%chk=000108474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108474

0 1
 O   0.1068000      0.3594000      0.1549000    
 O   -5.329900     -0.1333000     -0.4451000    
 O   -1.537500       1.526100     -0.9730000    
 N   -3.407100      0.6498000      0.6375000    
 C   -2.087900      0.1664000      0.9322000    
 C   -2.212700      -1.338100      0.7836000    
 C   -3.352200      -1.525300     -0.2178000    
 C   -4.189100     -0.2830000     -3.5200000E-02
 C   -1.170600      0.7743000     -7.9999998E-02
 C    1.094400      0.8689000     -0.7468000    
 C    2.438200      0.3251000     -0.3595000    
 C    3.229400       1.024400      0.5450000    
 C    2.880500     -0.8732000     -0.9089000    
 C    4.478900      0.5192000      0.9048000    
 C    4.129800      -1.378500     -0.5492000    
 C    4.929000     -0.6823000      0.3577000    
 H   -1.801500      0.4875000       1.937500    
 H   -2.510600      -1.775800       1.744800    
 H   -1.296700      -1.841400      0.4597000    
 H   -3.934700      -2.425300     -6.6000000E-03
 H   -2.979900      -1.550800      -1.246700    
 H   -3.727600       1.587600      0.8582000    
 H    1.102800       1.965300     -0.7058000    
 H   0.8467000      0.5717000      -1.773600    
 H    2.887800       1.960200      0.9788000    
 H    2.265300      -1.424800      -1.614300    
 H    5.101000       1.060900       1.611300    
 H    4.480200      -2.314400     -0.9746000    
 H    5.901600      -1.076000      0.6380000    


%chk=000108474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108474

0 1
O 0.129399 0.338196 0.059970
O -5.556552 -0.045372 -0.206042
O -1.481700 1.579524 -1.088757
N -3.494738 0.650681 0.707454
C -2.122044 0.179285 0.876107
C -2.272074 -1.378308 0.735824
C -3.554711 -1.562927 -0.109106
C -4.358213 -0.265695 0.104755
C -1.168702 0.787939 -0.173065
C 1.186332 0.870343 -0.882972
C 2.517402 0.334706 -0.424102
C 3.237902 0.991515 0.605868
C 3.067276 -0.831685 -1.012764
C 4.481827 0.488391 1.044815
C 4.312997 -1.336665 -0.577667
C 5.022186 -0.677797 0.453228
H -1.710925 0.435864 1.869797
H -2.411913 -1.808966 1.741809
H -1.370582 -1.829175 0.294295
H -4.159330 -2.434631 0.186315
H -3.341181 -1.654770 -1.190207
H -3.759012 1.632224 0.800227
H 1.130566 1.972745 -0.848836
H 0.919758 0.538123 -1.901380
H 2.821066 1.896197 1.064811
H 2.519168 -1.344464 -1.812651
H 5.030619 1.003687 1.840696
H 4.730125 -2.237222 -1.041475
H 5.989452 -1.067140 0.789953


