%chk=000080792.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080792

0 1
 O   -1.787300      0.4536000      0.8617000    
 O   -2.205000       1.074100      -1.356500    
 C    2.994800      0.5081000     -0.1036000    
 C    1.689700     -0.2109000     -4.4199999E-02
 C    3.460300      0.9990000       1.280400    
 C    2.973600       1.686400      -1.095700    
 C   0.5434000      0.4582000      0.3846000    
 C    1.615500      -1.552900     -0.4174000    
 C  -0.6772000     -0.2145000      0.4401000    
 C  -0.7515000      -1.556500      6.7199998E-02
 C   0.3948000      -2.225700     -0.3617000    
 C   -2.049500      -2.292400      0.1198000    
 C   -2.501700       1.084600     -0.1691000    
 C   -3.700000       1.789000      0.3945000    
 H    3.766500     -0.1866000     -0.4627000    
 H   0.5862000       1.503700      0.6794000    
 H    2.790100       1.761600       1.691500    
 H    4.462600       1.436300       1.215300    
 H    3.501600      0.1686000       1.994000    
 H    2.664900       1.350600      -2.091900    
 H    3.970800       2.131100      -1.184700    
 H    2.283600       2.476100     -0.7792000    
 H    2.498700      -2.089200     -0.7542000    
 H   0.3530000      -3.270700     -0.6572000    
 H   -2.548000      -2.132100       1.081700    
 H   -2.708900      -1.956700     -0.6870000    
 H   -1.907100      -3.373000      1.0100000E-02
 H   -4.357600       1.065100      0.8819000    
 H   -4.252100       2.271800     -0.4168000    
 H   -3.377700       2.555700       1.103200    


%chk=000080792-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080792

0 1
O -1.771526 0.613027 0.742845
O -2.788632 0.630770 -1.373563
C 3.146639 0.506514 -0.064683
C 1.785860 -0.194614 -0.053100
C 3.528494 1.042882 1.340556
C 3.193771 1.642902 -1.120976
C 0.603463 0.505252 0.294131
C 1.664891 -1.564772 -0.391874
C -0.637253 -0.154179 0.292010
C -0.781508 -1.525852 -0.034952
C 0.409148 -2.211969 -0.378568
C -2.125989 -2.223069 -0.016594
C -2.797424 0.956464 -0.171594
C -3.858233 1.759653 0.548024
H 3.905174 -0.249393 -0.352507
H 0.631213 1.564712 0.571190
H 2.813056 1.815462 1.679018
H 4.534921 1.500936 1.321315
H 3.529756 0.232345 2.091381
H 2.955590 1.260940 -2.129834
H 4.198552 2.104158 -1.151067
H 2.463890 2.438580 -0.881323
H 2.563132 -2.132225 -0.663990
H 0.345496 -3.275445 -0.638126
H -2.702368 -1.967555 0.891656
H -2.735019 -1.920876 -0.888707
H -2.000268 -3.318462 -0.047887
H -4.278942 1.171117 1.381689
H -4.656738 2.034923 -0.155425
H -3.412646 2.670174 0.984454


