%chk=000081258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081258

0 1
 O  -6.2199999E-02 -0.7786000      0.6824000    
 O    3.264500      0.5415000      2.8700000E-02
 O    4.846900      -1.092700     -0.3744000    
 C   0.9439000      0.2200000      0.5211000    
 C   -1.339000     -0.4284000      0.3663000    
 C   -3.955600      0.2879000     -0.2838000    
 C    2.265700     -0.4550000      0.2095000    
 C   -2.228900      -1.392600     -0.1070000    
 C   -1.757300      0.8938000      0.5146000    
 C   -3.537200      -1.034400     -0.4322000    
 C   -3.065700       1.252100      0.1896000    
 C   -5.354400      0.6710000     -0.6304000    
 C    4.518700      8.0499999E-02 -0.2606000    
 C    5.460400       1.235000     -0.4239000    
 H   0.7166000      0.9073000     -0.3050000    
 H    1.032000      0.8074000       1.442800    
 H    2.169800      -1.060300     -0.7003000    
 H    2.545300      -1.124300       1.032300    
 H   -1.908600      -2.424200     -0.2245000    
 H   -1.105200       1.669000      0.9059000    
 H   -4.221600      -1.795100     -0.7984000    
 H   -3.382700       2.283900      0.3168000    
 H   -5.404000       1.705600     -0.9866000    
 H   -5.750900      3.7599999E-02  -1.431300    
 H   -5.999900      0.5709000      0.2478000    
 H    5.509500       1.807400      0.5057000    
 H    5.129000       1.869200      -1.249900    
 H    6.460900      0.8574000     -0.6539000    


%chk=000081258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081258

0 1
O -0.012015 -0.792018 -0.101010
O 3.397380 0.536221 0.004445
O 5.019294 -1.135484 -0.043167
C 1.026254 0.242946 -0.048109
C -1.354155 -0.361502 -0.107633
C -4.131527 0.287600 -0.129036
C 2.349227 -0.518085 -0.052761
C -2.323775 -1.392872 -0.156473
C -1.761549 0.992212 -0.069057
C -3.691529 -1.064816 -0.166546
C -3.143774 1.298745 -0.080180
C -5.613164 0.624086 -0.143683
C 4.724772 0.078037 0.003015
C 5.683585 1.246388 0.064765
H 0.958281 0.912255 -0.928750
H 0.928496 0.849477 0.874221
H 2.473681 -1.119361 -0.969633
H 2.441730 -1.184691 0.821797
H -1.984882 -2.433187 -0.185012
H -1.031532 1.806432 -0.030101
H -4.433485 -1.872039 -0.204026
H -3.452572 2.350735 -0.049763
H -5.780268 1.712907 -0.075021
H -6.099357 0.268608 -1.072114
H -6.144306 0.149047 0.702713
H 5.508123 1.834258 0.982315
H 5.518764 1.920350 -0.793510
H 6.718305 0.875651 0.053614


