%chk=000019840.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019840

0 1
 O  -0.1702000     -0.7029000     -0.6431000    
 N    3.283800      0.3780000      2.9400000E-02
 N    4.479500     -0.3957000      0.2476000    
 C    2.178200     -0.5213000     -0.1631000    
 C   0.8862000      0.2311000     -0.4244000    
 C   -1.424200     -0.3150000     -0.2839000    
 C   -1.777600       1.033600     -0.3307000    
 C   -2.356100      -1.266100      0.1317000    
 C   -3.062800       1.431100      3.8300000E-02
 C   -3.641300     -0.8685000      0.5004000    
 C   -3.994500      0.4801000      0.4538000    
 C    5.599100      0.5155000      0.4441000    
 H    2.033200      -1.161600      0.7175000    
 H    2.363500      -1.202600      -1.004900    
 H   0.9862000      0.8609000      -1.316800    
 H   0.6854000      0.8684000      0.4475000    
 H    3.404700      0.9536000     -0.8040000    
 H   -1.092500       1.802500     -0.6752000    
 H   -2.086600      -2.318000      0.1703000    
 H    4.363600     -0.9576000       1.091100    
 H   -3.340600       2.480300     -4.1999999E-03
 H   -4.367100      -1.609000      0.8237000    
 H   -4.995600      0.7893000      0.7395000    
 H    5.439900       1.172700       1.306100    
 H    5.775200       1.130100     -0.4455000    
 H    6.510100     -6.2799998E-02  0.6276000    


%chk=000019840-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019840

0 1
O -0.167419 -0.761716 0.076493
N 3.365095 0.386406 0.120030
N 4.648496 -0.396120 0.251891
C 2.226003 -0.574914 0.130860
C 0.921122 0.227189 0.095201
C -1.487229 -0.279925 0.054882
C -1.838118 1.093573 0.049974
C -2.495169 -1.276682 0.036033
C -3.205661 1.456347 0.026477
C -3.851443 -0.898048 0.012841
C -4.216902 0.471421 0.007720
C 5.791743 0.514700 -0.007046
H 2.265370 -1.149475 1.074229
H 2.257818 -1.306084 -0.704607
H 0.866355 0.862980 -0.814713
H 0.843679 0.876910 0.988649
H 3.422758 0.816301 -0.822139
H -1.071865 1.874402 0.066378
H -2.192912 -2.328597 0.040182
H 4.669471 -0.676939 1.249274
H -3.475807 2.518610 0.023426
H -4.626008 -1.673035 -0.001391
H -5.272374 0.762447 -0.010296
H 5.744082 1.470669 0.561981
H 5.835340 0.753386 -1.086296
H 6.723073 -0.017706 0.252766


