%chk=000051609.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051609

0 1
 O   0.1109000      -2.972100      0.3967000    
 O   -3.939100      1.8800000E-02 -3.9400000E-02
 N    2.487000     -0.3035000     -0.4732000    
 C    1.709400      0.8706000     -1.2300000E-02
 C   0.1951000      0.6317000     -1.2800000E-02
 C   0.5883000      -1.854200     -0.3491000    
 C  -0.3317000     -0.6699000     -0.1596000    
 C    2.013400      -1.553600      0.1081000    
 C    2.089400       2.012700     -0.9823000    
 C    2.179000       1.257700       1.404900    
 C  -0.7016000       1.702100      0.1667000    
 C   -1.724900     -0.8574000     -0.1855000    
 C   -2.081800       1.497700      0.1609000    
 C   -2.593500      0.2194000     -2.2800000E-02
 H   0.5803000      -2.123600      -1.412900    
 H    2.086900      -1.544700       1.202600    
 H    2.668200      -2.371600     -0.2165000    
 H    3.474400     -0.1739000     -0.2545000    
 H    3.177200       2.148000      -1.033100    
 H    1.731400       1.807300      -1.998700    
 H    1.670000       2.976600     -0.6743000    
 H    1.901600      0.5059000       2.152300    
 H    3.267200       1.387400       1.446700    
 H    1.732100       2.205400       1.728400    
 H  -0.3349000       2.714000      0.3173000    
 H   -2.131500      -1.855800     -0.3331000    
 H   -2.750300       2.343400      0.2972000    
 H   0.7049000      -3.720500      0.2155000    
 H   -4.116000     -0.9278000     -0.1761000    


%chk=000051609-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051609

0 1
O -0.020542 -3.064165 0.173803
O -3.977431 0.036357 0.055005
N 2.483888 -0.328470 -0.388391
C 1.750355 0.908957 0.008607
C 0.234371 0.626348 -0.014240
C 0.624405 -1.871522 -0.412600
C -0.297339 -0.681276 -0.192505
C 2.005298 -1.585310 0.209917
C 2.127853 1.997372 -1.030821
C 2.173004 1.382371 1.439079
C -0.679093 1.696212 0.175537
C -1.696127 -0.893964 -0.171069
C -2.071250 1.497505 0.189123
C -2.577666 0.189564 0.018798
H 0.773710 -2.021328 -1.504347
H 1.897876 -1.569334 1.320221
H 2.717047 -2.392211 -0.049356
H 3.500795 -0.200307 -0.325900
H 3.226661 2.133426 -1.056118
H 1.791637 1.693372 -2.035982
H 1.676672 2.974116 -0.782946
H 2.000697 0.583206 2.182648
H 3.247731 1.648221 1.448023
H 1.598883 2.268994 1.762247
H -0.297814 2.713899 0.316733
H -2.066357 -1.920893 -0.272700
H -2.768773 2.327266 0.334974
H 0.506716 -3.862893 -0.081159
H -4.223808 -0.915413 -0.055483


