%chk=000028009.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028009

0 1
 O   0.4015000      -1.755200     -0.3950000    
 O    4.755800      4.3800000E-02 -8.2999999E-03
 C   -1.606400     -0.3183000     -6.6999998E-03
 C  -0.9795000      -1.712400      2.8000001E-02
 C  -0.8454000      0.7949000     -3.9200000E-02
 C   -3.120600     -0.2343000      3.0400001E-02
 C   -1.428500       2.187000     -9.4499998E-02
 C   -3.663000       1.154000      0.3670000    
 C   -2.921200       2.220500     -0.4203000    
 C   0.6180000      0.6292000      2.3000001E-03
 C   -1.028900      -2.293800       1.450500    
 C   -1.690400      -2.676400     -0.9371000    
 C    1.164200     -0.6439000     -0.1807000    
 C    1.500900       1.703300      0.2001000    
 C    2.549100     -0.8408000     -0.1966000    
 C    2.884900       1.507100      0.2011000    
 C    3.409400      0.2352000     -1.1000000E-03
 H   -3.509100     -0.5348000     -0.9507000    
 H   -3.523100     -0.9389000      0.7664000    
 H   -1.269100       2.673700      0.8764000    
 H  -0.9114000       2.788500     -0.8521000    
 H   -4.735000       1.196000      0.1437000    
 H   -3.552700       1.344700       1.442100    
 H   -3.327600       3.212100     -0.1914000    
 H   -3.069700       2.054900      -1.495000    
 H  -0.5228000      -3.265700       1.490600    
 H  -0.5033000      -1.644700       2.160800    
 H   -2.054500      -2.428800       1.808500    
 H   -1.678700      -2.281500      -1.960100    
 H   -1.171900      -3.642300     -0.9746000    
 H   -2.729800      -2.866800     -0.6509000    
 H    1.134600       2.714300      0.3594000    
 H    2.948900      -1.839500     -0.3566000    
 H    3.546200       2.355400      0.3564000    
 H    4.939900     -0.8988000     -0.1620000    


%chk=000028009-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028009

0 1
O 0.360366 -1.748495 -0.539668
O 4.833115 0.100268 -0.054063
C -1.660404 -0.329526 -0.059153
C -1.047495 -1.734892 0.016271
C -0.855673 0.781845 -0.005047
C -3.180102 -0.249290 -0.088589
C -1.426562 2.196391 -0.028595
C -3.711790 1.148336 0.298030
C -2.914371 2.243702 -0.438724
C 0.611144 0.621866 0.059136
C -0.961723 -2.208173 1.489106
C -1.762897 -2.768389 -0.871848
C 1.174984 -0.655345 -0.226936
C 1.515677 1.686207 0.320306
C 2.567896 -0.860773 -0.283863
C 2.911518 1.505210 0.288698
C 3.431854 0.227943 -0.024814
H -3.547922 -0.519881 -1.101530
H -3.609179 -1.010660 0.594878
H -1.303987 2.654187 0.976435
H -0.829318 2.821003 -0.721519
H -4.790404 1.220100 0.061959
H -3.606024 1.295011 1.391707
H -3.331936 3.245475 -0.223700
H -3.002782 2.082429 -1.531800
H -0.525312 -3.221492 1.541422
H -0.331875 -1.518078 2.077525
H -1.966835 -2.232935 1.948105
H -1.807287 -2.418505 -1.917169
H -1.200599 -3.717482 -0.847457
H -2.788453 -2.962495 -0.514288
H 1.121777 2.681567 0.549909
H 2.947081 -1.861171 -0.523212
H 3.603104 2.326901 0.492435
H 5.095216 -0.823158 -0.293148


