%chk=000031798.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031798

0 1
 O   -1.089200      7.4600004E-02 -5.3700000E-02
 O   -3.239300      -1.293800      -1.158400    
 O    2.063200       1.719100     -0.4582000    
 O  -0.4381000       2.249700      0.3538000    
 O    3.856200      -1.327900       1.129800    
 O    3.509100     -0.8391000      -1.063000    
 C   -3.300000     -0.8397000      0.1928000    
 C    1.173100      0.6122000     -0.4357000    
 C   -2.430900      0.4051000      0.3190000    
 C    1.729500     -0.4361000      0.5228000    
 C  -0.1905000       1.100900      1.1000000E-02
 C   -4.749500     -0.5447000      0.5478000    
 C    3.106200     -0.8800000      9.2000000E-02
 H   -2.900200      -1.640600      0.8243000    
 H    1.091900      0.2355000      -1.460700    
 H   -2.793200       1.188000     -0.3584000    
 H   -2.443800      0.7759000       1.350300    
 H    1.810000     -7.6000001E-03   1.529600    
 H    1.083800      -1.318800      0.5734000    
 H   -5.361700      -1.446300      0.4377000    
 H   -4.841200     -0.1866000       1.577700    
 H   -5.174300      0.2073000     -0.1262000    
 H   -3.784700      -2.096300      -1.222500    
 H    2.178500       2.034600      0.4545000    
 H    4.749400      -1.611900      0.8403000    


%chk=000031798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031798

0 1
O -0.995772 -0.033093 0.680331
O -2.994519 -0.298458 -1.346993
O 1.941411 1.476137 -0.921782
O -0.628336 2.084787 -0.251342
O 4.150450 -1.010740 1.189598
O 3.081754 -1.787389 -0.719455
C -3.263992 -0.709293 0.042847
C 1.138311 0.391622 -0.374574
C -2.441092 0.252301 0.901521
C 1.898327 -0.244574 0.806594
C -0.244413 0.923514 0.020669
C -4.763152 -0.619071 0.384211
C 3.063124 -1.080564 0.311144
H -2.895181 -1.743576 0.214259
H 0.977792 -0.386539 -1.150695
H -2.649391 1.300586 0.624971
H -2.623798 0.082937 1.975049
H 2.260832 0.536406 1.492861
H 1.216885 -0.915681 1.362592
H -5.348647 -1.306229 -0.253531
H -4.953724 -0.896909 1.437580
H -5.136871 0.406085 0.213897
H -3.397105 -0.952673 -1.971324
H 1.334078 2.248241 -1.090951
H 4.887327 -1.584326 0.842522


