%chk=000039879.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039879

0 1
 O   -2.553300       1.708800      0.2136000    
 O    4.129400      0.3955000     -0.1765000    
 O    2.513000      0.2081000       1.406600    
 C   0.4843000     -0.1863000     -0.5399000    
 C   -1.292700      -1.720900      2.9700000E-02
 C   2.9700000E-02  -1.491300     -0.3497000    
 C    1.898300      5.9200000E-02 -0.9451000    
 C  -0.3837000      0.8892000     -0.3507000    
 C   -1.706200      0.6595000      2.8800000E-02
 C   -2.160700     -0.6456000      0.2189000    
 C   -1.778700      -3.116100      0.2332000    
 C    2.843500      0.2235000      0.2289000    
 C   -2.022900       3.016400      2.3000001E-03
 H   0.7069000      -2.330000     -0.4932000    
 H    1.960300      0.9634000      -1.562600    
 H    2.258000     -0.7760000      -1.558400    
 H   2.2900000E-02   1.882500     -0.5093000    
 H   -3.192200     -0.8176000      0.5165000    
 H   -1.606500      -3.426400       1.268600    
 H   -2.849200      -3.198300      1.6100001E-02
 H   -1.262500      -3.815000     -0.4337000    
 H   -1.709300       3.160700      -1.037300    
 H   -1.222700       3.246300      0.7141000    
 H   -2.833100       3.728100      0.1926000    
 H    4.740600      0.5023000      0.5833000    


%chk=000039879-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039879

0 1
O -2.486273 1.686416 0.335356
O 3.722888 -0.067844 0.633452
O 2.722083 1.955510 0.093931
C 0.562821 -0.300833 -0.602139
C -1.310179 -1.792655 -0.022911
C 0.038634 -1.599131 -0.434714
C 2.010451 -0.112994 -1.070366
C -0.250663 0.835384 -0.355502
C -1.587962 0.644189 0.057307
C -2.115796 -0.662636 0.219717
C -1.864305 -3.196573 0.152278
C 2.818993 0.721398 -0.090401
C -1.991741 3.058924 0.196348
H 0.677378 -2.471350 -0.620378
H 2.022043 0.423385 -2.037716
H 2.498945 -1.090049 -1.203766
H 0.177461 1.835468 -0.473022
H -3.157746 -0.767021 0.539417
H -1.282297 -3.765322 0.901625
H -2.916036 -3.178132 0.484609
H -1.818408 -3.765858 -0.795203
H -1.683892 3.271821 -0.845918
H -1.140996 3.251636 0.878060
H -2.842387 3.699939 0.470753
H 4.210183 0.506327 1.285982


