%chk=000008600.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008600

0 1
 O  -0.2526000      -1.311700     -0.7592000    
 O  -0.2949000       1.306200      0.7587000    
 O   -3.511800     -3.3000000E-02 -4.9999999E-03
 O   0.4479000      -1.513200       1.449400    
 O   0.4167000       1.526300      -1.444300    
 O   -3.089100      -1.991300      -1.144700    
 O   -3.152800       1.938400       1.134700    
 C    1.724700      -2.502700     -0.3657000    
 C    1.686900       2.529000      0.3683000    
 C    2.727200      -2.977000      0.6834000    
 C    2.682400       3.013600     -0.6828000    
 C   -1.339800     -0.5765000     -0.3288000    
 C   -1.358500      0.5725000      0.3374000    
 C   0.5799000      -1.728000      0.2517000    
 C   0.5490000       1.742300     -0.2468000    
 C    3.853400      -3.781200      5.5000000E-02
 C    3.801400       3.829600     -5.6400001E-02
 C   -2.719300     -0.9885000     -0.5627000    
 C   -2.750600      0.9451000      0.5579000    
 H    1.304700      -3.365900     -0.8941000    
 H    2.228700      -1.851200      -1.088500    
 H    1.258100       3.387200      0.8978000    
 H    2.197900       1.882200       1.090300    
 H    3.148300      -2.114600       1.214000    
 H    2.219700      -3.593700       1.434900    
 H    3.111400       2.155700      -1.214200    
 H    2.167000       3.625000      -1.433200    
 H    4.559800      -4.109300      0.8239000    
 H    3.465100      -4.670600     -0.4515000    
 H    4.402800      -3.180700     -0.6772000    
 H    4.502900       4.165100     -0.8267000    
 H    3.405000       4.714900      0.4508000    
 H    4.358400       3.234800      0.6746000    


%chk=000008600-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008600

0 1
O -0.514009 -1.608580 -0.447788
O -0.538509 1.599644 0.446223
O -3.776960 -0.029134 -0.001388
O 0.917184 -0.863883 1.258563
O 0.906068 0.874021 -1.257062
O -3.349027 -2.266336 -0.589035
O -3.383300 2.214291 0.586446
C 1.659385 -2.628453 -0.332345
C 1.620082 2.651084 0.332713
C 2.946915 -2.860601 0.484116
C 2.905069 2.900787 -0.482555
C -1.493789 -0.676142 -0.179307
C -1.503904 0.652414 0.177576
C 0.738945 -1.608972 0.284900
C 0.715491 1.617511 -0.284531
C 3.873565 -3.884890 -0.202804
C 3.815472 3.940062 0.203594
C -2.911317 -1.150868 -0.304373
C -2.928581 1.105582 0.302052
H 1.092102 -3.568458 -0.473057
H 1.898605 -2.272011 -1.354833
H 1.039019 3.582904 0.471513
H 1.863199 2.299418 1.355939
H 3.475264 -1.898028 0.616473
H 2.680985 -3.210840 1.499112
H 3.447818 1.945921 -0.612406
H 2.635243 3.245107 -1.498545
H 4.794172 -4.041021 0.386898
H 3.375431 -4.866041 -0.314566
H 4.173325 -3.542365 -1.210966
H 4.734259 4.109153 -0.385381
H 3.302428 4.913750 0.313180
H 4.119272 3.603771 1.212643


