%chk=000011968.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011968

0 1
 O   -1.234600      -2.302800     -0.1898000    
 O    3.953900       1.025800     -0.5024000    
 O    3.530900     -0.9997000      0.4578000    
 C  -0.6369000      2.4999999E-03  0.1321000    
 C   -1.592200     -0.9914000     -8.0399998E-02
 C   -1.030300       1.336400      0.2401000    
 C   -2.940900     -0.6514000     -0.1849000    
 C   0.7775000     -0.3269000      0.2452000    
 C   -2.379100       1.676300      0.1355000    
 C   -3.334400      0.6825000     -7.7100001E-02
 C    1.741100      0.4932000     -0.1598000    
 C    3.145100      5.5399999E-02 -1.6400000E-02
 H  -0.3221000       2.138900      0.4291000    
 H   -3.696600      -1.414700     -0.3502000    
 H    1.012300      -1.298200      0.6722000    
 H   -2.686600       2.714200      0.2250000    
 H   -4.384700      0.9472000     -0.1572000    
 H    1.561000       1.459100     -0.6180000    
 H   -2.032600      -2.839800     -0.3343000    
 H    4.902000      0.7840000     -0.4307000    


%chk=000011968-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000011968

0 1
O -1.188745 -2.300043 -0.058623
O 4.139479 1.085563 -0.048679
O 3.584960 -1.177023 -0.082073
C -0.652751 0.053436 -0.026518
C -1.646891 -0.975191 -0.033794
C -1.109864 1.402745 -0.002418
C -3.027065 -0.665567 -0.017736
C 0.763973 -0.318891 -0.044382
C -2.479961 1.721140 0.013980
C -3.442647 0.681325 0.006366
C 1.831310 0.540230 -0.038745
C 3.208707 0.022619 -0.058687
H -0.372334 2.212128 0.003186
H -3.771177 -1.472540 -0.024244
H 0.984387 -1.393708 -0.063834
H -2.801626 2.767123 0.032393
H -4.511780 0.918457 0.018824
H 1.729707 1.629343 -0.019615
H -1.941775 -2.940964 -0.056768
H 5.056893 0.700418 -0.062832


