%chk=000016940.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016940

0 1
 O   -6.861500      8.3300002E-02 -0.4286000    
 O   -5.569000      -1.580200      0.4204000    
 C  -0.6736000      7.3600002E-02  0.2504000    
 C   0.5252000      0.9837000     -2.5900001E-02
 C   -1.988200      0.7533000     -0.1379000    
 C    1.842900      0.2899000      0.3324000    
 C   -3.184400     -0.1703000      0.1073000    
 C    3.069600       1.176500      9.7800002E-02
 C   -4.514900      0.4890000     -0.2409000    
 C    4.362200      0.4877000      0.4286000    
 C   -5.676200     -0.4545000     -4.9600001E-02
 C    5.394200      0.2480000     -0.3949000    
 C    6.685000     -0.4403000     -6.3100003E-02
 C    6.588700      -1.939700     -0.2960000    
 H  -0.6966000     -0.1932000       1.314000    
 H  -0.5628000     -0.8596000     -0.3152000    
 H   0.5389000       1.267100      -1.085200    
 H   0.4273000       1.908200      0.5559000    
 H   -1.958800       1.038700      -1.196400    
 H   -2.110900       1.675400      0.4431000    
 H    1.814600     -1.8300001E-02   1.385600    
 H    1.939700     -0.6281000     -0.2615000    
 H   -3.195700     -0.4804000       1.160100    
 H   -3.061500      -1.085900     -0.4854000    
 H    3.080000       1.511900     -0.9465000    
 H    2.991300       2.078000      0.7175000    
 H   -4.676800       1.365100      0.3962000    
 H   -4.506000      0.8071000      -1.289300    
 H    4.461500      0.1643000       1.463700    
 H    5.295900      0.5648000      -1.431900    
 H    7.489000     -1.3800000E-02 -0.6733000    
 H    6.950500     -0.2527000      0.9840000    
 H    5.816500      -2.392000      0.3356000    
 H    6.348800      -2.163400      -1.341000    
 H    7.543000      -2.420500     -5.8200002E-02
 H   -7.607600     -0.5377000     -0.2870000    


%chk=000016940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016940

0 1
O -7.004499 0.284243 -0.454868
O -5.889180 -1.417294 0.662559
C -0.733374 0.041372 0.287260
C 0.508716 0.894576 -0.054186
C -2.060547 0.685411 -0.172641
C 1.837664 0.239156 0.383247
C -3.296762 -0.172219 0.175394
C 3.079025 1.105831 0.040515
C -4.608461 0.478619 -0.302323
C 4.381365 0.483797 0.500455
C -5.840891 -0.336561 0.036182
C 5.428532 0.168093 -0.306259
C 6.725947 -0.471883 0.145593
C 6.997616 -1.825662 -0.560705
H -0.769810 -0.131656 1.383055
H -0.630548 -0.959563 -0.181330
H 0.536370 1.080877 -1.148445
H 0.414753 1.890647 0.427877
H -2.022102 0.854418 -1.269523
H -2.160583 1.688418 0.293468
H 1.813987 0.050876 1.476892
H 1.942894 -0.752116 -0.101839
H -3.345315 -0.337407 1.268766
H -3.197511 -1.176287 -0.280236
H 3.115551 1.283700 -1.052810
H 2.949353 2.100534 0.519353
H -4.738267 1.485155 0.143102
H -4.599283 0.640056 -1.398241
H 4.460016 0.269621 1.579575
H 5.345206 0.375444 -1.386484
H 7.572016 0.214226 -0.068741
H 6.707250 -0.618548 1.242851
H 6.201952 -2.556013 -0.327866
H 7.028223 -1.699097 -1.659276
H 7.965833 -2.253821 -0.241508
H -7.794835 -0.271946 -0.214060


