%chk=000085618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085618

0 1
 O  -0.2348000     -0.5515000     -0.1612000    
 O   -1.025800       1.587900     -0.4708000    
 C    1.080700     -0.1169000     -0.4402000    
 C    2.075300      -1.256000     -0.2891000    
 C    1.572500      0.8918000      0.5854000    
 C    3.414300     -0.5529000     -0.1062000    
 C    3.090900      0.8267000      0.4731000    
 C   -1.205700      0.4068000     -0.2096000    
 C   -2.530600     -0.1965000      0.1056000    
 C   -2.641900      -1.658500      0.4125000    
 C   -3.595000      0.6192000      0.1005000    
 H    1.135700      0.2910000      -1.458300    
 H    2.070100      -1.927800      -1.153100    
 H    1.835200      -1.865300      0.5913000    
 H    1.249600      0.6091000       1.595300    
 H    1.215000       1.909800      0.4075000    
 H    3.920600     -0.4394000      -1.071800    
 H    4.079700      -1.124600      0.5485000    
 H    3.567900      0.9804000       1.446400    
 H    3.460400       1.607700     -0.2013000    
 H   -2.295600      -2.256900     -0.4366000    
 H   -2.040200      -1.913700       1.291000    
 H   -3.675000      -1.954700      0.6241000    
 H   -4.587700      0.2397000      0.3223000    
 H   -3.520100       1.678600     -0.1209000    


%chk=000085618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085618

0 1
O -0.265691 -0.471591 -0.020348
O -1.151885 1.544372 -0.797721
C 1.108112 0.015323 -0.342606
C 2.053117 -1.193726 -0.438274
C 1.708421 0.881069 0.785832
C 3.465124 -0.568633 -0.249490
C 3.245808 0.757034 0.569281
C -1.323013 0.401380 -0.303425
C -2.643448 -0.221165 0.053992
C -2.658513 -1.609435 0.659607
C -3.764356 0.511382 -0.192903
H 1.051227 0.586654 -1.287806
H 1.945866 -1.747270 -1.386463
H 1.813873 -1.888546 0.388526
H 1.413260 0.437543 1.755807
H 1.344919 1.921106 0.758698
H 3.920688 -0.340809 -1.230157
H 4.146590 -1.266943 0.266485
H 3.782761 0.738965 1.533586
H 3.630879 1.624439 0.003663
H -2.177118 -2.340355 -0.014296
H -2.087988 -1.634688 1.605431
H -3.692553 -1.937468 0.860465
H -4.762107 0.123428 0.038895
H -3.688474 1.511936 -0.632378


