%chk=000086758.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086758

0 1
 O   0.5121000      -2.233300      0.5727000    
 O    2.958900       1.346200      0.4023000    
 O    2.878000     -0.7609000     -0.4635000    
 C   -1.409300      0.7013000      0.3906000    
 C   -1.176500     -0.6732000     -0.2967000    
 C   1.6000001E-02   1.206000      7.0000002E-03
 C  -0.7534000     -0.3004000      -1.736000    
 C   2.7799999E-02   1.016400      -1.534300    
 C   0.9575000      0.1584000      0.6652000    
 C   0.1470000      -1.087100      0.3610000    
 C   -2.553800       1.543600     -0.2085000    
 C   -1.679100      0.6218000       1.907700    
 C   -2.274900      -1.704500     -0.2001000    
 C    2.349700      0.1658000      0.1328000    
 H   0.2371000       2.232900      0.3101000    
 H   -1.613500     -0.1451000      -2.396000    
 H  -0.1153000      -1.066000      -2.192700    
 H    1.034500      0.9589000      -1.958300    
 H  -0.4780000       1.847000      -2.038200    
 H    1.005100      0.2807000       1.752100    
 H   -2.532400       1.628100      -1.297000    
 H   -3.528100       1.111700      4.7400001E-02
 H   -2.525500       2.562800      0.1937000    
 H   -2.707900      0.2970000       2.103000    
 H   -1.035000     -8.2800001E-02   2.440500    
 H   -1.547000       1.606100       2.370800    
 H   -1.993200      -2.625300     -0.7229000    
 H   -2.477800      -1.975200      0.8412000    
 H   -3.205600      -1.338900     -0.6449000    
 H    3.877600       1.370900      5.9200000E-02


%chk=000086758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086758

0 1
O 0.596960 -2.198369 0.625327
O 3.266996 0.760477 0.996922
O 2.753410 -0.135073 -1.080258
C -1.434134 0.737585 0.375301
C -1.183468 -0.684382 -0.274837
C -0.034408 1.312614 -0.083684
C -0.784117 -0.299624 -1.757427
C -0.053466 1.080421 -1.622536
C 0.952224 0.282083 0.572056
C 0.174597 -1.056160 0.347074
C -2.633215 1.503464 -0.230426
C -1.644566 0.686208 1.910457
C -2.252136 -1.765752 -0.151127
C 2.366427 0.259833 0.042852
H 0.165395 2.351486 0.226426
H -1.702526 -0.231718 -2.368106
H -0.139410 -1.070528 -2.213562
H 0.958315 1.050253 -2.055170
H -0.608848 1.888378 -2.128219
H 1.014642 0.469221 1.658246
H -2.600349 1.576805 -1.329104
H -3.582625 1.007579 0.043988
H -2.669070 2.532424 0.175148
H -2.656269 0.305270 2.141242
H -0.929092 0.032202 2.438694
H -1.564748 1.699503 2.346916
H -1.891845 -2.714502 -0.587024
H -2.502300 -1.968963 0.905827
H -3.177252 -1.471810 -0.679525
H 4.189878 0.723973 0.622729


