%chk=000004119.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004119

0 1
 O   0.3482000     -0.6628000     -3.0800000E-02
 O   -4.145600      -2.191500     -0.1156000    
 O  -0.8234000       3.235200      0.1472000    
 C   -1.456700      0.9612000      3.7099998E-02
 C  -0.9874000     -0.3499000     -2.1199999E-02
 C   -2.829000       1.220800      4.4900000E-02
 C    1.269500      0.3727000      1.1800000E-02
 C  -0.4824000       2.061800      9.1600001E-02
 C   -1.890500      -1.412000     -7.1699999E-02
 C   -3.730100      0.1566000     -6.2000002E-03
 C   -3.262100      -1.157000     -6.4300001E-02
 C   0.9424000       1.673100      7.6300003E-02
 C    2.676600     -7.5400002E-02  2.7999999E-03
 C   -3.408700       2.596800      0.1053000    
 C    3.668900      0.7385000     -0.5493000    
 C    3.022000      -1.314900      0.5470000    
 C    4.998100      0.3156000     -0.5573000    
 C    4.351200      -1.737800      0.5391000    
 C    5.339200     -0.9225000     -1.3100000E-02
 C   -3.600000      -3.508500     -0.1736000    
 H   -1.467700      -2.410300     -0.1158000    
 H   -4.803100      0.3343000     -1.7000000E-03
 H    1.663500       2.479600      0.1375000    
 H   -3.117500       3.103700       1.030900    
 H   -3.108900       3.186200     -0.7673000    
 H   -4.505000       2.576000      9.8899998E-02
 H    3.441700       1.699500      -1.003000    
 H    2.274700      -1.967400      0.9918000    
 H    5.767100      0.9477000     -0.9917000    
 H    4.617500      -2.701100      0.9644000    
 H    6.374000      -1.252100     -2.0000000E-02
 H   -3.026000      -3.746800      0.7284000    
 H   -3.019400      -3.664000      -1.089200    
 H   -4.443300      -4.206100     -0.2085000    


%chk=000004119-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004119

0 1
O 0.394263 -0.575437 -0.000262
O -4.157395 -2.229259 0.071797
O -0.819771 3.414375 -0.093369
C -1.474379 1.058325 -0.028618
C -0.984408 -0.277894 0.001976
C -2.904375 1.242082 -0.023584
C 1.336300 0.465016 -0.032549
C -0.494870 2.175989 -0.063638
C -1.813403 -1.416704 0.036414
C -3.736911 0.111181 0.010564
C -3.206584 -1.207730 0.040261
C 0.917377 1.774408 -0.062444
C 2.727627 -0.036665 -0.029305
C -3.541781 2.617433 -0.054344
C 3.827954 0.864913 -0.064702
C 2.989987 -1.434294 0.009455
C 5.150441 0.380605 -0.061119
C 4.315696 -1.914968 0.012999
C 5.402540 -1.011710 -0.022237
C -3.670313 -3.612739 0.102509
H -1.352618 -2.406230 0.058447
H -4.825038 0.224884 0.014879
H 1.644603 2.588345 -0.087298
H -3.213623 3.231893 0.801354
H -3.230820 3.184406 -0.948500
H -4.641883 2.530352 -0.041490
H 3.656529 1.945524 -0.095278
H 2.149128 -2.132167 0.036774
H 5.986054 1.088234 -0.088749
H 4.500816 -2.994263 0.043264
H 6.432318 -1.385215 -0.019661
H -3.064807 -3.802345 1.009560
H -3.074657 -3.845908 -0.800907
H -4.576197 -4.235238 0.122498


