%chk=000020413.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020413

0 1
 O   -2.245400       1.559200     -3.7799999E-02
 O   0.7738000       2.330500       1.200100    
 O   0.8572000       2.469300      -1.067100    
 C    2.189400     -0.5503000     -1.4600000E-02
 C   0.6970000     -0.6242000     -9.8000001E-03
 C  -8.4500000E-02  0.5311000     -2.7600000E-02
 C    2.804500      -1.203900      -1.265300    
 C    2.810400      -1.159800       1.255200    
 C   8.7200001E-02  -1.878600      1.3400000E-02
 C   -1.475900      0.4319000     -2.2200000E-02
 C   -2.085600     -0.8225000      1.0000000E-03
 C   -1.304100      -1.977700      1.8800000E-02
 C   -3.573400     -0.9500000      5.9000002E-03
 C   0.5494000       1.845100     -4.9800001E-02
 H    2.528900      0.4907000     -3.4100000E-02
 H    2.620300      -2.283000      -1.299200    
 H    3.889400      -1.052600      -1.283300    
 H    2.389200     -0.7630000      -2.178500    
 H    2.399500     -0.6871000       2.154300    
 H    3.895400      -1.008100       1.262600    
 H    2.626300      -2.237000       1.327700    
 H   0.6734000      -2.793300      2.7600000E-02
 H   -1.763100      -2.962600      3.6800001E-02
 H   -3.999400     -0.4728000      0.8947000    
 H   -4.003000     -0.5017000     -0.8961000    
 H   -3.888600      -1.999300      2.3399999E-02
 H   -3.190500       1.343600     -3.0700000E-02
 H    1.200900       3.213400       1.177800    


%chk=000020413-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020413

0 1
O -2.182976 1.589193 -0.216092
O 0.222219 2.731229 0.881106
O 1.407479 2.186352 -1.030555
C 2.287011 -0.605742 0.123624
C 0.754581 -0.670993 0.132418
C -0.046875 0.502285 0.010168
C 2.823706 -0.902723 -1.305135
C 2.938576 -1.546750 1.167468
C 0.091132 -1.917899 0.244071
C -1.463379 0.399379 -0.018590
C -2.125158 -0.853104 0.091655
C -1.315987 -2.002521 0.228173
C -3.640756 -0.933109 0.047927
C 0.593644 1.847465 -0.137594
H 2.595368 0.426469 0.373752
H 2.530920 -1.918277 -1.632321
H 3.927928 -0.841779 -1.320024
H 2.425938 -0.170434 -2.028005
H 2.534756 -1.370775 2.180893
H 4.030224 -1.374201 1.195243
H 2.783510 -2.612255 0.916078
H 0.679898 -2.833758 0.351763
H -1.801137 -2.981945 0.316546
H -4.117781 -0.349019 0.861427
H -4.052810 -0.572345 -0.916653
H -3.975925 -1.976405 0.167265
H -3.157126 1.418306 -0.195430
H 0.631719 3.620657 0.694020