%chk=000091229.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091229

0 1
 O   -2.173400      -1.970800     -0.8307000    
 O    2.469700     -0.1723000     -0.4246000    
 O    1.841400     -0.4594000       1.776800    
 C  -0.8733000     -0.3236000      0.3833000    
 C  -0.7341000       1.153900      3.4000000E-03
 C   -1.993900       1.948500      0.3444000    
 C   -3.218500       1.356400     -0.3483000    
 C   -3.414800     -0.1086000      1.3000000E-02
 C   -2.144900     -0.8932000     -0.2382000    
 C   0.3638000      -1.108600     -4.1499998E-02
 C    1.622000     -0.5527000      0.5770000    
 C    3.718600      0.3811000      2.2000000E-03
 C    4.537300      0.7492000      -1.216800    
 H  -0.9911000     -0.4051000       1.472000    
 H  -0.5346000       1.247900      -1.072200    
 H   0.1123000       1.612100      0.5275000    
 H   -1.865300       2.991300      3.3000000E-02
 H   -2.147300       1.952900       1.430400    
 H   -3.098200       1.452500      -1.434800    
 H   -4.111900       1.927400     -7.2099999E-02
 H   -4.225000     -0.5348000     -0.5880000    
 H   -3.680500     -0.2204000       1.069800    
 H   0.4543000      -1.113000      -1.135400    
 H   0.2874000      -2.160400      0.2595000    
 H    3.533300       1.275500      0.6076000    
 H    4.259900     -0.3588000      0.6022000    
 H    5.501000       1.176800     -0.9263000    
 H    4.715300     -0.1320000      -1.842000    
 H    4.000500       1.475200      -1.836400    


%chk=000091229-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091229

0 1
O -1.957223 -1.915559 -0.967299
O 2.799126 -0.125840 -0.559607
O 1.684815 0.404032 1.415198
C -0.876491 -0.000949 0.124007
C -1.172859 1.499459 -0.185945
C -2.504510 1.968683 0.440325
C -3.684376 1.096382 -0.043400
C -3.431703 -0.407123 0.263569
C -2.076895 -0.873903 -0.265033
C 0.429368 -0.495964 -0.521361
C 1.656631 -0.017968 0.233102
C 4.092845 0.256017 0.089764
C 5.186747 0.038948 -0.950475
H -0.769452 -0.078180 1.228867
H -1.211526 1.638955 -1.286037
H -0.332040 2.109331 0.193759
H -2.686573 3.029848 0.184379
H -2.431415 1.913485 1.545756
H -3.818145 1.227837 -1.135685
H -4.628710 1.414248 0.437046
H -4.219961 -1.051598 -0.161953
H -3.434812 -0.547222 1.365064
H 0.506334 -0.184944 -1.578457
H 0.437130 -1.603717 -0.542229
H 4.019264 1.309255 0.416385
H 4.228720 -0.372850 0.988245
H 6.169763 0.306219 -0.521496
H 5.222131 -1.016375 -1.270312
H 5.013817 0.666489 -1.841377


