%chk=000005156.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005156

0 1
 O   -1.397800       1.021200     -0.8770000    
 O   -3.613400       1.115400      -1.469800    
 O    4.186000       1.223700      0.2096000    
 C   -1.593900     -0.2124000       1.098200    
 C  -0.6835000      0.7490000      0.3379000    
 C   0.8608000      -1.208000     -0.3592000    
 C   -1.442300      -1.673000      0.6559000    
 C   0.7297000      0.2602000      6.1099999E-02
 C   2.3000000E-02  -2.091600      0.5926000    
 C   -2.960600      0.3945000      0.7709000    
 C   -2.743400      0.8718000     -0.6485000    
 C   0.4143000      -1.387300      -1.826600    
 C    2.286600      -1.709900     -0.2968000    
 C    1.803400       1.065300      0.2429000    
 C   -4.157100     -0.5288000      0.9133000    
 C    3.352400     -0.9367000     -9.0099998E-02
 C    3.189400      0.5122000      0.1151000    
 C    1.746300       2.534200      0.5706000    
 H   -1.389100     -0.1580000       2.174900    
 H  -0.6603000       1.688500      0.9026000    
 H   -1.910700      -1.844300     -0.3197000    
 H   -1.969300      -2.324100       1.364200    
 H   0.4425000      -2.055400       1.608200    
 H   7.0699997E-02  -3.143100      0.2787000    
 H   -3.119500       1.288900       1.387500    
 H   0.5116000      -2.432400      -2.146300    
 H  -0.6274000      -1.102300      -1.995500    
 H    1.025900     -0.7792000      -2.505300    
 H    2.454300      -2.772400     -0.4636000    
 H   -4.148300      -1.338000      0.1760000    
 H   -4.195800     -0.9670000       1.915400    
 H   -5.086300      2.9700000E-02  0.7542000    
 H    4.355300      -1.347500     -8.3999999E-02
 H    2.546700       3.084700      6.4300001E-02
 H    1.854800       2.685300       1.649100    
 H   0.8176000       3.006500      0.2386000    


%chk=000005156-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000005156

0 1
O -1.414527 1.013415 -0.937399
O -3.661440 1.058558 -1.533034
O 4.241359 1.308463 0.240752
C -1.589540 -0.241377 1.120308
C -0.645944 0.726099 0.348096
C 0.895480 -1.232382 -0.369393
C -1.440584 -1.703344 0.642043
C 0.751282 0.227022 0.058096
C 0.037429 -2.137175 0.585937
C -2.977301 0.382477 0.791191
C -2.796247 0.846897 -0.668741
C 0.412549 -1.406299 -1.858494
C 2.325553 -1.717945 -0.338979
C 1.828526 1.068387 0.240499
C -4.235698 -0.476648 0.993316
C 3.398100 -0.906516 -0.128250
C 3.229633 0.540602 0.115976
C 1.718223 2.541694 0.595874
H -1.362770 -0.182314 2.201287
H -0.597598 1.692587 0.880007
H -1.901586 -1.828763 -0.356479
H -1.994673 -2.371544 1.327265
H 0.480405 -2.097452 1.601287
H 0.110421 -3.186625 0.240368
H -3.084087 1.313779 1.390419
H 0.456190 -2.473791 -2.145024
H -0.614164 -1.036246 -2.000312
H 1.067364 -0.834082 -2.537402
H 2.468103 -2.788058 -0.549435
H -4.170511 -1.430966 0.443830
H -4.392992 -0.699992 2.063358
H -5.120081 0.063095 0.613282
H 4.428182 -1.279400 -0.148948
H 2.699904 3.015613 0.432503
H 1.461383 2.690790 1.662535
H 0.962257 3.061139 -0.016940


