%chk=000021866.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021866

0 1
 O    2.879600      0.2125000      0.4556000    
 O   -2.889900     -0.5539000     -0.3359000    
 O   -2.512500       1.236300       1.052700    
 O    3.612700      -1.446400     -0.9624000    
 N   -1.175400      0.8294000     -0.8005000    
 N    4.751200     -0.9388000      0.9698000    
 C   0.9449000       1.598900      0.1872000    
 C  -0.2741000       1.940400     -0.6595000    
 C    1.779700      0.4710000     -0.4071000    
 C   -2.220800      0.5676000      6.6500001E-02
 C   -4.003000     -0.9421000      0.4771000    
 C   -4.626100      -2.193100     -0.1049000    
 C    3.733700     -0.7819000      6.1400000E-02
 H   0.6338000       1.318100       1.201500    
 H    1.572700       2.490800      0.3034000    
 H   3.2000002E-02   2.242800      -1.666600    
 H  -0.8126000       2.779400     -0.2055000    
 H    1.181000     -0.4419000     -0.5026000    
 H    2.151200      0.7621000      -1.396700    
 H   -1.036900      0.1953000      -1.581500    
 H   -3.657500      -1.141100       1.497700    
 H   -4.742300     -0.1337000      0.4937000    
 H   -5.481800      -2.518500      0.4931000    
 H   -4.959900      -2.015000      -1.132500    
 H   -3.893100      -3.005700     -0.1453000    
 H    5.477100      -1.634500      0.8353000    
 H    4.808300     -0.3638000       1.803600    


%chk=000021866-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021866

0 1
O 2.965940 0.235520 0.500273
O -2.967480 -0.583350 -0.376030
O -2.453957 1.208223 1.077379
O 3.818515 -1.364059 -1.010862
N -1.214717 0.779114 -0.872703
N 4.882947 -0.868783 1.025489
C 0.948725 1.539664 0.201397
C -0.270145 1.891695 -0.686262
C 1.835202 0.468300 -0.434230
C -2.220595 0.537258 0.037597
C -4.098854 -0.952969 0.519968
C -4.777936 -2.164543 -0.111640
C 3.895694 -0.733601 0.073175
H 0.591879 1.198428 1.189532
H 1.544211 2.458061 0.364523
H 0.064849 2.229777 -1.685204
H -0.820605 2.723325 -0.213327
H 1.294865 -0.484959 -0.581238
H 2.242109 0.791062 -1.411971
H -1.140035 0.153848 -1.675017
H -3.694968 -1.173669 1.524937
H -4.778986 -0.086111 0.606120
H -5.627951 -2.486945 0.517103
H -5.161912 -1.921369 -1.117268
H -4.072846 -3.008593 -0.202499
H 5.631605 -1.534864 0.859535
H 4.856446 -0.316261 1.878823


