%chk=000019335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019335

0 1
 O    2.940800      -1.338500      0.2860000    
 O    4.876700      0.5060000     -0.1418000    
 N    3.518000      0.8445000     -0.2079000    
 C   -1.210800     -0.2461000      6.0899999E-02
 C   -1.618200       1.080900      0.1982000    
 C   -2.158600      -1.248900     -0.1434000    
 C   0.2022000     -0.5841000      0.1309000    
 C   -2.973200       1.404900      0.1313000    
 C   -3.513600     -0.9249000     -0.2106000    
 C   -3.921000      0.4021000     -7.3299997E-02
 C    1.222300      0.2828000     -5.8200002E-02
 C    2.635600     -0.1788000      2.8100001E-02
 H  -0.9191000       1.892100      0.3790000    
 H   -1.860200      -2.288700     -0.2540000    
 H   0.4219000      -1.628100      0.3436000    
 H   -3.291500       2.437400      0.2429000    
 H   -4.251600      -1.705700     -0.3699000    
 H   -4.976100      0.6542000     -0.1245000    
 H    1.061400       1.327800     -0.2994000    
 H    3.296000       1.825300     -0.3376000    
 H    5.063800      0.3626000      -1.085000    


%chk=000019335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019335

0 1
O 3.044775 -1.257759 -0.242099
O 5.001155 0.484815 -0.232117
N 3.643722 0.937780 -0.165797
C -1.207042 -0.148254 -0.053256
C -1.731392 1.175714 0.027383
C -2.126524 -1.236675 -0.074887
C 0.229879 -0.445597 -0.114121
C -3.120545 1.397260 0.084278
C -3.518156 -1.015193 -0.018085
C -4.021649 0.303635 0.061951
C 1.267015 0.447236 -0.108999
C 2.658204 -0.030323 -0.175865
H -1.050992 2.034525 0.046189
H -1.737866 -2.260493 -0.136669
H 0.512630 -1.506903 -0.170636
H -3.507207 2.420569 0.146322
H -4.207770 -1.866058 -0.035953
H -5.101919 0.480097 0.106506
H 1.101266 1.531142 -0.056193
H 3.570448 1.951936 -0.122561
H 4.846768 -0.520656 -0.270092


