%chk=000062382.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062382

0 1
 O   0.5780000       3.066400      1.7500000E-02
 O    2.182700      -2.115500      -1.194500    
 O   -3.535200      0.2859000     -0.9231000    
 O    2.167800       1.673800     -0.8284000    
 O    1.863800      -2.041600       1.057000    
 O   -2.791800      -1.396900      0.4063000    
 C  -0.2171000     -3.7799999E-02  0.6790000    
 C   0.8638000      0.9797000       1.093300    
 C   0.2570000     -0.9871000     -0.4405000    
 C   -1.519700      0.6796000      0.2709000    
 C    1.294100       1.916000     -7.7999998E-03
 C    1.508300      -1.749500     -7.5099997E-02
 C   -2.651700     -0.2728000     -5.4699998E-02
 H  -0.4330000     -0.6508000       1.565100    
 H   0.5002000       1.582500       1.935800    
 H    1.764100      0.4847000       1.473100    
 H   0.4478000     -0.4121000      -1.354100    
 H  -0.5027000      -1.738700     -0.6770000    
 H   -1.337700       1.291800     -0.6202000    
 H   -1.863500       1.337900       1.076400    
 H   0.8454000       3.680300     -0.6995000    
 H    2.991100      -2.629200     -0.9829000    
 H   -4.277200     -0.3215000      -1.130400    


%chk=000062382-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000062382

0 1
O 1.841439 3.162667 0.502820
O 2.148226 -2.525606 -0.919591
O -3.890161 0.120698 -0.605208
O 0.821945 2.087848 -1.277158
O 2.071466 -1.616892 1.210362
O -2.622090 -1.695596 0.080194
C -0.275933 0.000895 0.538405
C 0.655093 1.140033 1.020427
C 0.395476 -0.937855 -0.494318
C -1.603385 0.568891 -0.019634
C 1.077455 2.126893 -0.049929
C 1.592911 -1.684479 0.053530
C -2.699186 -0.468963 -0.158901
H -0.508494 -0.607767 1.433426
H 0.174394 1.717188 1.833599
H 1.568723 0.704328 1.466803
H 0.706890 -0.377951 -1.395655
H -0.331928 -1.700387 -0.829201
H -1.442630 1.045934 -1.004800
H -1.993834 1.369484 0.638723
H 2.116818 3.789728 -0.220605
H 2.922977 -3.012783 -0.526455
H -4.591671 -0.581210 -0.690634


