%chk=000016457.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016457

0 1
 O    1.704400      0.3439000      0.3465000    
 O    3.085900      0.3242000      -1.504900    
 C    1.155100     -0.9393000      5.2499998E-02
 C  -8.6099997E-02  -1.186400      0.9309000    
 C   -1.298200     -0.4737000      0.4336000    
 C    2.234800      -1.988700      0.2849000    
 C   -1.577700      0.8193000      0.8761000    
 C   -2.152200      -1.099800     -0.4746000    
 C   -2.711200       1.486000      0.4111000    
 C   -3.285500     -0.4329000     -0.9397000    
 C   -3.565100      0.8600000     -0.4969000    
 C    2.815300      0.6887000     -0.3687000    
 C    3.680600       1.598800      0.4492000    
 H   0.8591000     -0.9651000      -1.004800    
 H   0.1198000     -0.8801000       1.965000    
 H  -0.3076000      -2.260900      0.9725000    
 H    2.656100      -1.897600       1.292400    
 H    1.826000      -2.998400      0.1731000    
 H    3.068700      -1.903700     -0.4176000    
 H  -0.9201000       1.319000       1.582500    
 H   -1.944500      -2.105900     -0.8292000    
 H   -2.928700       2.492800      0.7554000    
 H   -3.950100     -0.9200000      -1.647300    
 H   -4.447400       1.379200     -0.8594000    
 H    4.003200       1.084800       1.358100    
 H    3.130400       2.510200      0.6963000    
 H    4.567300       1.873000     -0.1294000    


%chk=000016457-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016457

0 1
O 1.788572 0.010307 0.547507
O 2.896893 0.198456 -1.500078
C 1.265836 -1.345231 0.154741
C -0.064214 -1.515878 0.921097
C -1.161639 -0.570238 0.454757
C 2.319479 -2.402604 0.510565
C -1.308770 0.717518 1.031277
C -2.045128 -0.949748 -0.588591
C -2.311853 1.603436 0.577012
C -3.048366 -0.066445 -1.047940
C -3.185316 1.214661 -0.465324
C 2.580982 0.682626 -0.389110
C 2.961305 2.052709 0.130386
H 1.094484 -1.326137 -0.937693
H 0.143177 -1.374900 1.998561
H -0.384159 -2.566867 0.784396
H 2.533471 -2.394393 1.594268
H 1.955567 -3.409499 0.234803
H 3.256208 -2.215039 -0.040436
H -0.627822 1.023403 1.833796
H -1.950381 -1.945214 -1.041332
H -2.414081 2.593629 1.035962
H -3.723474 -0.377440 -1.853375
H -3.964805 1.899990 -0.816980
H 3.291622 1.993192 1.180442
H 2.078446 2.716570 0.096387
H 3.756267 2.480536 -0.497500


