%chk=000153353.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153353

0 1
 O   0.1382000       1.608300       1.221300    
 O    3.634800     -2.0700000E-02  -2.114700    
 O   -5.503700     -0.3220000      -1.557900    
 C  -0.3762000      0.4913000      0.4399000    
 C   0.4187000     -0.8005000      0.7121000    
 C   0.3885000       1.697200     -0.1649000    
 C    2.614200      0.4684000      8.3700001E-02
 C    1.744700     -0.7979000     -8.2800001E-02
 C   -1.941900      0.4505000      0.5539000    
 C    1.845000       1.653500     -0.5350000    
 C    3.891500      2.3700001E-02 -0.7038000    
 C    2.716800      -1.948500      0.1973000    
 C  -0.3564000      -2.073200      0.3292000    
 C    4.097600      -1.440600     -0.2571000    
 C   -2.531300     -0.9404000      0.3049000    
 C   -1.761300      -2.087400      0.8953000    
 C   -2.561400       1.446800     -0.4666000    
 C    2.982000      0.7713000       1.560700    
 C   -2.369200      0.8574000       1.989900    
 C    5.141000      0.8750000     -0.4950000    
 C   -4.073300       1.339600     -0.5997000    
 C   -3.657100      -1.179300     -0.3880000    
 C   -4.481200     -7.2499998E-02 -0.9225000    
 H   0.6264000     -0.8494000       1.788800    
 H  -0.1367000       2.458600     -0.7230000    
 H    1.467300     -0.8725000      -1.147300    
 H    1.873700       1.604400      -1.628600    
 H    2.321200       2.603200     -0.2638000    
 H    2.434700      -2.855500     -0.3476000    
 H    2.741900      -2.199300       1.264000    
 H   0.1790000      -2.956000      0.6990000    
 H  -0.4086000      -2.172400     -0.7638000    
 H    4.799700      -1.517000      0.5812000    
 H    4.482900      -2.064900      -1.071400    
 H   -1.739800      -2.008800       1.988200    
 H   -2.232400      -3.049700      0.6611000    
 H   -2.116600       1.269900      -1.456500    
 H   -2.315600       2.480200     -0.1926000    
 H    3.620800     -2.4999999E-03   1.998400    
 H    3.525600       1.720000       1.636100    
 H    2.115000      0.8518000       2.218100    
 H   -1.819800      0.2858000       2.747200    
 H   -2.171800       1.918700       2.180800    
 H   -3.438400      0.6926000       2.166300    
 H    5.954900      0.5286000      -1.142500    
 H    4.948400       1.918600     -0.7671000    
 H    5.500400      0.8480000      0.5378000    
 H   -4.407400       1.991800      -1.414300    
 H   -4.583700       1.651600      0.3168000    
 H   -4.027700      -2.186000     -0.5500000    
 H    3.698500      0.8840000      -2.464200    


%chk=000153353-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153353

0 1
O 0.119581 1.665737 1.324224
O 3.601758 -0.176659 -2.151670
O -5.557342 -0.137828 -1.721764
C -0.380800 0.475502 0.504200
C 0.422659 -0.830113 0.773165
C 0.352269 1.629389 -0.164704
C 2.627086 0.474475 0.086076
C 1.783423 -0.831478 0.031432
C -1.958831 0.440362 0.551902
C 1.807188 1.579784 -0.617928
C 3.918712 0.000619 -0.700185
C 2.789742 -1.946492 0.414759
C -0.332430 -2.116211 0.337523
C 4.149868 -1.452385 -0.177107
C -2.534072 -0.934221 0.184073
C -1.816655 -2.137229 0.750318
C -2.564596 1.534143 -0.378943
C 3.029788 0.893195 1.526708
C -2.375768 0.714181 2.041011
C 5.148024 0.915633 -0.586584
C -4.095480 1.432310 -0.533951
C -3.680107 -1.080193 -0.556549
C -4.516724 0.045401 -1.017950
H 0.589825 -0.878885 1.870204
H -0.246585 2.379920 -0.695631
H 1.552646 -0.967847 -1.047617
H 1.796078 1.391747 -1.711278
H 2.249016 2.584445 -0.454452
H 2.502990 -2.931401 0.007725
H 2.848619 -2.050034 1.515744
H 0.185990 -2.992854 0.767758
H -0.269740 -2.216964 -0.764509
H 4.954162 -1.470085 0.579360
H 4.478204 -2.071917 -1.028511
H -1.885806 -2.123899 1.858027
H -2.301256 -3.069987 0.410016
H -2.113751 1.435477 -1.386020
H -2.297681 2.534459 0.010917
H 3.667916 0.132455 2.012317
H 3.595839 1.842838 1.508193
H 2.136488 1.060897 2.147160
H -1.909650 -0.011800 2.729958
H -2.036214 1.719527 2.336854
H -3.470708 0.641882 2.161425
H 5.974978 0.501497 -1.191360
H 4.927713 1.937103 -0.957222
H 5.499493 1.007576 0.454419
H -4.478954 2.186932 -1.243178
H -4.602597 1.621544 0.433870
H -4.061182 -2.082489 -0.792055
H 3.668775 0.705745 -2.598874


