%chk=000085992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085992

0 1
 O    1.192100     -9.7700000E-02 -0.1417000    
 O    2.425100      -1.201700       1.456200    
 C   -1.228900      5.6499999E-02 -0.2483000    
 C   -2.514900     -0.5608000      0.3408000    
 C   -1.240200       1.600400     -0.3109000    
 C  -8.2000000E-03 -0.4895000      0.5104000    
 C   -3.782700     -0.1976000     -0.4392000    
 C    3.574200     -3.5200000E-02 -0.3580000    
 C   -5.054300     -0.8010000      0.1633000    
 C   -1.361800       2.301800       1.034900    
 C    2.359500     -0.5232000      0.4382000    
 C    3.575600       1.498700     -0.4016000    
 C    4.863400     -0.5164000      0.3270000    
 C    3.520800     -0.6112000      -1.779400    
 C   -6.319600     -0.4231000     -0.5915000    
 H   -1.139900     -0.2865000      -1.288900    
 H   -2.629700     -0.2612000       1.389400    
 H   -2.416700      -1.654200      0.3440000    
 H   -2.050600       1.941500     -0.9645000    
 H  -0.3161000       1.943900     -0.7929000    
 H  -1.6000000E-03 -0.1391000       1.548600    
 H  -5.0099999E-02  -1.585900      0.5222000    
 H   -3.908200      0.8901000     -0.4634000    
 H   -3.678400     -0.5319000      -1.478500    
 H   -4.964600      -1.893700      0.1805000    
 H   -5.153800     -0.4736000       1.205100    
 H  -0.5211000       2.065200       1.692700    
 H   -1.366400       3.387000      0.8872000    
 H   -2.291700       2.035900       1.545300    
 H    3.558500       1.921200      0.6096000    
 H    4.466000       1.880500     -0.9133000    
 H    2.698200       1.888300     -0.9303000    
 H    4.936100     -0.1326000       1.351300    
 H    5.752900     -0.1823000     -0.2189000    
 H    4.898200      -1.610600      0.3849000    
 H    2.640600     -0.2542000      -2.326100    
 H    4.407000     -0.3259000      -2.357100    
 H    3.467500      -1.705800      -1.758700    
 H   -7.194700     -0.8816000     -0.1206000    
 H   -6.462900      0.6620000     -0.5945000    
 H   -6.271400     -0.7662000      -1.629700    


%chk=000085992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085992

0 1
O 1.218249 -0.121081 -0.150123
O 2.458254 -1.157328 1.518973
C -1.221224 0.052735 -0.223785
C -2.536460 -0.546372 0.348702
C -1.196426 1.608756 -0.251690
C -0.032765 -0.530951 0.555090
C -3.813054 -0.129174 -0.415458
C 3.633699 -0.039799 -0.381743
C -5.085027 -0.825410 0.121230
C -1.450194 2.298385 1.108555
C 2.422185 -0.508137 0.446984
C 3.587733 1.509869 -0.518056
C 4.931124 -0.477953 0.337118
C 3.554433 -0.690069 -1.794326
C -6.364354 -0.407829 -0.635421
H -1.121092 -0.295142 -1.274052
H -2.643388 -0.266446 1.417076
H -2.460319 -1.654094 0.328712
H -1.950914 1.961651 -0.981254
H -0.212221 1.926921 -0.645558
H 0.015705 -0.165606 1.597554
H -0.065484 -1.636230 0.583580
H -3.951926 0.968878 -0.352230
H -3.692138 -0.367619 -1.493175
H -4.955367 -1.925004 0.053792
H -5.199397 -0.592338 1.199828
H -0.705824 1.998088 1.869056
H -1.385056 3.396624 1.001849
H -2.453945 2.062157 1.506786
H 3.631252 2.000012 0.471920
H 4.457894 1.853217 -1.107532
H 2.665277 1.834979 -1.028278
H 4.998531 -0.034076 1.345536
H 5.809003 -0.153532 -0.251141
H 4.970643 -1.574647 0.454932
H 2.630528 -0.389676 -2.316503
H 4.423443 -0.367152 -2.396818
H 3.576533 -1.793292 -1.726988
H -7.258713 -0.916298 -0.230780
H -6.532313 0.683144 -0.558561
H -6.289687 -0.659862 -1.710199


