%chk=000008833.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008833

0 1
 O    2.743900     -0.4647000     -0.6396000    
 O    3.737200      -1.119700       1.340700    
 C   3.6499999E-02   2.189300     -0.3343000    
 C   -1.084100       1.592900      0.5401000    
 C    1.000900       1.148900     -0.9340000    
 C   -1.893400      0.4987000     -0.1639000    
 C   0.7976000       3.256500      0.4597000    
 C   -2.978200     -6.5800004E-02  0.7600000    
 C    1.902600      0.4382000      6.8899997E-02
 C   -3.821400      -1.122700      8.6999997E-02
 C   -4.577300     -0.7135000      -1.144400    
 C   -3.917500      -2.365000      0.5859000    
 C    3.619000      -1.184900      0.1245000    
 C    4.434200      -2.088200     -0.7506000    
 H  -0.4463000       2.695500      -1.181500    
 H   -1.762800       2.398700      0.8482000    
 H  -0.6519000       1.182500       1.461400    
 H   0.4627000      0.4114000      -1.539700    
 H    1.649300       1.660800      -1.659400    
 H   -2.336300      0.9210000      -1.073000    
 H   -1.242700     -0.3282000     -0.4675000    
 H   0.1276000       4.081000      0.7275000    
 H    1.617200       3.676300     -0.1329000    
 H    1.212400       2.857500       1.390800    
 H   -2.506100     -0.4678000       1.665600    
 H   -3.638600      0.7459000       1.090800    
 H    1.298800     -0.1222000      0.7909000    
 H    2.532600       1.156900      0.6030000    
 H   -3.894000     -0.5313000      -1.979200    
 H   -5.286400      -1.485200      -1.463400    
 H   -5.151700      0.1989000     -0.9539000    
 H   -3.381300      -2.657200       1.482700    
 H   -4.533100      -3.119600      0.1077000    
 H    5.009200      -1.492600      -1.464000    
 H    3.778100      -2.788500      -1.273400    
 H    5.131800      -2.660000     -0.1319000    


%chk=000008833-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008833

0 1
O 2.798109 -0.462559 -0.652706
O 3.576231 -1.324832 1.368440
C 0.066567 2.236507 -0.345681
C -1.029387 1.575000 0.537166
C 1.084409 1.221659 -0.944000
C -1.874917 0.491702 -0.169738
C 0.771866 3.374796 0.433489
C -3.020352 -0.032287 0.739876
C 1.855422 0.416927 0.104937
C -3.867171 -1.133435 0.111650
C -4.654794 -0.761264 -1.133940
C -3.922329 -2.382976 0.646354
C 3.614066 -1.298037 0.117173
C 4.511126 -2.128286 -0.776926
H -0.448655 2.698389 -1.215383
H -1.709342 2.375592 0.897079
H -0.566299 1.143202 1.449164
H 0.562361 0.514177 -1.615095
H 1.813528 1.771188 -1.570292
H -2.297235 0.913742 -1.104116
H -1.238508 -0.364851 -0.467139
H 0.046257 4.155948 0.726605
H 1.557780 3.854252 -0.179470
H 1.245694 3.001611 1.360832
H -2.581531 -0.399911 1.687924
H -3.673206 0.828397 1.002315
H 1.199848 -0.227425 0.717754
H 2.447575 1.054039 0.785643
H -3.982649 -0.498161 -1.973620
H -5.303364 -1.589469 -1.466858
H -5.292578 0.125333 -0.946689
H -3.355195 -2.647789 1.546949
H -4.534903 -3.175366 0.199809
H 5.137567 -1.470079 -1.403448
H 3.901140 -2.746231 -1.458427
H 5.151367 -2.775706 -0.160830


