%chk=000084329.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084329

0 1
 O    2.781100     -1.5600000E-02  0.2590000    
 C   0.4111000     -3.0500000E-02 -8.5400000E-02
 C  -0.7288000     -3.5100002E-02  -1.111400    
 C    1.780400     -3.7000000E-03 -0.7498000    
 C   -2.071900     -1.2700000E-02 -0.4635000    
 C    4.087200      8.3999997E-03 -0.3010000    
 C    5.106500     -5.9000002E-03  0.8278000    
 C   -2.711200      -1.210000     -0.1420000    
 C   -2.688700       1.205600     -0.1784000    
 C    6.530600      3.3599999E-02  0.3034000    
 C   -3.967400      -1.189300      0.4642000    
 C   -3.944800       1.226300      0.4279000    
 C   -4.584100      2.8899999E-02  0.7491000    
 H   0.3405000     -0.9113000      0.5663000    
 H   0.3197000      0.8349000      0.5841000    
 H  -0.6288000      0.8291000      -1.781000    
 H  -0.6427000     -0.9184000      -1.757500    
 H    1.900500     -0.8813000      -1.395900    
 H    1.883600      0.9016000      -1.359500    
 H    4.209600      0.9144000     -0.9062000    
 H    4.227200     -0.8680000     -0.9446000    
 H    4.931300      0.8484000       1.492700    
 H    4.960800     -0.9016000       1.443600    
 H   -2.240400      -2.165700     -0.3569000    
 H   -2.200300       2.145500     -0.4219000    
 H    6.708200      0.9413000     -0.2821000    
 H    7.241700      2.1800000E-02   1.135400    
 H    6.738500     -0.8324000     -0.3331000    
 H   -4.465000      -2.121500      0.7150000    
 H   -4.424900       2.174800      0.6504000    
 H   -5.562000      4.5100000E-02   1.221300    


%chk=000084329-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084329

0 1
O 2.801479 0.008064 0.208481
C 0.407735 0.010000 -0.154395
C -0.759960 -0.003750 -1.179347
C 1.777602 0.003387 -0.840321
C -2.122417 -0.001875 -0.500633
C 4.166942 0.003597 -0.329548
C 5.138533 0.004304 0.855847
C -2.758029 -1.219337 -0.143778
C -2.770383 1.217307 -0.173113
C 6.613313 0.001522 0.397764
C -4.004277 -1.220896 0.522557
C -4.016681 1.222082 0.493187
C -4.638755 0.001450 0.844161
H 0.334930 -0.870299 0.511234
H 0.332074 0.904964 0.491006
H -0.667156 0.879995 -1.841594
H -0.661024 -0.900145 -1.823486
H 1.891553 -0.901401 -1.482524
H 1.895008 0.899138 -1.494415
H 4.328298 0.901978 -0.969840
H 4.324137 -0.898799 -0.965230
H 4.930526 0.893614 1.479811
H 4.928249 -0.882251 1.482952
H -2.273464 -2.171757 -0.394256
H -2.295642 2.168357 -0.446544
H 6.846261 0.894439 -0.212864
H 7.296225 0.000984 1.265979
H 6.843274 -0.893084 -0.211544
H -4.481166 -2.171749 0.787085
H -4.503284 2.174101 0.734878
H -5.606401 0.002762 1.358488


