%chk=000100496.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100496

0 1
 O   -2.252800      -1.243400      0.2119000    
 O   -4.216900      -1.991300     -0.7275000    
 C    2.968000     -0.6023000     -0.2826000    
 C    4.404500     -0.5715000      0.2470000    
 C    2.061200      -1.575300      0.4741000    
 C    5.292100      0.4547000     -0.4607000    
 C   0.6484000      -1.588100     -0.1154000    
 C    6.692500      0.4939000      0.1558000    
 C  -0.2685000      -2.538900      0.6597000    
 C    7.570100       1.544900     -0.5237000    
 C   -1.690100      -2.543500      0.1109000    
 C    8.951300       1.609900      0.1084000    
 C   -3.528500      -1.105100     -0.2457000    
 C   -3.997600      0.2945000     -8.5900001E-02
 C   -5.282600      0.6505000     -0.4955000    
 C   -3.153500       1.253500      0.4744000    
 C   -5.723500       1.965300     -0.3451000    
 C   -3.594500       2.568200      0.6248000    
 C   -4.879500       2.924000      0.2150000    
 H    2.986600     -0.8730000      -1.345700    
 H    2.541600      0.4068000     -0.2207000    
 H    4.380500     -0.3459000       1.320500    
 H    4.848000      -1.569500      0.1436000    
 H    2.019100      -1.287200       1.531500    
 H    2.487800      -2.584500      0.4297000    
 H    4.831400       1.447200     -0.3876000    
 H    5.361500      0.2073000      -1.526700    
 H   0.6895000      -1.894800      -1.167500    
 H   0.2393000     -0.5710000     -9.0999998E-02
 H    6.615600      0.7191000       1.226600    
 H    7.162200     -0.4931000      6.6100001E-02
 H   0.1368000      -3.556700      0.6266000    
 H  -0.2934000      -2.225300       1.710500    
 H    7.096000       2.530500     -0.4503000    
 H    7.671400       1.312000      -1.590100    
 H   -1.684000      -2.862200     -0.9382000    
 H   -2.297400      -3.248300      0.6908000    
 H    9.466200      0.6475000      2.5599999E-02
 H    8.885800       1.874900       1.168500    
 H    9.562600       2.366600     -0.3935000    
 H   -5.955700     -8.1400000E-02 -0.9340000    
 H   -2.145900       1.020300      0.8067000    
 H   -6.724000       2.242700     -0.6641000    
 H   -2.937800       3.315400       1.060800    
 H   -5.222800       3.947700      0.3322000    


%chk=000100496-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100496

0 1
O -2.308133 -1.197655 0.213851
O -4.203818 -1.986537 -0.887261
C 3.054078 -0.538999 -0.283601
C 4.468916 -0.482768 0.335188
C 2.088801 -1.471577 0.481995
C 5.438631 0.441668 -0.435056
C 0.673041 -1.522255 -0.133686
C 6.853371 0.498090 0.183990
C -0.276945 -2.473149 0.627663
C 7.824586 1.418816 -0.589758
C -1.685078 -2.544425 0.037498
C 9.235420 1.469497 0.035586
C -3.598880 -1.052725 -0.301317
C -4.149535 0.315211 -0.071034
C -5.451320 0.598329 -0.560274
C -3.416406 1.319900 0.612756
C -6.015525 1.875879 -0.368039
C -3.985555 2.596955 0.803191
C -5.283717 2.877540 0.314001
H 3.128763 -0.876139 -1.338729
H 2.626362 0.484945 -0.315216
H 4.395007 -0.139548 1.388525
H 4.893489 -1.508047 0.372552
H 2.017568 -1.137143 1.538342
H 2.516169 -2.496329 0.509390
H 5.014501 1.467082 -0.473525
H 5.513174 0.097661 -1.488118
H 0.743767 -1.846959 -1.193021
H 0.235079 -0.505078 -0.145931
H 6.781077 0.845972 1.235969
H 7.277772 -0.527135 0.225415
H 0.141407 -3.500833 0.618746
H -0.345195 -2.167533 1.690192
H 7.399785 2.442735 -0.631224
H 7.896558 1.070361 -1.640451
H -1.676741 -2.784660 -1.042102
H -2.322209 -3.286790 0.552143
H 9.694146 0.462830 0.059997
H 9.194294 1.843317 1.076239
H 9.909488 2.134124 -0.535695
H -5.996771 -0.193697 -1.084072
H -2.414926 1.088582 0.986068
H -7.020315 2.092442 -0.746457
H -3.420600 3.372688 1.331523
H -5.722582 3.870457 0.463943


