%chk=000019251.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019251

0 1
 O   -2.268600      -1.636200      -1.140000    
 O   0.4936000      0.3077000       2.122200    
 O   -2.492200       2.859800     -0.2503000    
 N   -2.308800      0.6262000     -0.7627000    
 N  -0.9286000       1.597400      0.8664000    
 C  -0.4207000     -0.6788000      0.1045000    
 C   0.6845000     -0.4824000     -0.9487000    
 C  -0.2460000      -2.049800      0.7736000    
 C   -1.754300     -0.6386000     -0.6349000    
 C  -0.2464000      0.4226000       1.145500    
 C   0.5792000      -1.552000      -2.036600    
 C    2.041900     -0.5473000     -0.2906000    
 C   -1.375200      -2.327900       1.740100    
 C    2.992200      0.4061000     -0.2398000    
 C   -1.936600       1.774200     -7.3700003E-02
 C    4.292600      0.1431000      0.4742000    
 C    2.893200       1.775900     -0.8492000    
 H   0.5418000      0.4828000      -1.445200    
 H   0.6824000      -2.123500       1.349500    
 H  -0.2454000      -2.878000      5.9599999E-02
 H   0.7349000      -2.574500      -1.683400    
 H  -0.3548000      -1.504700      -2.601600    
 H    1.369900      -1.379700      -2.779700    
 H    2.301800      -1.505300      0.1571000    
 H   -1.455600      -1.562800       2.518300    
 H   -2.348200      -2.416500       1.249300    
 H   -1.194200      -3.281600       2.249200    
 H   -3.123500      0.7060000      -1.364900    
 H  -0.7256000       2.393200       1.464800    
 H    4.336200     -0.8598000      0.9117000    
 H    4.430500      0.8641000       1.286700    
 H    5.132500      0.2381000     -0.2218000    
 H    3.007800       2.539700     -7.2499998E-02
 H    1.944900       1.969700      -1.352600    
 H    3.689300       1.915700      -1.588100    


%chk=000019251-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019251

0 1
O -2.401542 -1.503118 -1.222559
O 0.456818 0.150951 2.221060
O -2.170474 3.041274 -0.288672
N -2.185676 0.760093 -0.811489
N -0.750907 1.584203 0.869049
C -0.457171 -0.787558 0.126517
C 0.740318 -0.607048 -0.970359
C -0.434462 -2.189862 0.788813
C -1.761513 -0.578567 -0.657750
C -0.222334 0.308432 1.177338
C 0.701491 -1.721716 -2.048044
C 2.105834 -0.569975 -0.313745
C -1.534090 -2.402255 1.852383
C 2.979732 0.476625 -0.261939
C -1.723660 1.882084 -0.099529
C 4.337307 0.310257 0.401022
C 2.721588 1.864856 -0.821641
H 0.544855 0.360709 -1.471317
H 0.555784 -2.330010 1.256182
H -0.552990 -2.944695 -0.006630
H 1.039791 -2.689125 -1.637388
H -0.305658 -1.863573 -2.475710
H 1.394793 -1.449613 -2.863446
H 2.425496 -1.521617 0.135465
H -1.427266 -1.692200 2.690926
H -2.543059 -2.296527 1.415142
H -1.461101 -3.422340 2.270171
H -2.975457 0.928726 -1.443028
H -0.483719 2.359089 1.484707
H 4.486822 -0.714519 0.781158
H 4.445760 1.010152 1.253021
H 5.157796 0.541030 -0.307077
H 2.803619 2.623016 -0.017914
H 1.730494 1.978877 -1.290081
H 3.487281 2.126844 -1.578236


