%chk=000006521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006521

0 1
 O  -0.6156000      0.3154000      0.4102000    
 O   0.3728000      0.6318000     -0.6118000    
 O   -1.962100       1.909300     -0.6341000    
 O    1.770600       1.219800       1.161400    
 O   -1.798700       2.695000      0.5756000    
 C   -1.881000      0.5521000     -0.2053000    
 C    1.636000      0.3947000      5.1000002E-03
 C   -2.045800     -0.3486000      -1.435900    
 C   -2.982600      0.2708000      0.8246000    
 C    1.728200      -1.073000      0.4420000    
 C    2.734800      0.7283000      -1.012000    
 C   -2.122600      -1.828500      -1.064800    
 C   -3.063600      -1.209000       1.197000    
 C    3.121000      -1.438800      0.9534000    
 C    4.127700      0.3667000     -0.4997000    
 C   -3.221200      -2.091000     -3.8400002E-02
 C    4.202100      -1.095000     -6.7299999E-02
 H   -1.235600     -0.2011000      -2.159300    
 H   -2.962900     -6.3299999E-02  -1.969100    
 H   -3.951300      0.6080000      0.4340000    
 H   -2.809100      0.8333000       1.750100    
 H    1.007300      -1.300900       1.236800    
 H    1.464900      -1.723900     -0.4020000    
 H    2.538700      0.2036000      -1.956000    
 H    2.708500       1.800200      -1.244800    
 H   -1.158100      -2.161000     -0.6632000    
 H   -2.313400      -2.423100      -1.965400    
 H   -3.909300      -1.371700       1.874700    
 H   -2.158600      -1.503100       1.742700    
 H    3.158600      -2.510400       1.180300    
 H    3.322200     -0.9088000       1.892400    
 H    4.389600       1.012700      0.3471000    
 H    4.868500      0.5565000      -1.284600    
 H   -4.199900      -1.902800     -0.4969000    
 H   -3.205100      -3.146100      0.2572000    
 H    5.190400      -1.304200      0.3574000    
 H    4.089600      -1.740500     -0.9472000    
 H    1.303000      0.7929000       1.898600    
 H   -2.722700       2.994400      0.6259000    


%chk=000006521-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006521

0 1
O -0.641743 -0.605910 0.323663
O 0.430581 -0.485693 -0.787317
O -1.512712 1.641007 0.037003
O 1.568167 1.402615 0.233058
O -0.919579 1.955023 1.439623
C -1.811925 0.197423 -0.004170
C 1.685737 0.016543 -0.132818
C -2.311538 0.016496 -1.454785
C -2.846616 -0.231534 1.061789
C 2.069110 -0.878439 1.066303
C 2.708266 -0.072974 -1.284063
C -2.799040 -1.437835 -1.669000
C -3.367511 -1.666271 0.806614
C 3.490659 -0.530118 1.568642
C 4.126452 0.272870 -0.766091
C -3.885333 -1.834019 -0.641796
C 4.529548 -0.627678 0.425691
H -1.488306 0.264612 -2.144057
H -3.141384 0.726676 -1.628669
H -3.678417 0.496444 1.001998
H -2.393398 -0.141235 2.063709
H 1.322222 -0.753484 1.870052
H 2.030021 -1.934914 0.737686
H 2.689558 -1.100466 -1.692755
H 2.398486 0.626030 -2.080232
H -1.934103 -2.121993 -1.579234
H -3.187935 -1.532748 -2.700417
H -4.170593 -1.894753 1.533045
H -2.545922 -2.384221 0.988208
H 3.765248 -1.206657 2.400785
H 3.487055 0.502415 1.969250
H 4.135708 1.332464 -0.448355
H 4.851766 0.166866 -1.595548
H -4.782188 -1.196839 -0.790126
H -4.202224 -2.880826 -0.810306
H 5.532369 -0.339446 0.795979
H 4.601579 -1.681704 0.084001
H 0.778910 1.542203 0.835980
H -1.165674 2.920770 1.475359


