%chk=000080496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080496

0 1
 O   0.2271000       2.083200      0.9068000    
 C  -0.9548000     -0.4776000       1.265400    
 C   -2.117200      0.3267000      0.5779000    
 C   -2.473400      0.1602000     -0.9363000    
 C   0.4090000     -0.2755000      0.5746000    
 C  -0.8073000      8.5900001E-02   2.708800    
 C   -1.351600      -1.959000       1.438000    
 C   -3.593900       1.180900      -1.255200    
 C   -3.046900      -1.237400      -1.240800    
 C   -1.303400      0.4426000      -1.886300    
 C   0.9064000      0.9948000      0.4435000    
 C    1.060200      -1.394700      0.1220000    
 C    2.141400       1.158700     -0.1840000    
 C    2.295200      -1.230900     -0.5054000    
 C    2.835700      4.5800000E-02 -0.6585000    
 C    2.736300       2.517200     -0.3577000    
 C    3.037500      -2.420800      -1.012700    
 H   -3.033400      0.1084000       1.149000    
 H   -1.966300       1.399200      0.7492000    
 H  -0.7320000       1.174000       2.769600    
 H   7.0500001E-02 -0.3363000       3.213800    
 H   -1.684300     -0.1804000       3.312800    
 H  -0.6461000      -2.491500       2.088600    
 H   -2.335900      -2.043500       1.915200    
 H   -1.411000      -2.513000      0.5007000    
 H   -3.252500       2.208100      -1.083500    
 H   -4.475100       1.010900     -0.6260000    
 H   -3.915500       1.111900      -2.300800    
 H   -3.778200      -1.545900     -0.4861000    
 H   -3.553600      -1.250900      -2.213400    
 H   -2.261200      -1.994300      -1.299900    
 H   -1.657600      0.4882000      -2.924100    
 H  -0.8366000       1.409200      -1.676200    
 H  -0.5493000     -0.3454000      -1.870700    
 H   0.6853000      -2.405100      0.2200000    
 H    3.799400      0.1700000      -1.146600    
 H    2.902300       2.993500      0.6143000    
 H    3.707700       2.471900     -0.8626000    
 H    2.084700       3.148000     -0.9715000    
 H    3.762300      -2.142400      -1.785200    
 H    3.575300      -2.905900     -0.1921000    
 H    2.350900      -3.145200      -1.463900    
 H   0.7085000       2.904600      0.7242000    


%chk=000080496-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080496

0 1
O 0.292448 2.137477 0.800895
C -0.995207 -0.445081 1.280775
C -2.166360 0.343570 0.575622
C -2.557290 0.185362 -0.937548
C 0.374232 -0.291394 0.574788
C -0.869494 0.153466 2.723738
C -1.384933 -1.936731 1.481834
C -3.871501 1.003814 -1.116659
C -2.844575 -1.277890 -1.370026
C -1.486079 0.784097 -1.890055
C 0.995116 0.978845 0.381830
C 1.104500 -1.417667 0.122716
C 2.268799 1.119468 -0.230345
C 2.377933 -1.327081 -0.494982
C 2.945287 -0.045254 -0.662817
C 2.881411 2.497928 -0.421116
C 3.105655 -2.579150 -0.957218
H -3.074602 0.102793 1.170028
H -1.967145 1.420170 0.732767
H -0.603073 1.221214 2.691689
H -0.094443 -0.387120 3.298355
H -1.832427 0.046831 3.259264
H -0.645619 -2.455748 2.120713
H -2.361492 -1.983339 1.998177
H -1.481460 -2.499484 0.540346
H -3.730189 2.056993 -0.807028
H -4.693101 0.578517 -0.508769
H -4.193653 0.999874 -2.175504
H -3.538316 -1.781513 -0.670777
H -3.309849 -1.287762 -2.374907
H -1.917077 -1.874494 -1.432011
H -1.868161 0.798749 -2.929501
H -1.235859 1.821370 -1.599881
H -0.554691 0.193508 -1.878858
H 0.670465 -2.413798 0.253880
H 3.929625 0.057295 -1.136811
H 3.036047 3.029155 0.540941
H 3.870891 2.418246 -0.900502
H 2.262779 3.148637 -1.073591
H 4.078930 -2.333607 -1.416673
H 3.298414 -3.270018 -0.114496
H 2.514023 -3.139297 -1.706128
H 0.828641 2.947248 0.612745


