%chk=000016768.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016768

0 1
 O   0.1311000      7.6000001E-03  -1.795400    
 O    2.783700      2.1700000E-02 -0.8804000    
 N   0.8430000      3.0000000E-03  0.4200000    
 N    2.920100      1.3500000E-02   1.413000    
 C   -1.561600     -8.6000003E-03 -8.5800000E-02
 C   -1.875800      -1.278900      0.7256000    
 C   -1.887000       1.251000      0.7375000    
 C  -0.1161000      7.9999998E-04 -0.5896000    
 C   -1.687700      -2.556600     -8.2599998E-02
 C   -1.775900       2.533300     -7.7600002E-02
 C    2.226100      1.3200000E-02  0.2153000    
 H   -2.207300     -9.1000004E-03 -0.9749000    
 H   -2.917900      -1.239500       1.066200    
 H   -1.254000      -1.333000       1.626700    
 H   -1.235100       1.328700       1.615100    
 H   -2.913900       1.177800       1.116600    
 H  -0.6421000      -2.699300     -0.3716000    
 H   -2.298600      -2.539800     -0.9907000    
 H   -1.989900      -3.424500      0.5123000    
 H  -0.7494000       2.705600     -0.4153000    
 H   -2.427500       2.497300     -0.9563000    
 H   -2.075800       3.392500      0.5309000    
 H   0.5293000     -4.8000002E-03   1.386000    
 H    2.441600      6.5000001E-03   2.307400    
 H    3.934400      2.0500001E-02   1.431600    


%chk=000016768-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016768

0 1
O 0.081503 0.006455 -1.872412
O 2.843896 0.035447 -0.894169
N 0.821888 0.008963 0.368049
N 2.915145 0.029892 1.430537
C -1.608838 -0.015564 -0.081527
C -1.904280 -1.307977 0.733860
C -1.931541 1.267468 0.739008
C -0.170494 0.001077 -0.644745
C -1.657378 -2.610667 -0.056099
C -1.710537 2.578608 -0.044729
C 2.242292 0.025365 0.205135
H -2.250778 -0.020729 -0.983044
H -2.962089 -1.264536 1.061749
H -1.300806 -1.316243 1.667575
H -1.330051 1.283278 1.673890
H -2.988786 1.201030 1.064589
H -0.600070 -2.703882 -0.363664
H -2.270390 -2.635402 -0.975377
H -1.915228 -3.497225 0.550803
H -0.655216 2.694615 -0.351361
H -2.323543 2.595547 -0.964193
H -1.986405 3.456910 0.566248
H 0.460801 0.002235 1.325472
H 2.462822 0.022686 2.342469
H 3.931785 0.041547 1.385937


