%chk=000079261.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079261

0 1
 O   -1.156600      -1.474600     -3.1099999E-02
 O    1.394700      -1.308500     -0.5214000    
 C   -3.423700      0.6336000      5.9300002E-02
 C   -2.347700      0.2945000       1.101700    
 C   -1.110200     -0.3752000      0.5175000    
 C   0.1838000      0.4016000      0.6674000    
 C   -2.872900       1.554100      -1.032900    
 C   -3.964000     -0.6505000     -0.5732000    
 C    2.706500      0.5808000      0.2112000    
 C    1.424400     -0.2265000      6.2399998E-02
 C    3.946200     -0.1162000     -0.3441000    
 C    5.219500      0.6869000     -0.1168000    
 H   -4.247300       1.144800      0.5723000    
 H   -2.748900     -0.3721000       1.874300    
 H   -2.041700       1.212800       1.617200    
 H   0.3680000      0.5355000       1.738700    
 H   4.4000000E-02   1.378800      0.1933000    
 H   -2.461500       2.469900     -0.5957000    
 H   -2.084200       1.072200      -1.620000    
 H   -3.670600       1.844700      -1.725100    
 H   -4.863500     -0.4259000      -1.157800    
 H   -3.251500      -1.117300      -1.259500    
 H   -4.245400      -1.382200      0.1912000    
 H    2.560300       1.538300     -0.3014000    
 H    2.848500      0.7803000       1.279600    
 H    3.818600     -0.2938000      -1.418700    
 H    4.057400      -1.101400      0.1248000    
 H    5.155800       1.665300     -0.6034000    
 H    6.082200      0.1556000     -0.5306000    
 H    5.396600      0.8446000      0.9518000    


%chk=000079261-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079261

0 1
O -0.260903 -0.715419 1.723244
O 0.809583 1.581481 -1.329383
C -2.982760 0.154521 -0.129053
C -2.364071 0.427719 1.291764
C -0.844036 0.340688 1.352890
C -0.024362 1.593707 0.956423
C -2.746759 1.304163 -1.138252
C -2.517344 -1.204075 -0.702043
C 2.291075 0.568073 0.339260
C 1.029506 1.277253 -0.126051
C 3.244460 0.148829 -0.794490
C 4.525672 -0.522186 -0.256369
H -4.075649 0.090897 0.055282
H -2.757213 -0.334910 1.988883
H -2.696071 1.428067 1.631590
H 0.492155 1.934447 1.875217
H -0.688401 2.393040 0.594844
H -3.075448 2.277879 -0.726571
H -1.685052 1.392666 -1.430397
H -3.329491 1.119345 -2.059779
H -3.077260 -1.443215 -1.624678
H -1.442130 -1.183314 -0.958199
H -2.672505 -2.025471 0.020905
H 2.808966 1.240503 1.058159
H 1.964964 -0.302218 0.948780
H 3.502685 1.035711 -1.403040
H 2.712555 -0.540815 -1.476722
H 5.093461 0.165172 0.399508
H 5.193437 -0.824530 -1.083451
H 4.287737 -1.427908 0.332727


