%chk=000012773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012773

0 1
 O   -2.773200     -0.2898000     -0.5103000    
 O   -1.501100       1.873700      0.5579000    
 N    2.934600      0.7717000     -0.4206000    
 C    1.670400      0.3349000     -0.1028000    
 C   0.6273000       1.183000     -0.1386000    
 C    1.582400      -1.040600      0.3500000    
 C   -1.434500     -0.3698000     -0.1569000    
 C  -0.8065000      0.9394000      0.1585000    
 C  -0.8155000      -1.556200     -9.6400000E-02
 C   0.5161000      -1.846300      0.3591000    
 H   0.8236000       2.223200     -0.4009000    
 H    2.513200      -1.465000      0.7267000    
 H   -1.389000      -2.449200     -0.3418000    
 H   0.6541000      -2.861700      0.7269000    
 H    3.079900       1.729900     -0.7142000    
 H    3.722300      0.1376000     -0.3683000    
 H   -3.099200      -1.188300     -0.6905000    


%chk=000012773-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000012773

0 1
O -2.841063 -0.274833 -0.189656
O -1.596095 2.014848 -0.408075
N 2.986877 0.857662 -0.078762
C 1.703614 0.308493 -0.068968
C 0.613936 1.181046 -0.218091
C 1.659873 -1.132942 0.096225
C -1.454427 -0.365025 -0.123315
C -0.828092 0.999669 -0.257780
C -0.850795 -1.606843 0.049245
C 0.540342 -1.942923 0.145204
H 0.862198 2.247017 -0.333409
H 2.633581 -1.633296 0.193552
H -1.531836 -2.470432 0.124426
H 0.735915 -3.015433 0.278611
H 3.120800 1.859116 -0.191319
H 3.810280 0.270926 0.022014
H -3.260207 -1.170551 -0.102103


