%chk=000005538.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005538

0 1
 O    7.977100       1.360500       1.205600    
 O    8.017900     -0.1979000     -0.4553000    
 C   -4.898500     -0.8278000      0.4509000    
 C   -6.289300     -0.1446000      0.3417000    
 C   -6.232000       1.333300      0.6841000    
 C   -3.788600      3.4899998E-02 -0.1949000    
 C   -5.293700       2.053800     -0.2721000    
 C   -3.989100       1.331300     -0.5415000    
 C   -5.044000      -2.204300     -0.2428000    
 C   -4.569200      -1.062000       1.943100    
 C   -2.508300     -0.6272000     -0.3835000    
 C   -2.982600       2.229000      -1.223600    
 C   -1.329500     -2.8200001E-02 -0.1481000    
 C  -5.2999998E-03 -0.6280000     -0.3145000    
 C   5.4200001E-02  -2.059100     -0.7977000    
 C    1.156000      1.5400000E-02 -6.4599998E-02
 C    2.512900     -0.4842000     -0.1962000    
 C    3.590800      0.2676000      8.8000000E-02
 C    4.998100     -0.1366000     -1.4700000E-02
 C    5.279600      -1.547400     -0.4638000    
 C    5.939900      0.7689000      0.3186000    
 C    7.403600      0.5527000      0.2815000    
 H   -7.014000     -0.6424000      0.9986000    
 H   -6.679600     -0.2503000     -0.6803000    
 H   -5.898600       1.476100       1.718300    
 H   -7.233700       1.773200      0.6161000    
 H   -5.086700       3.049200      0.1403000    
 H   -5.805100       2.206500      -1.231300    
 H   -5.139500      -2.095400      -1.329400    
 H   -4.194500      -2.865100     -3.9299998E-02
 H   -5.936700      -2.730200      0.1169000    
 H   -5.375000      -1.610300       2.444700    
 H   -3.653200      -1.652200       2.063600    
 H   -4.420700     -0.1195000       2.481200    
 H   -2.537600      -1.638400     -0.7717000    
 H   -2.254800       1.687400      -1.833000    
 H   -2.465200       2.856200     -0.4912000    
 H   -3.495700       2.897800      -1.925600    
 H   -1.301900      0.9745000      0.2724000    
 H  -0.4004000      -2.136500      -1.792600    
 H    1.042700      -2.507800     -0.8824000    
 H  -0.5052000      -2.708300     -0.1133000    
 H    1.087400       1.047100      0.2828000    
 H    2.664800      -1.495800     -0.5452000    
 H    3.423400       1.288500      0.4323000    
 H    4.969000      -1.687600      -1.504900    
 H    6.331900      -1.828300     -0.3970000    
 H    4.742800      -2.267600      0.1642000    
 H    5.641700       1.756000      0.6690000    
 H    8.953500       1.266200       1.220200    


%chk=000005538-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000005538

0 1
O 8.123166 1.757084 0.717465
O 8.134378 -0.470737 0.057727
C -4.952589 -0.821069 0.403537
C -6.333750 -0.102754 0.347209
C -6.253766 1.372674 0.772371
C -3.816640 0.081001 -0.165930
C -5.345638 2.123381 -0.216408
C -4.031530 1.406999 -0.502221
C -5.090288 -2.132999 -0.428516
C -4.615417 -1.200691 1.876631
C -2.515092 -0.590912 -0.324724
C -3.027802 2.286821 -1.229140
C -1.261063 -0.039841 -0.148297
C 0.006376 -0.743027 -0.304813
C -0.009891 -2.200747 -0.729186
C 1.182970 -0.036039 -0.056407
C 2.535704 -0.519171 -0.149419
C 3.643086 0.269380 0.122209
C 5.031285 -0.163968 0.042131
C 5.340149 -1.592149 -0.369957
C 6.013156 0.768994 0.351802
C 7.461188 0.560735 0.340108
H -7.046619 -0.661946 0.984293
H -6.724133 -0.149865 -0.690668
H -5.843310 1.453876 1.797564
H -7.261176 1.829934 0.791413
H -5.113721 3.141678 0.160006
H -5.884483 2.282654 -1.176840
H -5.168773 -1.914117 -1.509473
H -4.246007 -2.828422 -0.273163
H -6.008763 -2.668090 -0.121030
H -5.367720 -1.907862 2.275486
H -3.621666 -1.680109 1.944679
H -4.597669 -0.308926 2.529028
H -2.557916 -1.664417 -0.552056
H -2.267760 1.705858 -1.775863
H -2.496792 2.968144 -0.533206
H -3.561498 2.936359 -1.950423
H -1.185744 1.008536 0.169469
H -0.515066 -2.320641 -1.706040
H 1.000356 -2.627586 -0.819156
H -0.568870 -2.815713 0.001937
H 1.073364 1.017081 0.247069
H 2.699400 -1.561452 -0.450313
H 3.472924 1.313822 0.424584
H 4.923156 -1.802679 -1.372974
H 6.423557 -1.774011 -0.391859
H 4.873455 -2.306559 0.334487
H 5.709853 1.781736 0.641026
H 9.102728 1.582853 0.699450


