%chk=000020885.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020885

0 1
 O   -4.668600      0.5670000     -0.7199000    
 O   -1.441300      -2.477000       1.018300    
 O   0.6884000      -1.316200       1.974800    
 O    2.368000      -1.289000      -2.512600    
 O    1.515800      -2.331400     -0.6812000    
 C  -0.8555000     -0.1841000      0.6311000    
 C    1.679700      0.3157000      0.6237000    
 C   0.5328000     -0.4344000       1.119000    
 C    2.406400     -0.1196000     -0.4844000    
 C   -1.764700      -1.217600      0.6097000    
 C   -1.171800       1.091700      0.2185000    
 C    2.045900       1.490600       1.280200    
 C   -3.057500     -0.9631000      0.1521000    
 C   -3.407500      0.3187000     -0.2723000    
 C   -2.464500       1.346100     -0.2391000    
 C    3.499300      0.6202000     -0.9361000    
 C    3.138800       2.230300      0.8286000    
 C    3.865500       1.795100     -0.2796000    
 C    2.048900      -1.342600      -1.191400    
 C   -4.958100       1.899700      -1.139400    
 H  -0.4674000       1.915500      0.2378000    
 H    1.490600       1.839700       2.147200    
 H   -3.798300      -1.758400      0.1225000    
 H   -2.669700       2.364100     -0.5522000    
 H    4.094300      0.3016000      -1.788100    
 H    3.425000       3.144300       1.340700    
 H    4.718500       2.369700     -0.6288000    
 H   -2.219700      -3.052100      0.9225000    
 H   -6.003700       1.916300      -1.463900    
 H   -4.350800       2.190700      -2.003100    
 H   -4.869400       2.610600     -0.3109000    
 H    2.123500      -2.115600      -2.981000    


%chk=000020885-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020885

0 1
O -4.647996 0.408433 -0.828306
O -1.587954 -2.349571 1.652366
O 0.776807 -1.084994 2.463836
O 1.933723 -0.677185 -2.814366
O 0.832810 -1.806666 -1.114696
C -0.771192 -0.232732 0.790898
C 1.760594 0.302615 0.779365
C 0.574156 -0.431128 1.399556
C 2.202917 0.153321 -0.570397
C -1.841417 -1.172060 0.954467
C -1.046135 0.943489 0.046905
C 2.475635 1.175332 1.636048
C -3.110319 -0.919013 0.395541
C -3.348653 0.271060 -0.329865
C -2.310076 1.220185 -0.508355
C 3.315713 0.902442 -1.038194
C 3.580217 1.917535 1.165823
C 3.996433 1.788456 -0.179931
C 1.576305 -0.860272 -1.463980
C -4.961226 1.622925 -1.588773
H -0.243668 1.677306 -0.083681
H 2.153159 1.258973 2.678813
H -3.933921 -1.634247 0.505019
H -2.471565 2.150038 -1.059247
H 3.642198 0.763660 -2.072270
H 4.113467 2.590861 1.845718
H 4.853609 2.360096 -0.551004
H -2.373913 -2.952042 1.617957
H -6.017024 1.515186 -1.876447
H -4.332137 1.700834 -2.495999
H -4.833555 2.529084 -0.966209
H 1.515910 -1.405422 -3.347893


