%chk=000076263.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076263

0 1
 O   -2.670500       2.034700      8.6800002E-02
 O    2.672300       2.031300      8.5000001E-02
 N   -2.808600     -0.5376000      0.5059000    
 N    2.807400     -0.5404000      0.5080000    
 C  -0.6981000      0.7378000      0.2983000    
 C   0.6984000      0.7371000      0.2984000    
 C   -1.397000     -0.4594000      0.4937000    
 C    1.395900     -0.4609000      0.4944000    
 C  -0.6967000       3.250600     -0.1120000    
 C   0.6998000       3.249800     -0.1122000    
 C   -1.446600       1.994800      9.3500003E-02
 C    1.448400       1.993000      9.2900001E-02
 C  -0.6980000      -1.651000      0.6884000    
 C   0.6955000      -1.651700      0.6889000    
 C   -1.394200       4.448700     -0.3073000    
 C    1.398800       4.447100     -0.3077000    
 C  -0.6938000       5.639500     -0.5017000    
 C   0.6997000       5.638800     -0.5018000    
 C   -3.707100      -1.558200      0.1480000    
 C    3.705300      -1.561400      0.1495000    
 C   -4.942800      -1.663200      0.7915000    
 C    4.941000      -1.667400      0.7927000    
 C   -3.368200      -2.472400     -0.8527000    
 C    3.365900      -2.474600     -0.8520000    
 C   -5.833800      -2.676100      0.4368000    
 C    5.831900      -2.679900      0.4365000    
 C   -4.259300      -3.485200      -1.207400    
 C    4.256800      -3.487100      -1.208000    
 C   -5.492100      -3.587000     -0.5626000    
 C    5.489800      -3.589600     -0.5638000    
 H   -1.206000      -2.592200      0.8806000    
 H    1.202400      -2.593400      0.8815000    
 H   -3.259800      0.2881000      0.8881000    
 H    3.259000      0.2847000      0.8910000    
 H   -2.480500       4.478600     -0.3119000    
 H    2.485100       4.475700     -0.3127000    
 H   -1.235500       6.568700     -0.6530000    
 H    1.242500       6.567400     -0.6533000    
 H   -5.221000     -0.9603000       1.572800    
 H    5.219600     -0.9652000       1.574500    
 H   -2.426900      -2.403400      -1.391200    
 H    2.424500      -2.404900      -1.390200    
 H   -6.793800      -2.755500      0.9386000    
 H    6.792000      -2.759800      0.9379000    
 H   -3.996200      -4.191000      -1.989700    
 H    3.993400      -4.192100      -1.991000    
 H   -6.186400      -4.374800     -0.8398000    
 H    6.184000      -4.377100     -0.8421000    


%chk=000076263-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076263

0 1
O -2.769783 2.059087 0.109808
O 2.771491 2.056882 0.108823
N -2.828974 -0.492135 0.162408
N 2.828741 -0.494226 0.162208
C -0.724351 0.754406 0.123036
C 0.725043 0.753865 0.122941
C -1.444782 -0.494354 0.179484
C 1.444566 -0.495411 0.179361
C -0.711234 3.287737 -0.028049
C 0.713852 3.287187 -0.028186
C -1.466513 2.018929 0.070254
C 1.468161 2.017806 0.070118
C -0.692986 -1.710368 0.343624
C 0.691915 -1.710878 0.343558
C -1.413861 4.518253 -0.112750
C 1.417421 4.517151 -0.113063
C -0.708402 5.731799 -0.201611
C 0.712891 5.731246 -0.201773
C -3.719982 -1.585856 0.016531
C 3.718841 -1.588715 0.016667
C -4.986042 -1.496073 0.659934
C 4.985217 -1.499540 0.659536
C -3.439883 -2.715453 -0.802708
C 3.437465 -2.718637 -0.801673
C -5.939267 -2.522566 0.504875
C 5.937564 -2.526883 0.504734
C -4.397150 -3.742427 -0.942182
C 4.393854 -3.746467 -0.940870
C -5.648420 -3.658076 -0.288160
C 5.645480 -3.662669 -0.287456
H -1.229357 -2.644607 0.528452
H 1.227642 -2.645512 0.528290
H -3.212911 0.491036 0.203763
H 3.213476 0.488654 0.203197
H -2.507416 4.487160 -0.106743
H 2.510953 4.485207 -0.107256
H -1.254165 6.679055 -0.270355
H 1.259374 6.678079 -0.270629
H -5.205891 -0.623327 1.285027
H 5.206011 -0.626568 1.283982
H -2.501916 -2.767178 -1.364087
H 2.499157 -2.770019 -1.362522
H -6.908295 -2.439016 1.009149
H 6.906866 -2.443783 1.008555
H -4.170564 -4.603034 -1.581609
H 4.166292 -4.607335 -1.579600
H -6.388488 -4.456783 -0.403924
H 6.384860 -4.462043 -0.403009


