%chk=000094427.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094427

0 1
 O    2.324700      0.3649000     -0.2152000    
 O   -2.327600      0.3496000      0.2430000    
 O    1.355700      -1.726700     -0.1793000    
 O   -1.357100      -1.735300      8.6099997E-02
 C    3.572900     -0.1223000      0.2878000    
 C   -3.570300     -0.1050000     -0.3025000    
 C    4.640600      0.9595000      0.1124000    
 C   -4.640300      0.9638000     -7.0600003E-02
 C    3.400800     -0.4944000       1.754400    
 C   -3.382600     -0.3842000      -1.787700    
 C    4.804400       1.378200      -1.342700    
 C   -4.819300       1.290200       1.406300    
 C  -3.0000001E-04  0.2849000      2.3800001E-02
 C    1.274900     -0.5074000     -0.1324000    
 C   -1.276600     -0.5156000      0.1165000    
 H    3.870200      -1.006800     -0.2898000    
 H   -3.872900      -1.024100      0.2153000    
 H    4.365500       1.849500      0.6916000    
 H    5.602700      0.6008000      0.4961000    
 H   -4.359700       1.888400     -0.5898000    
 H   -5.598200      0.6301000     -0.4860000    
 H    2.969600      0.3381000       2.321800    
 H    2.734500      -1.351000       1.892900    
 H    4.363300     -0.7580000       2.205100    
 H   -2.946200      0.4823000      -2.297200    
 H   -2.714300      -1.230300      -1.972800    
 H   -4.340200     -0.6191000      -2.264100    
 H    3.885400       1.822200      -1.737900    
 H    5.070500      0.5207000      -1.968900    
 H    5.601100       2.123600      -1.432100    
 H   -3.904700       1.708300       1.838000    
 H   -5.091300      0.3950000       1.974500    
 H   -5.617300       2.028500       1.534200    
 H   8.7700002E-02  0.8752000      0.9427000    
 H  -8.7499999E-02  0.9454000     -0.8462000    


%chk=000094427-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094427

0 1
O 2.215128 1.156256 0.499970
O -2.211187 1.107726 -0.233267
O 0.705353 0.343548 2.092168
O -0.413357 0.413914 -1.557775
C 3.318586 0.255855 1.011664
C -3.179099 0.269160 -1.041830
C 4.058434 -0.239379 -0.241010
C -4.212046 -0.254423 -0.032090
C 4.179880 1.072973 1.981451
C -3.762649 1.155127 -2.148724
C 3.180695 -1.119242 -1.156090
C -3.605227 -1.203533 1.021924
C -0.042572 1.934336 0.358880
C 0.970053 1.062909 1.101493
C -0.872049 1.071941 -0.595681
H 2.827980 -0.582825 1.541566
H -2.593474 -0.561229 -1.480028
H 4.432777 0.639846 -0.800521
H 4.948106 -0.806686 0.098787
H -4.693896 0.610799 0.463124
H -5.003049 -0.777055 -0.606157
H 4.612187 1.953682 1.474293
H 3.583049 1.416789 2.843607
H 5.009089 0.450323 2.364420
H -4.285882 2.026662 -1.716825
H -2.968307 1.515167 -2.824695
H -4.488086 0.577566 -2.750558
H 2.283343 -0.569427 -1.489888
H 2.844397 -2.031208 -0.627301
H 3.742692 -1.437725 -2.052534
H -2.814405 -0.694225 1.599744
H -3.156310 -2.094948 0.544642
H -4.377174 -1.552350 1.731035
H -0.711510 2.417024 1.086132
H 0.496632 2.691651 -0.232624


