%chk=000164939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164939

0 1
 O   -2.261600      0.3191000       1.283300    
 O  -0.3203000     -0.6289000      0.3069000    
 O   -3.899500      -1.044900      -2.253300    
 O   -3.508500       1.774600      -1.865600    
 O   -1.892300      -2.621900     -0.8895000    
 O    2.716000      0.1724000       2.168100    
 O   -2.162100       2.945400       2.021700    
 O    3.083200      -1.462500     -0.1880000    
 O    3.363500       2.132800     -0.6306000    
 O   0.6183000      -3.088500      0.6974000    
 O    5.745400       1.347200      -1.774200    
 C   -2.879900     -0.4903000      -1.418800    
 C   -3.408500      0.8135000     -0.8174000    
 C   -2.538200      -1.490700     -0.3162000    
 C   -2.481500       1.328800      0.2919000    
 C   -1.652000     -0.8632000      0.7611000    
 C   0.6212000     -0.7548000       1.367200    
 C   -3.067900       2.540100       1.012000    
 C    1.799900      0.1807000       1.066400    
 C    2.614200     -0.1100000     -0.2063000    
 C    3.836400      0.7930000     -0.4292000    
 C    1.008100      -2.216000       1.467400    
 C    4.666200      0.4242000      -1.654400    
 H   -2.014400     -0.2976000      -2.064600    
 H   -4.419500      0.6403000     -0.4265000    
 H   -3.470300      -1.841100      0.1459000    
 H   -1.509800       1.625700     -0.1250000    
 H   -1.624900      -1.588800       1.584700    
 H   0.1831000     -0.4652000       2.331600    
 H   -4.020500       2.297000       1.494300    
 H   -3.220600       3.383900      0.3340000    
 H    1.410400       1.203300      0.9906000    
 H    1.939700     -2.2700001E-02  -1.066700    
 H   -3.515400      -1.805300      -2.721300    
 H   -4.013300       2.532500      -1.526500    
 H   -2.534000      -3.069500      -1.466000    
 H    4.488600      0.8073000      0.4508000    
 H    1.673200      -2.473700       2.309200    
 H    5.082900     -0.5848000      -1.584400    
 H    4.073600      0.4981000      -2.571700    
 H    3.086900     -0.7213000       2.252000    
 H   -2.027500       2.188800       2.617700    
 H    3.762600      -1.536200      0.5033000    
 H    2.789100       2.132800      -1.415400    
 H    6.292900       1.262300     -0.9750000    


%chk=000164939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000164939

0 1
O -2.407209 -0.227262 1.307017
O -0.216159 -0.566869 0.346781
O -2.986860 -0.322436 -2.849281
O -3.261659 2.205651 -1.477537
O -1.311809 -2.250583 -1.630009
O 2.618476 1.044145 2.098537
O -2.840359 1.885220 3.003574
O 3.525119 -1.307403 0.914160
O 2.664184 1.327150 -1.592413
O 0.446684 -2.632464 2.263297
O 4.872015 0.350426 -2.972591
C -2.342388 -0.001858 -1.569072
C -3.213162 0.937002 -0.723834
C -2.153654 -1.351071 -0.856538
C -2.580407 1.115388 0.673005
C -1.539789 -1.136458 0.538037
C 0.565010 -0.265595 1.543951
C -3.449600 1.886004 1.674713
C 1.820312 0.487156 1.000871
C 2.675374 -0.418245 0.082413
C 3.548077 0.389752 -0.896497
C 0.907224 -1.478307 2.411401
C 4.251707 -0.505348 -1.936433
H -1.355637 0.474197 -1.739777
H -4.231075 0.501064 -0.621448
H -3.159709 -1.799118 -0.700288
H -1.590334 1.601606 0.569725
H -1.498619 -2.063065 1.130450
H 0.022787 0.450322 2.204484
H -4.467794 1.438446 1.701648
H -3.523933 2.947772 1.384329
H 1.468933 1.353768 0.420627
H 2.005621 -1.089893 -0.479649
H -3.122717 0.528783 -3.337766
H -4.023552 2.754429 -1.165924
H -1.659594 -2.230577 -2.560184
H 4.312378 0.965179 -0.315877
H 1.582881 -1.236822 3.273327
H 4.988068 -1.183940 -1.464988
H 3.504414 -1.103409 -2.483465
H 3.024814 0.281961 2.590711
H -2.648857 0.935446 3.222784
H 4.345172 -0.806681 1.167988
H 3.121694 1.562975 -2.445329
H 5.726831 0.719462 -2.634029


