%chk=000007713.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007713

0 1
 O    1.696200      0.6451000      0.8988000    
 O   -1.698100     -0.6655000      0.8926000    
 C   0.6752000     -0.3518000      0.9038000    
 C  -0.6804000      0.3282000      0.9082000    
 C    2.877200      0.3193000      0.3065000    
 C   -2.884900     -0.3239000      0.2995000    
 C    3.313100      -1.005700      0.3017000    
 C   -3.306600       1.000900      0.3161000    
 C    3.652300       1.310600     -0.2954000    
 C   -3.656100      -1.305700     -0.3124000    
 C    4.524200      -1.339400     -0.3047000    
 C   -4.515400       1.348400     -0.2872000    
 C    4.863200      0.9769000     -0.9020000    
 C   -4.864700     -0.9580000     -0.9158000    
 C    5.299100     -0.3482000     -0.9066000    
 C   -5.294300      0.3690000     -0.9031000    
 H   0.7231000     -0.9974000      1.6500000E-02
 H   0.7801000     -0.9829000       1.794500    
 H  -0.7256000      0.9844000      2.8500000E-02
 H  -0.7825000      0.9497000       1.806000    
 H    2.754500      -1.803100      0.7828000    
 H   -2.744900       1.788300      0.8091000    
 H    3.317800       2.344500     -0.2949000    
 H   -3.325200      -2.340300     -0.3245000    
 H    4.867200      -2.369900     -0.3031000    
 H   -4.853600       2.380400     -0.2718000    
 H    5.467000       1.748800      -1.370300    
 H   -5.471600      -1.720700      -1.395000    
 H    6.242700     -0.6078000      -1.377500    
 H   -6.236200      0.6393000      -1.371400    


%chk=000007713-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000007713

0 1
O 1.692349 0.680779 -0.043212
O -1.691514 -0.680032 -0.053989
C 0.668352 -0.370291 -0.054294
C -0.667504 0.371001 -0.048194
C 3.040645 0.277324 -0.046068
C -3.039852 -0.276450 -0.050856
C 3.467689 -1.073397 -0.058122
C -3.466782 1.074329 -0.042011
C 3.987914 1.330966 -0.035906
C -3.987159 -1.330078 -0.057354
C 4.853751 -1.357570 -0.059936
C -4.852833 1.358566 -0.040066
C 5.364071 1.029918 -0.037929
C -5.363301 -1.028958 -0.055281
C 5.806894 -0.316202 -0.049995
C -5.806027 0.317220 -0.046720
H 0.757985 -0.997823 -0.962752
H 0.755805 -1.015253 0.842143
H -0.757129 1.013237 -0.946328
H -0.754818 1.001355 0.858591
H 2.747269 -1.896793 -0.065831
H -2.746296 1.897684 -0.036407
H 3.626759 2.364075 -0.026698
H -3.626027 -2.363215 -0.064039
H 5.183817 -2.402572 -0.069287
H -5.182853 2.403602 -0.033295
H 6.093043 1.847956 -0.030079
H -6.092330 -1.846964 -0.060364
H 6.877363 -0.546192 -0.051602
H -6.876483 0.547280 -0.045220


