%chk=000021185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021185

0 1
 O    4.670600     -0.7811000       1.392300    
 O    3.794000      -1.973100     -0.8549000    
 O   -5.933500     -0.1037000     -0.1037000    
 C    2.531000      0.3721000      0.8685000    
 C    1.974800      0.8974000     -0.4768000    
 C   0.4389000      0.9111000     -0.6414000    
 C    3.999600      6.7000002E-02  0.4775000    
 C    2.656000      1.8700000E-02  -1.557400    
 C    3.935700     -0.5538000     -0.9271000    
 C  -0.2469000     -0.3557000     -7.6499999E-02
 C    1.768800     -0.8704000       1.373700    
 C   0.2517000     -0.6982000       1.339100    
 C  -0.2001000       2.173100     -4.0199999E-02
 C    2.526100       1.452100       1.967800    
 C   -1.764600     -0.2549000     -9.4999999E-02
 C   -1.671300       2.266500     -0.4368000    
 C    5.184200     -0.2611000      -1.752700    
 C   -2.426200      0.9797000     -0.2288000    
 C   -2.530100      -1.427300      3.6200002E-02
 C   -3.830100       1.015200     -0.2359000    
 C   -3.923700      -1.377200      3.6800001E-02
 C   -4.573800     -0.1555000     -9.8200001E-02
 C   -6.631300      -1.340800      3.3399999E-02
 H    2.348400       1.919300     -0.6388000    
 H   0.2308000      0.9516000      -1.721700    
 H    4.562100       1.009400      0.4256000    
 H    1.995300     -0.7882000      -1.894500    
 H    2.872600      0.6400000      -2.434800    
 H   2.2200000E-02  -1.190200     -0.7394000    
 H    2.079500      -1.113900       2.397600    
 H    2.011500      -1.753000      0.7740000    
 H  -0.2041000      -1.635300       1.683400    
 H  -6.3600004E-02  6.4800002E-02   2.060000    
 H   0.3194000       3.073300     -0.3894000    
 H  -0.1307000       2.170100       1.050800    
 H    2.994200       2.379000       1.617900    
 H    1.519600       1.701900       2.307700    
 H    3.083000       1.117200       2.850000    
 H   -1.744300       2.536700      -1.497800    
 H   -2.139900       3.072000      0.1413000    
 H    5.338800      0.8145000      -1.885900    
 H    6.075600     -0.6814000      -1.273600    
 H    5.112000     -0.7255000      -2.742700    
 H    4.681600     -0.3367000       2.256300    
 H    4.548100      -2.319300     -0.3478000    
 H   -2.038300      -2.392100      0.1382000    
 H   -4.346800       1.965300     -0.3547000    
 H   -4.436300      -2.327000      0.1445000    
 H   -6.427500      -2.013000     -0.8070000    
 H   -7.701900      -1.112600      7.7999998E-03
 H   -6.427900      -1.812400       1.000900    


%chk=000021185-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021185

0 1
O 4.781641 -0.838084 1.331819
O 3.900299 -2.009699 -0.846004
O -6.005769 -0.069041 -0.087411
C 2.570635 0.403367 0.879185
C 1.991018 0.894756 -0.496711
C 0.442636 0.927220 -0.633847
C 4.043052 0.093854 0.463166
C 2.672781 -0.016505 -1.569733
C 4.006080 -0.537501 -0.966422
C -0.228526 -0.364448 -0.083843
C 1.823734 -0.875809 1.362284
C 0.289392 -0.698722 1.347034
C -0.222037 2.182582 -0.014301
C 2.561608 1.488017 1.983922
C -1.757162 -0.278679 -0.116687
C -1.699051 2.272359 -0.447977
C 5.258211 -0.194999 -1.792701
C -2.452813 0.960398 -0.245733
C -2.518940 -1.464903 0.008640
C -3.864802 0.973290 -0.225655
C -3.930179 -1.461878 0.021500
C -4.606210 -0.222112 -0.092139
C -6.813407 -1.282688 0.037186
H 2.357144 1.933307 -0.652867
H 0.227192 0.973403 -1.725099
H 4.597957 1.056726 0.416900
H 2.050760 -0.898106 -1.803432
H 2.833910 0.534267 -2.513523
H 0.077084 -1.214558 -0.730153
H 2.157192 -1.137030 2.387247
H 2.100154 -1.724788 0.709783
H -0.192929 -1.631424 1.696971
H -0.028891 0.092388 2.054236
H 0.318518 3.093118 -0.339999
H -0.163726 2.152281 1.089907
H 2.961571 2.449069 1.608390
H 1.549609 1.676078 2.379950
H 3.188615 1.178721 2.846725
H -1.739840 2.542597 -1.524490
H -2.215457 3.087961 0.093732
H 5.326309 0.892349 -1.987655
H 6.174070 -0.510839 -1.260099
H 5.219756 -0.723129 -2.761352
H 4.641375 -0.599984 2.280605
H 4.440725 -2.254447 -0.044293
H -1.993020 -2.424892 0.092174
H -4.415540 1.916177 -0.319303
H -4.476623 -2.404921 0.115898
H -6.635936 -1.975535 -0.808957
H -7.857643 -0.936943 0.019381
H -6.611324 -1.808025 0.991548


