%chk=000081834.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081834

0 1
 O   -4.815900      0.7370000      0.6205000    
 O   -4.239900     -0.3944000      -1.309900    
 C    3.281800      0.1986000     -0.3212000    
 C    2.166800     -0.4546000      0.4999000    
 C    4.673500      2.3399999E-02  0.2932000    
 C   0.8103000     -0.3090000     -0.1984000    
 C    5.795200      0.6123000     -0.5632000    
 C  -0.3418000     -0.9746000      0.5616000    
 C    7.153000      0.4245000      9.6600004E-02
 C   -1.681700     -0.7684000     -8.6499996E-02
 C   -2.690700     -0.1139000      0.5042000    
 C   -3.983900      3.7200000E-02 -0.1971000    
 C   -6.126700      0.9820000      0.1002000    
 H    3.070700       1.269100     -0.4352000    
 H    3.284300     -0.2325000      -1.330300    
 H    2.123300      4.8000002E-03   1.494400    
 H    2.390400      -1.518500      0.6427000    
 H    4.864400      -1.045900      0.4476000    
 H    4.686800      0.4929000       1.284700    
 H   0.8721000     -0.7406000      -1.205800    
 H   0.5891000      0.7585000     -0.3279000    
 H    5.616300       1.681600     -0.7241000    
 H    5.801700      0.1316000      -1.548200    
 H  -0.1552000      -2.053400      0.6289000    
 H  -0.3555000     -0.5979000       1.592100    
 H    7.374200     -0.6374000      0.2438000    
 H    7.187800      0.9215000       1.071300    
 H    7.941200      0.8519000     -0.5310000    
 H   -1.804800      -1.192500      -1.079800    
 H   -2.584500      0.3121000       1.496100    
 H   -6.689200       1.547600      0.8478000    
 H   -6.643100      3.5599999E-02 -8.6099997E-02
 H   -6.065200       1.576100     -0.8167000    


%chk=000081834-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081834

0 1
O -4.989173 0.711417 0.650797
O -4.316841 -0.366109 -1.311319
C 3.346690 0.181789 -0.373326
C 2.197951 -0.452817 0.442629
C 4.738032 -0.033752 0.264411
C 0.806786 -0.224942 -0.189720
C 5.889275 0.598432 -0.550913
C -0.338426 -0.864580 0.645653
C 7.274651 0.381644 0.095712
C -1.688592 -0.695665 -0.000435
C -2.763181 -0.080783 0.568782
C -4.048180 0.043775 -0.153590
C -6.324223 0.897586 0.039617
H 3.159992 1.270345 -0.484953
H 3.345087 -0.240602 -1.399936
H 2.205837 -0.036513 1.471598
H 2.379784 -1.543198 0.546461
H 4.926025 -1.122121 0.378029
H 4.741336 0.390630 1.290377
H 0.792488 -0.646819 -1.215469
H 0.617106 0.861764 -0.293801
H 5.699651 1.685244 -0.666418
H 5.887026 0.172352 -1.575039
H -0.120691 -1.949201 0.750831
H -0.342123 -0.435791 1.666043
H 7.500646 -0.696917 0.195590
H 7.313285 0.826698 1.107988
H 8.080099 0.841197 -0.506296
H -1.811270 -1.093229 -1.020485
H -2.723053 0.343946 1.577559
H -6.912717 1.426743 0.802371
H -6.774868 -0.079820 -0.203376
H -6.243609 1.493997 -0.885170


