%chk=000021844.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021844

0 1
 O   -2.274200     -0.7827000       1.698600    
 O    5.687200      -1.288900       1.085500    
 C   -1.602700       1.090300     -0.5430000    
 C   -2.445600     -0.2137000     -0.7058000    
 C  -0.1734000      0.8890000      2.7200000E-02
 C   0.5771000     -0.2340000     -0.7302000    
 C   -3.160900     -0.3368000      0.6753000    
 C   -1.607700      -1.448900      -1.106400    
 C   -2.463800       1.989200      0.3736000    
 C  -0.2013000      -1.541800     -0.5207000    
 C   0.6798000       2.182100      7.6499999E-02
 C   -3.544700       1.107800       1.008700    
 C    2.050100     -0.3429000     -0.3351000    
 C   -3.481100      1.6899999E-02  -1.847300    
 C    1.984900       1.875500      0.8332000    
 C    2.675600      0.6046000      0.3976000    
 C   0.9739000       2.802600      -1.295800    
 C    2.799000      -1.554000     -0.8496000    
 C   -4.345300      -1.209700      0.6700000    
 C    4.109600      0.5019000      0.8522000    
 C    4.311500      -1.387700     -0.8689000    
 C    4.764000     -0.7973000      0.4381000    
 C   -5.311800      -1.921700      0.6662000    
 H   -1.503700       1.572400      -1.522700    
 H  -0.2814000      0.5665000       1.073200    
 H   0.5633000     -7.7999998E-03  -1.806100    
 H   -1.486200      -1.454000      -2.199000    
 H   -2.156300      -2.369600     -0.8717000    
 H   -2.936300       2.785900     -0.2131000    
 H   -1.882800       2.479900       1.159600    
 H  -0.2326000      -1.801100      0.5428000    
 H   0.3004000      -2.380000      -1.018100    
 H   0.1533000       2.948300      0.6572000    
 H   -3.594600       1.284800       2.089800    
 H   -4.522100       1.381900      0.5922000    
 H   -4.160600      0.8495000      -1.640700    
 H   -2.971900      0.2486000      -2.790700    
 H   -4.088700     -0.8773000      -2.024500    
 H    1.765600       1.788600       1.905600    
 H    2.669700       2.725900      0.7241000    
 H   5.2299999E-02   3.104500      -1.801400    
 H    1.583900       3.705600      -1.180800    
 H    1.519100       2.123300      -1.957100    
 H    2.539900      -2.414500     -0.2201000    
 H    2.474600      -1.784400      -1.871400    
 H   -2.131500      -1.737500       1.583800    
 H    4.698000       1.320300      0.4233000    
 H    4.150600      0.5675000       1.945200    
 H    4.628100     -0.7172000      -1.675800    
 H    4.797000      -2.356700      -1.023400    
 H   -6.169100      -2.553400      0.6621000    


%chk=000021844-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021844

0 1
O -2.327506 -0.735695 1.755258
O 5.794012 -1.294907 1.047523
C -1.605297 1.126532 -0.512776
C -2.458009 -0.180471 -0.718851
C -0.165811 0.901578 0.030570
C 0.567855 -0.238487 -0.723535
C -3.240622 -0.310431 0.650663
C -1.639213 -1.452800 -1.087111
C -2.461337 2.025406 0.449041
C -0.215566 -1.558583 -0.490821
C 0.695709 2.198085 0.039906
C -3.622533 1.147774 1.003678
C 2.043931 -0.345930 -0.333378
C -3.488232 0.071074 -1.857819
C 1.982933 1.897880 0.847736
C 2.677088 0.615822 0.402535
C 1.038185 2.750054 -1.366337
C 2.792945 -1.577946 -0.835446
C -4.379545 -1.246857 0.606071
C 4.122190 0.478532 0.867623
C 4.326881 -1.360853 -0.910992
C 4.843187 -0.784657 0.398028
C -5.300631 -2.066627 0.597653
H -1.509221 1.616285 -1.502803
H -0.262758 0.574193 1.086469
H 0.521796 -0.032618 -1.820686
H -1.532336 -1.472139 -2.190712
H -2.235626 -2.353593 -0.831269
H -2.857346 2.917073 -0.069379
H -1.834790 2.390839 1.281435
H -0.236935 -1.763583 0.596821
H 0.296345 -2.414280 -0.970457
H 0.134127 2.987124 0.580957
H -3.740879 1.234369 2.096259
H -4.589943 1.403785 0.539841
H -4.124173 0.951641 -1.657408
H -2.951222 0.253346 -2.806895
H -4.150318 -0.801939 -1.999864
H 1.738610 1.829642 1.929872
H 2.694961 2.745286 0.753273
H 0.131465 2.936316 -1.970362
H 1.577936 3.711472 -1.279128
H 1.686794 2.053490 -1.927597
H 2.578789 -2.452532 -0.186791
H 2.422204 -1.852145 -1.843430
H -2.148294 -1.705628 1.652759
H 4.716647 1.350081 0.511269
H 4.184985 0.520970 1.973692
H 4.536849 -0.624350 -1.713900
H 4.865842 -2.295442 -1.142069
H -6.115926 -2.766354 0.593085


