000    
 N   0.1649000      0.2825000     -0.7491000    
 C    2.387100     -0.2683000     -0.3137000    
 C   -2.191400     -0.1907000     -0.4720000    
 C  -0.9215000      0.4402000      9.6400000E-02
 C    2.005100      -1.295000      0.7447000    
 C    3.772900      0.3073000     -4.9699999E-02
 C   -2.284000      -1.655800     -5.0200000E-02
 C   -3.434400      0.5735000     -2.2900000E-02
 H    2.431100     -0.7769000      -1.286400    
 H   -2.146800     -0.1426000      -1.567300    
 H    1.659900       1.479800      -1.076200    
 H   9.5299996E-02 -0.1856000      -1.647600    
 H    2.786700      -2.057500      0.8378000    
 H    1.880800     -0.8300000       1.729400    
 H    1.077600      -1.821800      0.4968000    
 H    4.058700       1.020300     -0.8310000    
 H    4.527300     -0.4868000     -3.4600001E-02
 H    3.813500      0.8276000      0.9139000    
 H   -2.312900      -1.753200       1.040800    
 H   -1.415000      -2.219400     -0.4064000    
 H   -3.183200      -2.126100     -0.4611000    
 H   -4.335500      0.1595000     -0.4872000    
 H   -3.562000      0.5295000       1.064400    
 H   -3.362200       1.629600     -0.3045000    


%chk=000022600-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022600

0 1
O -0.901608 0.497788 1.427090
N 1.404206 0.750890 -0.262068
N 0.128116 0.328753 -0.680324
C 2.491987 -0.258927 -0.369804
C -2.234586 -0.339499 -0.464050
C -0.951405 0.201717 0.203588
C 2.231846 -1.422794 0.605551
C 3.821201 0.460196 -0.066393
C -2.603615 -1.698762 0.183339
C -3.377129 0.690686 -0.285900
H 2.545094 -0.674740 -1.409670
H -2.057218 -0.495412 -1.549131
H 1.647958 1.676239 -0.638974
H -0.009435 0.018100 -1.653453
H 3.028521 -2.184299 0.519508
H 2.198058 -1.042998 1.641191
H 1.263709 -1.910706 0.393895
H 4.017671 1.277950 -0.786919
H 4.663587 -0.250505 -0.124790
H 3.793454 0.889948 0.950686
H -2.739406 -1.566607 1.271173
H -1.811679 -2.454347 0.026359
H -3.544754 -2.089275 -0.245166
H -4.320542 0.300833 -0.709876
H -3.528414 0.893072 0.788871
H -3.142415 1.649100 -0.784033


