%chk=000085267.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085267

0 1
 O    4.108600     -0.5914000      -1.598300    
 O   -4.108300     -0.5834000       1.598300    
 N    3.536700      0.7712000      0.1743000    
 N   -3.548200      0.7725000     -0.1831000    
 C   0.7517000       1.905500      0.2170000    
 C  -0.7212000       1.860800     -0.1971000    
 C    1.671600       1.866800      -1.008200    
 C   -1.689800       1.889800      0.9910000    
 C    3.149300       1.897000     -0.6304000    
 C   -3.168300       1.905900      0.6140000    
 C    3.997200     -0.4135000     -0.3860000    
 C   -3.999400     -0.4123000      0.3848000    
 C    4.355900      -1.485300      0.6035000    
 C   -4.351300      -1.492700     -0.5976000    
 C    3.663300      -1.589400       1.928200    
 C   -3.659200      -1.600000      -1.922400    
 C    5.325000      -2.344500      0.2511000    
 C   -5.313700      -2.357000     -0.2390000    
 H   0.9611000       1.054400      0.8756000    
 H   0.9446000       2.817800      0.7939000    
 H  -0.8965000      0.9533000     -0.7877000    
 H  -0.9375000       2.712900     -0.8533000    
 H    1.453900       2.725100      -1.655100    
 H    1.461200      0.9620000      -1.591800    
 H   -1.490500       1.017000       1.625800    
 H   -1.479200       2.776200       1.601800    
 H    3.760800       1.921000      -1.539200    
 H    3.375200       2.800900     -5.4400001E-02
 H   -3.781500       1.936600       1.521400    
 H   -3.395700       2.802700      2.7799999E-02
 H    3.473200      0.8690000       1.182600    
 H   -3.484100      0.8639000      -1.191900    
 H    3.878800      -2.539000       2.429800    
 H    2.577800      -1.529500       1.796300    
 H    3.980300     -0.7816000       2.595200    
 H   -3.868400      -2.554200      -2.418000    
 H   -2.574000      -1.531600      -1.792000    
 H   -3.982700     -0.7987000      -2.594100    
 H    5.635200      -3.142100      0.9189000    
 H    5.840800      -2.278400     -0.7013000    
 H   -5.618700      -3.160800     -0.9015000    
 H   -5.828900      -2.288700      0.7135000    


%chk=000085267-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085267

0 1
O 4.313090 -0.345069 -1.515790
O -4.310945 -0.336236 1.520145
N 3.597940 0.738038 0.408798
N -3.599279 0.732727 -0.413640
C 0.719287 1.967901 0.269113
C -0.723994 1.961559 -0.283641
C 1.790948 1.982109 -0.842195
C -1.795978 1.992779 0.826992
C 3.245712 1.973307 -0.313096
C -3.250509 1.975334 0.297276
C 4.110993 -0.367140 -0.258484
C -4.108831 -0.368296 0.263062
C 4.415907 -1.576661 0.604180
C -4.410563 -1.585748 -0.589567
C 4.144430 -1.530889 2.099336
C -4.141117 -1.550888 -2.085394
C 4.928983 -2.672672 -0.015466
C -4.919273 -2.678553 0.039263
H 0.859603 1.073088 0.910307
H 0.854834 2.853703 0.926038
H -0.862510 1.055319 -0.908879
H -0.861179 2.835430 -0.956064
H 1.660313 2.887924 -1.469289
H 1.660392 1.109962 -1.511261
H -1.665298 1.131135 1.509512
H -1.666017 2.908335 1.439879
H 3.943281 2.058030 -1.164607
H 3.411538 2.832601 0.365019
H -3.948736 2.066155 1.147629
H -3.418116 2.827900 -0.388829
H 3.422582 0.686614 1.411870
H -3.423605 0.673145 -1.416205
H 4.419105 -2.487319 2.574252
H 3.072592 -1.352518 2.317820
H 4.731056 -0.735200 2.600051
H -4.413023 -2.512009 -2.552376
H -3.070201 -1.370513 -2.306764
H -4.731213 -0.761267 -2.591589
H 5.177289 -3.585747 0.536718
H 5.104395 -2.651715 -1.096503
H -5.165092 -3.596749 -0.505494
H -5.093691 -2.649706 1.120275


