%chk=000020311.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020311

0 1
 O    2.185500      -1.191100      0.8257000    
 O    2.236300       1.195800      0.8427000    
 O    2.170100     -3.8400002E-02  -1.199900    
 O   -3.917000     -1.2900000E-02  0.2016000    
 C    1.724800      2.1800000E-02  0.1786000    
 C   0.1903000      1.2800000E-02  0.1849000    
 C  -0.4588000     -3.1099999E-02   1.394600    
 C  -0.4687000      4.8099998E-02  -1.020000    
 C   -1.853700     -4.0199999E-02   1.400000    
 C   -1.863500      3.9200000E-02  -1.014600    
 C   -2.556000     -5.1000002E-03  0.1954000    
 C    1.772500      -2.410900      0.2176000    
 C    1.829800       2.426100      0.2525000    
 C    3.581100     -3.8600001E-02  -1.393900    
 C   -4.572400      2.4499999E-02  -1.065200    
 H   8.2099997E-02 -5.7100002E-02   2.335200    
 H   2.9999999E-02  8.8100001E-02  -1.981900    
 H   -2.387600     -7.4199997E-02   2.345800    
 H   -2.346600      6.9499999E-02  -1.985400    
 H    2.292600      -3.226900      0.7281000    
 H    2.040200      -2.455100     -0.8414000    
 H   0.6994000      -2.577200      0.3437000    
 H    2.049400       2.455900     -0.8182000    
 H    2.392700       3.229500      0.7363000    
 H   0.7671000       2.615400      0.4270000    
 H    4.045600     -0.9018000     -0.9101000    
 H    4.026400      0.8849000      -1.014200    
 H    3.775400     -9.8700002E-02  -2.468100    
 H   -4.355300      0.9535000      -1.603300    
 H   -5.650200      1.1400000E-02 -0.8721000    
 H   -4.343900     -0.8644000      -1.662900    


%chk=000020311-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020311

0 1
O 2.287536 -1.141696 0.827298
O 2.300892 1.096579 0.847394
O 2.239391 -0.003005 -1.294121
O -4.001389 0.022654 0.232458
C 1.749839 -0.012402 0.080514
C 0.226906 -0.003188 0.035998
C -0.469925 -0.010510 1.274392
C -0.508388 0.012755 -1.166451
C -1.873397 -0.001638 1.305529
C -1.922638 0.021787 -1.151887
C -2.605599 0.014674 0.089175
C 1.857548 -2.451934 0.309826
C 1.886591 2.420866 0.353279
C 3.711885 -0.003682 -1.399878
C -4.807579 0.038448 -0.990693
H 0.106267 -0.023218 2.205610
H 0.033398 0.018091 -2.116425
H -2.425581 -0.007077 2.250091
H -2.469948 0.034190 -2.099145
H 2.418541 -3.189151 0.903948
H 2.102492 -2.560263 -0.763745
H 0.770688 -2.602378 0.451428
H 2.125782 2.542418 -0.720233
H 2.462143 3.140728 0.954734
H 0.802981 2.584590 0.504629
H 4.141173 -0.891483 -0.903089
H 4.140172 0.902763 -0.936865
H 3.920154 -0.023232 -2.480490
H -4.609936 0.947510 -1.591405
H -5.851850 0.041541 -0.645751
H -4.620549 -0.861939 -1.607624


