%chk=000007781.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007781

0 1
 O    2.827300      0.6227000      0.1317000    
 O    1.637200      -1.320500      0.4939000    
 C  -0.4000000       2.529400     -0.5135000    
 C   -1.507100       1.832200      0.3015000    
 C   0.8616000       1.675100     -0.7384000    
 C   -1.914000      0.4664000     -0.2614000    
 C  -5.0200000E-02   3.873000      0.1354000    
 C   -3.003000     -0.1828000      0.5998000    
 C    1.693300       1.395500      0.5082000    
 C   -3.456300      -1.516200      5.4200001E-02
 C   -2.418000      -2.594200     -6.8400003E-02
 C   -4.724500      -1.719400     -0.3351000    
 C    2.661800     -0.7364000      0.1691000    
 C    3.948000      -1.405000     -0.2563000    
 C    3.843800      -2.919800     -0.2207000    
 H  -0.8149000       2.745500      -1.507600    
 H   -1.176600       1.707800       1.340400    
 H   -2.389700       2.484100      0.3330000    
 H   0.6133000      0.7390000      -1.250200    
 H    1.507200       2.200700      -1.456600    
 H   -1.044000     -0.1963000     -0.2815000    
 H   -2.266400      0.5822000      -1.293500    
 H  -0.9228000       4.535500      0.1333000    
 H   0.7495000       4.378200     -0.4162000    
 H   0.2687000       3.754700       1.175900    
 H   -2.627900     -0.3316000       1.620200    
 H   -3.853800      0.5056000      0.6822000    
 H    1.109700      0.8997000       1.291700    
 H    2.079100       2.326000      0.9352000    
 H   -1.683400      -2.345000     -0.8401000    
 H   -2.861500      -3.559400     -0.3364000    
 H   -1.895100      -2.728500      0.8841000    
 H   -5.044900      -2.673700     -0.7400000    
 H   -5.471700     -0.9365000     -0.2594000    
 H    4.746700      -1.081100      0.4192000    
 H    4.185800      -1.081100      -1.275000    
 H    3.609400      -3.274100      0.7886000    
 H    4.789200      -3.374400     -0.5322000    
 H    3.055000      -3.275500     -0.8919000    


%chk=000007781-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007781

0 1
O 2.748261 0.511540 0.187009
O 1.313458 -1.327097 0.073262
C -0.405135 2.716367 -0.476853
C -1.490459 1.932337 0.315425
C 0.886588 1.887282 -0.742685
C -1.837775 0.543402 -0.266973
C -0.093274 4.067861 0.212509
C -2.994231 -0.152976 0.502743
C 1.586697 1.392188 0.532540
C -3.226121 -1.593148 0.055452
C -2.166969 -2.604893 0.462031
C -4.323601 -1.947063 -0.666802
C 2.463374 -0.838107 -0.036297
C 3.726401 -1.587946 -0.430386
C 3.580347 -3.115277 -0.300963
H -0.830105 2.941272 -1.478599
H -1.168183 1.812378 1.371803
H -2.408615 2.555304 0.351430
H 0.631682 1.008259 -1.362364
H 1.597683 2.502122 -1.327823
H -0.943975 -0.106548 -0.238087
H -2.127022 0.642967 -1.332938
H -1.005226 4.688291 0.291300
H 0.661536 4.644683 -0.354322
H 0.293013 3.919617 1.238964
H -2.746568 -0.141366 1.586158
H -3.923472 0.436304 0.377150
H 0.898403 0.814778 1.173549
H 2.047064 2.210433 1.107623
H -1.157396 -2.309381 0.119025
H -2.389360 -3.608572 0.060518
H -2.110698 -2.681983 1.566653
H -4.486310 -2.978681 -1.001367
H -5.090129 -1.212642 -0.943514
H 4.564221 -1.201443 0.177314
H 3.959080 -1.308164 -1.477574
H 3.417031 -3.412085 0.749689
H 4.492187 -3.619910 -0.665745
H 2.718396 -3.478300 -0.885655


