%chk=000021901.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021901

0 1
 O    1.375800     -3.9200000E-02  0.4553000    
 O   0.4282000      -1.274600      -1.304400    
 O    4.163800      0.1392000       1.099600    
 C   0.1687000     -0.3013000     -0.2794000    
 C  -0.8760000     -0.8506000      0.6839000    
 C  -0.3091000      0.9857000     -0.9397000    
 C    2.412500     -0.6377000     -0.3276000    
 C    1.714300      -1.805400     -0.9811000    
 C   -2.174400      -1.198000     -4.1499998E-02
 C  -0.5579000       2.082800      9.3400002E-02
 C    3.580900      -1.032900      0.5500000    
 C   -3.208100      -1.779500      0.9225000    
 C   -1.005200       3.382000     -0.5760000    
 C   -4.491500      -2.158900      0.2009000    
 C   -1.222200       4.488300      0.4440000    
 H   -1.054500     -0.1790000       1.530300    
 H  -0.4812000      -1.770600       1.137300    
 H   0.4737000       1.335300      -1.627300    
 H   -1.185600      0.8254000      -1.576200    
 H    2.717200      0.1071000      -1.073500    
 H    1.571200      -2.646200     -0.2931000    
 H    2.218900      -2.160700      -1.883200    
 H   -1.983800      -1.921600     -0.8426000    
 H   -2.615600     -0.3082000     -0.5016000    
 H   -1.342000       1.786900      0.7974000    
 H   0.3511000       2.273600      0.6757000    
 H    3.253200      -1.655100       1.388700    
 H    4.346100      -1.574100     -1.4700000E-02
 H   -2.799100      -2.669000       1.415800    
 H   -3.437800      -1.049600       1.707600    
 H  -0.2498000       3.707200      -1.300800    
 H   -1.936100       3.214400      -1.130200    
 H   -4.300700      -2.913300     -0.5690000    
 H   -4.945200      -1.285500     -0.2783000    
 H   -5.216200      -2.572300      0.9092000    
 H  -0.2995000       4.703200      0.9924000    
 H   -1.995100       4.209300       1.167300    
 H   -1.541500       5.407800     -5.6400001E-02
 H    4.486500      0.6820000      0.3602000    


%chk=000021901-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021901

0 1
O 1.405703 -0.085935 0.479571
O 0.483790 -1.215204 -1.405000
O 4.364190 -0.044301 1.261206
C 0.142146 -0.268049 -0.294749
C -0.875267 -0.911817 0.660636
C -0.278011 1.053104 -0.957893
C 2.510339 -0.657023 -0.319771
C 1.802679 -1.790334 -1.093294
C -2.262034 -1.166087 0.030817
C -0.665836 2.164556 0.041009
C 3.633565 -1.130711 0.604382
C -3.192817 -1.967098 0.969562
C -0.930546 3.516145 -0.660026
C -4.594942 -2.199071 0.366824
C -1.345047 4.630474 0.324631
H -0.970799 -0.268438 1.556297
H -0.440961 -1.870156 1.006396
H 0.570059 1.391971 -1.584396
H -1.117504 0.845073 -1.649006
H 2.891203 0.108200 -1.034443
H 1.704285 -2.697552 -0.461085
H 2.281315 -2.047899 -2.051718
H -2.132635 -1.717430 -0.921434
H -2.748988 -0.201832 -0.221038
H -1.573154 1.869067 0.606184
H 0.147510 2.283807 0.783641
H 3.206820 -1.723723 1.429422
H 4.329292 -1.771852 0.016962
H -2.721742 -2.944408 1.200452
H -3.287458 -1.432355 1.937048
H -0.017278 3.826255 -1.207994
H -1.722073 3.384068 -1.426354
H -4.527982 -2.751831 -0.589269
H -5.102384 -1.237359 0.161817
H -5.239284 -2.782016 1.050418
H -0.559027 4.799886 1.084606
H -2.274712 4.360734 0.860709
H -1.522550 5.588448 -0.198012
H 4.664138 0.607595 0.577789


