%chk=000026420.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026420

0 1
 O   -3.509800       5.774900      0.3996000    
 O   -6.126700      -3.546300      0.1614000    
 O    7.536200     -0.1655000     -0.1091000    
 O   -4.052700       3.709800      0.9095000    
 O   -5.524200      -1.527000      0.7765000    
 O    6.079100       1.253300     -0.9355000    
 N  -0.9936000      5.9999999E-02 -0.2932000    
 N    1.302600      0.6534000      7.1599998E-02
 N   0.6552000      -1.656300      1.2600000E-02
 N   -3.229200       4.554700      0.4826000    
 N   -5.254000      -2.655100      0.2983000    
 N    6.353000      0.1930000     -0.3231000    
 C   1.1000000E-02  0.9337000     -0.1461000    
 C  -0.5963000      -1.219400     -0.2018000    
 C    1.551200     -0.6644000      0.1395000    
 C  -0.3375000       2.335300     -0.2319000    
 C   -1.615900      -2.224900     -0.3483000    
 C    2.917500      -1.053400      0.3722000    
 C   -1.604400       2.765100      0.1633000    
 C   -2.931900      -1.957400      4.2399999E-02
 C    3.967200     -0.2496000     -8.3800003E-02
 C   0.5939000       3.257000     -0.7102000    
 C   -1.297800      -3.477600     -0.8826000    
 C    3.205500      -2.238800       1.056300    
 C   -1.939700       4.116500      8.0300003E-02
 C   -3.919400      -2.932100     -0.1000000    
 C    5.290900     -0.6269000      0.1421000    
 C   0.2586000       4.608300     -0.7932000    
 C   -2.285300      -4.452400      -1.025000    
 C    4.529100      -2.616300       1.282100    
 C   -1.008300       5.038200     -0.3978000    
 C   -3.596100      -4.179600     -0.6336000    
 C    5.571800      -1.810300      0.8250000    
 H   -2.323500       2.044000      0.5461000    
 H   -3.177600     -0.9865000      0.4683000    
 H    3.743700      0.6673000     -0.6257000    
 H    1.585800       2.952300      -1.035000    
 H  -0.2878000      -3.718700      -1.205800    
 H    2.415800      -2.884300       1.433700    
 H   0.9832000       5.325600      -1.167700    
 H   -2.033900      -5.423100      -1.442600    
 H    4.747700      -3.536700       1.815700    
 H   -1.234400       6.098500     -0.4770000    
 H   -4.339100      -4.963000     -0.7599000    
 H    6.590500      -2.136000       1.019600    


%chk=000026420-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026420

0 1
O -3.661290 5.855694 -0.312894
O -6.373417 -3.446131 -0.126988
O 7.701300 0.084243 0.227267
O -4.317667 3.671298 -0.284437
O -5.752362 -1.251164 -0.133831
O 6.112625 1.718517 0.145925
N -1.003778 0.035062 -0.074141
N 1.344718 0.613856 -0.013297
N 0.671596 -1.710661 0.015044
N -3.413370 4.589493 -0.274044
N -5.483454 -2.511189 -0.116879
N 6.474509 0.480803 0.178272
C 0.016285 0.951366 -0.063880
C -0.631811 -1.283129 -0.034167
C 1.625518 -0.726381 0.025335
C -0.332726 2.392636 -0.111907
C -1.701634 -2.312341 -0.043516
C 3.052164 -1.135385 0.083754
C -1.690879 2.791272 -0.168080
C -3.062411 -1.919981 -0.076217
C 4.066303 -0.147581 0.102566
C 0.692088 3.378123 -0.102787
C -1.367715 -3.693653 -0.019320
C 3.408833 -2.510366 0.121280
C -1.986895 4.165145 -0.213356
C -4.051117 -2.919797 -0.083404
C 5.409350 -0.559073 0.157957
C 0.365252 4.749122 -0.148810
C -2.380513 -4.674865 -0.028373
C 4.764894 -2.895372 0.176028
C -0.983473 5.159327 -0.204765
C -3.739450 -4.297223 -0.060473
C 5.784687 -1.920382 0.194978
H -2.490970 2.047527 -0.176384
H -3.337085 -0.862790 -0.095228
H 3.807023 0.912763 0.074593
H 1.733754 3.048538 -0.059359
H -0.311004 -3.973428 0.006149
H 2.609567 -3.256447 0.106734
H 1.161055 5.499991 -0.141443
H -2.113561 -5.735933 -0.010201
H 5.030523 -3.956543 0.204446
H -1.270469 6.213504 -0.241728
H -4.548617 -5.032201 -0.067921
H 6.844024 -2.186966 0.237305


