%chk=000136574.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136574

0 1
 O   -2.738700       2.363300     -0.5354000    
 O   -2.334100      -2.397000     -0.6886000    
 O   -3.149800       1.212300       1.372300    
 O   -2.923100      -1.456100       1.286500    
 C    1.487600      0.1324000     -0.7283000    
 C   9.3900003E-02  4.3000001E-02 -0.1004000    
 C    2.623600      1.2500000E-02  0.2921000    
 C   -1.000900      0.1330000      -1.173400    
 C    4.043000      7.4000001E-02 -0.2815000    
 C   -2.429400     -7.4000000E-03 -0.6186000    
 C    5.175700      9.7000003E-03  0.7456000    
 C    6.561400     -8.1000002E-03  0.1197000    
 C   -2.813200       1.219700      0.1960000    
 C   -2.596100      -1.331300      0.1140000    
 H    1.600300     -0.6619000      -1.476500    
 H    1.585800       1.086000      -1.261400    
 H  -2.9800000E-02  0.8521000      0.6288000    
 H   1.3700000E-02 -0.9026000      0.4473000    
 H    2.510200     -0.9323000      0.8385000    
 H    2.512700      0.8132000       1.034200    
 H  -0.8965000       1.082700      -1.712500    
 H  -0.8285000     -0.6563000      -1.916700    
 H    4.147800      0.9997000     -0.8613000    
 H    4.163600     -0.7517000     -0.9944000    
 H   -3.144800     -3.7700001E-02  -1.451900    
 H    5.054900     -0.8905000       1.359800    
 H    5.099100      0.8687000       1.422600    
 H    6.731400      0.8939000     -0.4767000    
 H    6.684500     -0.8790000     -0.5317000    
 H    7.329800     -5.2700002E-02  0.8977000    
 H   -2.983800       3.151900     -5.9000002E-03
 H   -2.439700      -3.247700     -0.2118000    


%chk=000136574-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000136574

0 1
O -4.062869 1.401256 0.340317
O -2.977761 -2.172779 -0.774405
O -1.973579 2.399896 0.185932
O -2.582109 -1.187549 1.292126
C 1.618640 0.098624 -0.766243
C 0.186934 0.003371 -0.192715
C 2.712571 -0.061961 0.313182
C -0.882983 0.144330 -1.297664
C 4.147369 0.052158 -0.249282
C -2.360211 0.147432 -0.799069
C 5.241799 -0.107284 0.830709
C 6.672397 0.010217 0.261555
C -2.718107 1.425257 -0.040811
C -2.655353 -1.086197 0.051502
H 1.759080 -0.677321 -1.548585
H 1.745956 1.078723 -1.271566
H 0.041392 0.796187 0.564395
H 0.068831 -0.965835 0.332112
H 2.592112 -1.044924 0.814902
H 2.564621 0.707512 1.099133
H -0.719442 1.094364 -1.841218
H -0.776463 -0.677742 -2.031012
H 4.268877 1.036152 -0.749024
H 4.296942 -0.716329 -1.036801
H -3.029670 0.097991 -1.678748
H 5.119938 -1.090257 1.330057
H 5.091132 0.660671 1.616813
H 6.827284 0.994912 -0.218933
H 6.860332 -0.767811 -0.502541
H 7.435393 -0.102917 1.053714
H -4.282669 2.227031 0.850730
H -3.119784 -2.981379 -0.210462


