%chk=000016942.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016942

1 1
 O    1.411100       1.266600      5.5500001E-02
 N   -1.106000     -7.8299999E-02  1.3800000E-02
 C   0.1869000     -0.7661000      0.4281000    
 C    1.391700     -0.1251000     -0.2529000    
 C   -1.252900     -0.1433000      -1.499600    
 C   -2.286500     -0.7808000      0.6688000    
 C   -1.071600       1.377000      0.4580000    
 C    2.727300     -0.7501000      0.1283000    
 H   0.2574000     -0.6826000       1.519600    
 H   0.1034000      -1.826100      0.1607000    
 H    1.318300     -0.2136000      -1.340400    
 H   -1.118600      -1.180400      -1.820700    
 H   -2.261800      0.1975000      -1.754500    
 H  -0.5301000      0.5189000      -1.982300    
 H   -2.169900     -0.7104000       1.754300    
 H   -3.210500     -0.2887000      0.3506000    
 H   -2.286100      -1.827300      0.3495000    
 H  -0.6199000       1.453400       1.451400    
 H  -0.6028000       2.010100     -0.2990000    
 H   -2.110700       1.719300      0.5318000    
 H    2.906500     -0.6605000       1.205200    
 H    3.551100     -0.2312000     -0.3732000    
 H    2.759800      -1.809400     -0.1438000    
 H    1.666200       1.360600      0.9895000    


%chk=000016942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016942

1 1
O 1.447544 1.251788 -0.306372
N -1.144662 -0.038080 0.061034
C 0.211790 -0.672100 0.476742
C 1.447505 -0.220982 -0.322032
C -1.256060 0.099828 -1.455969
C -2.265610 -0.947030 0.567180
C -1.304800 1.346578 0.706206
C 2.717376 -0.814235 0.312254
H 0.341208 -0.433865 1.546342
H 0.097821 -1.763954 0.363256
H 1.367940 -0.576910 -1.370842
H -1.074395 -0.878497 -1.926994
H -2.272832 0.444723 -1.699496
H -0.516620 0.838845 -1.795144
H -2.127475 -1.122874 1.645112
H -3.233767 -0.452732 0.393993
H -2.232969 -1.904013 0.024056
H -1.358359 1.220866 1.798861
H -0.429593 1.951152 0.433172
H -2.238225 1.796885 0.334404
H 2.860226 -0.438143 1.340425
H 3.606349 -0.539620 -0.283493
H 2.679075 -1.918134 0.341628
H 2.330832 1.600005 -0.585624


