%chk=000086893.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086893

0 1
 O   -3.733100      0.9019000     -0.1350000    
 O   -3.959300      -1.206700      0.7815000    
 C   0.5087000       1.971200      0.2588000    
 C    1.234800       2.798300     -0.8037000    
 C   -1.017300       2.064800      0.1635000    
 C    2.161500      -1.851400       1.081500    
 C    3.692200      -1.829700      0.9701000    
 C    2.754400       2.677600     -0.6611000    
 C    1.467800      -2.371800     -0.1802000    
 C    4.259300     -0.8849000     -9.6299998E-02
 C   -1.799300       1.313900       1.247700    
 C  -5.3100001E-02  -2.466500     -3.3700000E-02
 C    3.192700       1.254800     -0.8446000    
 C    3.824500      0.5388000      9.7000003E-02
 C   -3.314600       1.416100       1.120500    
 C  -0.7408000      -3.058400      -1.255300    
 C   -4.026500     -0.4342000     -0.1652000    
 C   -4.451900     -0.8336000      -1.545500    
 H   0.8257000       2.299700       1.256200    
 H   0.7771000      0.9142000      0.1686000    
 H   0.9226000       2.473700      -1.804100    
 H   0.9507000       3.852900     -0.7066000    
 H   -1.323100       1.692800     -0.8224000    
 H   -1.307500       3.122700      0.1981000    
 H    1.895000      -2.505000       1.921900    
 H    1.782000     -0.8572000       1.339000    
 H    4.054400      -2.845500      0.7685000    
 H    4.101400      -1.546400       1.948600    
 H    3.239500       3.296500      -1.424500    
 H    3.068700       3.068300      0.3141000    
 H    1.695500      -1.717500      -1.029100    
 H    1.867200      -3.363400     -0.4263000    
 H    5.354400     -0.9177000     -4.3299999E-02
 H    3.990100      -1.248100      -1.094900    
 H   -1.506700      0.2592000       1.218200    
 H   -1.502300       1.698100       2.230800    
 H  -0.2995000      -3.079800      0.8411000    
 H  -0.4602000      -1.467700      0.1504000    
 H    2.978100      0.7973000      -1.807500    
 H    4.050600      0.9971000       1.056500    
 H   -3.621200       2.467000       1.161900    
 H   -3.814200      0.9101000       1.955000    
 H  -0.3842000      -4.074600      -1.450300    
 H   -1.823300      -3.100100      -1.098900    
 H  -0.5480000      -2.449200      -2.144000    
 H   -5.348100     -0.2781000      -1.832700    
 H   -4.684400      -1.902300      -1.558400    
 H   -3.638800     -0.6461000      -2.251400    


%chk=000086893-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086893

0 1
O -3.843685 0.913385 -0.300063
O -3.825849 -1.260262 0.553466
C 0.389788 2.100901 0.409888
C 1.194839 2.943253 -0.604442
C -1.138456 2.244912 0.238855
C 2.403080 -2.005612 1.032358
C 3.913193 -1.950933 0.696699
C 2.732143 2.728820 -0.509872
C 1.500266 -2.478118 -0.130312
C 4.294793 -0.929515 -0.414486
C -1.934019 1.388944 1.248985
C 0.014009 -2.592059 0.279879
C 3.149904 1.312730 -0.853453
C 3.898319 0.492163 -0.070454
C -3.454847 1.438373 1.049255
C -0.911195 -3.038815 -0.872279
C -3.981943 -0.473707 -0.410247
C -4.326351 -0.873034 -1.829470
H 0.680442 2.392745 1.441357
H 0.672771 1.034117 0.300370
H 0.859034 2.693217 -1.632953
H 0.968417 4.018812 -0.455299
H -1.423151 1.950962 -0.791050
H -1.427292 3.311493 0.349851
H 2.254289 -2.683983 1.898018
H 2.067682 -1.000332 1.361157
H 4.259360 -2.958403 0.386830
H 4.476668 -1.695033 1.617949
H 3.224706 3.439581 -1.206830
H 3.084409 2.986326 0.508965
H 1.584321 -1.772762 -0.982223
H 1.857214 -3.462433 -0.501029
H 5.394215 -0.983328 -0.562682
H 3.834008 -1.221252 -1.377679
H -1.602774 0.333842 1.203174
H -1.723118 1.738425 2.281116
H -0.079071 -3.304260 1.125030
H -0.331070 -1.611561 0.668570
H 2.796302 0.934589 -1.827975
H 4.247180 0.865986 0.907066
H -3.835763 2.473347 1.037757
H -3.977873 0.841107 1.817265
H -0.629191 -4.042890 -1.242199
H -1.964867 -3.074398 -0.540130
H -0.840832 -2.337670 -1.727490
H -4.581724 0.003361 -2.442211
H -5.166386 -1.587325 -1.816318
H -3.460395 -1.392603 -2.278211


