%chk=000079990.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079990

0 1
 O    1.474900      -1.650300      0.4404000    
 O    2.381500      0.8042000     -0.4959000    
 C   -1.653800      0.2345000      0.2975000    
 C   -3.104000      3.4100000E-02  0.5813000    
 C  -0.7524000     -0.8101000      0.5024000    
 C   0.6043000     -0.6226000      0.2374000    
 C   -1.198700       1.466500     -0.1722000    
 C    1.059200      0.6096000     -0.2324000    
 C   0.1578000       1.654100     -0.4372000    
 C   -3.869100     -0.4772000     -0.6367000    
 C    1.708500      -2.528700     -0.6588000    
 C    3.191700       1.285900      0.5744000    
 H   -3.229100     -0.6716000       1.412100    
 H   -3.552100      0.9755000      0.9233000    
 H   -1.101700      -1.773000      0.8674000    
 H   -1.891200       2.287600     -0.3377000    
 H   0.5051000       2.616100     -0.8042000    
 H   -3.801500      0.2283000      -1.471700    
 H   -4.926800     -0.6115000     -0.3894000    
 H   -3.473900      -1.440400     -0.9768000    
 H    2.129000      -1.980500      -1.507700    
 H   0.7800000      -3.026900     -0.9554000    
 H    2.427900      -3.289100     -0.3427000    
 H    3.182300      0.5816000       1.412200    
 H    2.843900       2.269400      0.9059000    
 H    4.218300       1.382400      0.2103000    


%chk=000079990-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079990

0 1
O 1.396036 -1.639463 0.556171
O 2.348959 0.866286 -0.624428
C -1.781609 0.315760 0.318198
C -3.261641 0.119860 0.618909
C -0.848387 -0.720081 0.572116
C 0.517706 -0.569326 0.254889
C -1.309111 1.515883 -0.273408
C 0.985582 0.657249 -0.298629
C 0.060265 1.686123 -0.573498
C -4.025541 -0.532709 -0.564922
C 2.071999 -2.230176 -0.622477
C 3.262345 0.864383 0.542253
H -3.382286 -0.514959 1.517516
H -3.728217 1.095899 0.852871
H -1.168421 -1.670049 1.015607
H -2.014359 2.328193 -0.486248
H 0.437998 2.616787 -1.009687
H -3.949625 0.091137 -1.473951
H -5.096543 -0.660699 -0.321837
H -3.605064 -1.526298 -0.804191
H 2.647683 -1.464963 -1.173526
H 1.325118 -2.693268 -1.295209
H 2.742505 -3.004086 -0.218452
H 3.196468 -0.090535 1.094481
H 3.016525 1.705336 1.218310
H 4.271715 1.001618 0.124942


