%chk=000080201.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080201

0 1
 O    2.413200     -0.1432000     -0.4901000    
 O   -3.808900      0.3227000     -0.4948000    
 O   3.7599999E-02  -2.293800      0.5288000    
 O    2.150600      5.2099999E-02   1.788500    
 C  -0.3454000       1.330800      0.1168000    
 C   0.2482000      9.0599999E-02  0.3516000    
 C  -0.5216000      -1.071600      0.3020000    
 C   -1.708800       1.408900     -0.1680000    
 C   -2.478500      0.2467000     -0.2176000    
 C   -1.884900     -0.9935000      1.7500000E-02
 C   0.4539000       2.592300      0.1625000    
 C    1.673600      2.4000001E-03  0.6497000    
 C    3.832100     -0.2426000     -0.3276000    
 C    4.474700     -0.3977000      -1.689500    
 C   -4.535900     -0.9043000     -0.5298000    
 H   -2.182100       2.370100     -0.3531000    
 H   -2.430000      -1.931500     -6.8999999E-03
 H   0.9101000       2.722700       1.149400    
 H    1.238900       2.577100     -0.6006000    
 H  -0.1664000       3.475300     -2.6500000E-02
 H    4.206700      0.6648000      0.1590000    
 H    4.066600      -1.112800      0.2953000    
 H    5.561900     -0.4765000      -1.602300    
 H    4.094500      -1.291300      -2.195300    
 H    4.232100      0.4571000      -2.329300    
 H   0.9875000      -2.206900      0.7087000    
 H   -5.576500     -0.6566000     -0.7642000    
 H   -4.538000      -1.399100      0.4474000    
 H   -4.176900      -1.562500      -1.328200    


%chk=000080201-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080201

0 1
O 2.592439 0.188101 -0.347771
O -3.908249 0.500381 -0.303933
O -0.349731 -2.532674 0.965054
O 2.033609 -1.848018 0.587551
C -0.254989 0.896474 -0.589154
C 0.236865 -0.347270 -0.039938
C -0.727682 -1.323093 0.428256
C -1.639193 1.114348 -0.648210
C -2.566014 0.140532 -0.180885
C -2.118221 -1.078507 0.356681
C 0.650874 1.997058 -1.114130
C 1.647824 -0.723244 0.090663
C 4.024093 -0.229389 -0.198502
C 4.870387 0.913818 -0.747996
C -4.916693 -0.460236 0.160778
H -2.038110 2.046069 -1.058852
H -2.788150 -1.857108 0.726773
H 1.335470 2.367695 -0.332037
H 1.294441 1.636314 -1.935107
H 0.044864 2.840995 -1.484045
H 4.216176 -0.426925 0.871062
H 4.168901 -1.173186 -0.753482
H 5.941721 0.658099 -0.656266
H 4.647808 1.096137 -1.813271
H 4.687818 1.846973 -0.188048
H 0.682906 -2.567936 0.951301
H -5.884182 0.026865 -0.027899
H -4.802058 -0.664866 1.242079
H -4.854624 -1.407707 -0.407270


