%chk=000018650.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018650

0 1
 O   -4.697700     -0.8404000     -0.3096000    
 O    5.099200     -0.7886000       1.759900    
 C   -1.791800     -0.7795000     -0.5020000    
 C  -0.3511000     -0.4915000     -0.9841000    
 C   -2.626200      0.4845000     -0.1758000    
 C   0.4137000      0.4857000     -6.1999999E-02
 C    1.891600      0.7723000     -0.5371000    
 C   -3.831800     -0.1401000      0.5946000    
 C   -1.809300       1.461700      0.7071000    
 C  -0.4169000       1.767100      0.1542000    
 C    2.644900     -0.5592000     -0.8823000    
 C   -1.907600      -1.648000      0.7657000    
 C   0.4348000      -1.794500      -1.175500    
 C   -3.186600      -1.208300       1.488900    
 C    1.819300      -1.525200      -1.740900    
 C    2.642100       1.529800      0.6114000    
 C   -3.067200       1.199500      -1.468000    
 C    1.918900       1.669000      -1.800000    
 C    3.186100      -1.238300      0.3839000    
 C   -4.691200      0.8343000       1.396100    
 C    4.111300       1.145400      0.7423000    
 C    4.215700     -0.3360000       1.033200    
 H   -2.294300      -1.333100      -1.309700    
 H  -0.4427000     -1.9200001E-02  -1.971400    
 H   0.4937000     -2.7999999E-03  0.9191000    
 H   -1.684300       1.060400       1.720100    
 H   -2.355400       2.406400      0.8226000    
 H  -0.5197000       2.325200     -0.7816000    
 H   9.1100000E-02   2.434700      0.8591000    
 H    3.525900     -0.3066000      -1.492000    
 H   -1.052800      -1.526800       1.438600    
 H   -1.957100      -2.709900      0.4996000    
 H  -0.1074000      -2.456500      -1.861600    
 H   0.5310000      -2.335500     -0.2274000    
 H   -3.843800      -2.068500       1.658800    
 H   -2.917900     -0.8011000       2.470900    
 H    2.355300      -2.474900      -1.859000    
 H    1.715200      -1.111700      -2.751800    
 H    2.163300       1.311300       1.575700    
 H    2.562300       2.615400      0.4769000    
 H   -3.714900       2.052900      -1.240300    
 H   -2.216200       1.575300      -2.043500    
 H   -3.624300      0.5300000      -2.132300    
 H    1.504700       2.663500      -1.605900    
 H    2.947000       1.823300      -2.147900    
 H    1.355200       1.231100      -2.628800    
 H    3.681200      -2.181200      0.1265000    
 H    2.395400      -1.444500       1.111400    
 H   -5.147300       1.581100      0.7373000    
 H   -5.518600      0.3087000       1.886900    
 H   -4.121700       1.356000       2.170700    
 H    4.564200       1.697400       1.572700    
 H    4.670500       1.372400     -0.1706000    
 H   -5.405400      -1.258800      0.2098000    


%chk=000018650-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018650

0 1
O -4.657376 -0.843171 -0.395761
O 5.108597 -0.842827 1.866234
C -1.790730 -0.793426 -0.491563
C -0.354367 -0.501037 -1.006782
C -2.638245 0.485152 -0.170797
C 0.424413 0.478100 -0.083061
C 1.896973 0.786434 -0.564183
C -3.838049 -0.133335 0.634363
C -1.808270 1.440960 0.741279
C -0.414492 1.760650 0.153359
C 2.663538 -0.552867 -0.895138
C -1.881766 -1.665548 0.804484
C 0.440013 -1.809485 -1.222121
C -3.167429 -1.196128 1.552674
C 1.843027 -1.518635 -1.788155
C 2.648662 1.540999 0.600215
C -3.113761 1.224270 -1.441726
C 1.924241 1.684149 -1.832793
C 3.189242 -1.238405 0.392049
C -4.743662 0.856902 1.383024
C 4.128861 1.123333 0.776834
C 4.234776 -0.368486 1.093029
H -2.326219 -1.337212 -1.294871
H -0.461785 -0.010475 -2.000263
H 0.525566 -0.026009 0.906206
H -1.669897 0.989783 1.744801
H -2.367659 2.385214 0.892327
H -0.540772 2.306473 -0.801270
H 0.118563 2.447126 0.839468
H 3.561850 -0.269465 -1.485445
H -0.991492 -1.524816 1.445843
H -1.925202 -2.738715 0.551124
H -0.116119 -2.475837 -1.911425
H 0.527578 -2.356422 -0.261795
H -3.866457 -2.030293 1.751810
H -2.917266 -0.752838 2.534458
H 2.411295 -2.461489 -1.917042
H 1.736868 -1.080140 -2.800891
H 2.126286 1.354225 1.559794
H 2.598109 2.632733 0.430609
H -3.709438 2.120624 -1.182921
H -2.261465 1.563409 -2.057451
H -3.746042 0.562541 -2.055325
H 1.418958 2.650683 -1.660261
H 2.970572 1.907325 -2.117944
H 1.440658 1.201155 -2.700801
H 3.639414 -2.225785 0.179102
H 2.364434 -1.425275 1.111130
H -5.232091 1.549799 0.675097
H -5.540023 0.315187 1.930287
H -4.182294 1.450689 2.125848
H 4.628191 1.695859 1.578401
H 4.696421 1.319320 -0.157097
H -5.372337 -1.341271 0.075933


