%chk=000169676.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169676

0 1
 O  -0.1364000      -1.248300       2.174600    
 O   -1.274300       1.879300       1.574900    
 O   -1.829700      -2.405100     -0.5160000    
 O   -5.208300      0.9268000     -0.9367000    
 C    2.293700     -0.2181000       1.088000    
 C    1.047700     -0.4543000      0.2312000    
 C    3.515700      2.2100000E-02  0.2396000    
 C  -0.2241000     -0.6947000       1.061900    
 C   -1.520200     -0.2733000      0.5423000    
 C   -2.000100       1.006600      0.8201000    
 C   -2.279600      -1.150000     -0.2323000    
 C    4.298100      -1.055300     -0.1500000    
 C    3.840000       1.316800     -0.1385000    
 C   -3.239400       1.409900      0.3230000    
 C   -3.519000     -0.7468000     -0.7292000    
 C   -3.999000      0.5333000     -0.4516000    
 C    5.429600     -0.8330000     -0.9349000    
 C    4.971400       1.539200     -0.9234000    
 C    5.766200      0.4642000      -1.321600    
 C   -5.932300     -1.9500000E-02  -1.721400    
 H    1.184500      -1.331400     -0.4128000    
 H   0.8761000      0.4103000     -0.4216000    
 H    2.130300      0.6352000       1.759100    
 H    2.468700      -1.076600       1.749400    
 H    4.043200      -2.069400      0.1444000    
 H    3.226200       2.160200      0.1650000    
 H   -3.614100       2.407400      0.5389000    
 H   -4.069300      -1.466700      -1.325900    
 H    6.048200      -1.669900      -1.245500    
 H    5.233200       2.549200      -1.225100    
 H    6.646900      0.6373000      -1.933000    
 H  -0.4450000       1.469700       1.869300    
 H   -2.487500      -2.866700      -1.063400    
 H   -5.394700     -0.2760000      -2.640600    
 H   -6.868800      0.4609000      -2.023500    
 H   -6.202700     -0.9051000      -1.136400    


%chk=000169676-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169676

0 1
O 0.019119 0.710974 2.396934
O -2.404710 0.893125 2.842617
O -0.843881 -0.415232 -1.596581
O -5.619619 -0.006413 -0.528709
C 2.402875 0.295603 1.099276
C 1.082426 0.092583 0.316683
C 3.612158 0.024935 0.215970
C -0.156566 0.359181 1.156831
C -1.527052 0.240953 0.640933
C -2.638441 0.525284 1.545263
C -1.883134 -0.134065 -0.694437
C 4.156510 -1.281131 0.106193
C 4.203553 1.066095 -0.545897
C -3.978171 0.432928 1.121016
C -3.219404 -0.228950 -1.126302
C -4.264729 0.058117 -0.204413
C 5.257818 -1.541739 -0.740550
C 5.305163 0.811993 -1.394193
C 5.836290 -0.494942 -1.495702
C -5.992612 -0.392913 -1.893581
H 1.024973 -0.933068 -0.095698
H 1.055703 0.740408 -0.580685
H 2.430091 1.326828 1.494819
H 2.404053 -0.370837 1.980681
H 3.718982 -2.096559 0.696327
H 3.802386 2.084457 -0.464800
H -4.784249 0.651837 1.823244
H -3.437886 -0.520037 -2.159228
H 5.668047 -2.556150 -0.806726
H 5.752353 1.631247 -1.969129
H 6.693366 -0.693595 -2.149165
H -1.361155 0.905670 2.963585
H -1.209059 -0.660231 -2.483523
H -5.601893 0.328799 -2.636379
H -7.091765 -0.373801 -1.903241
H -5.636342 -1.413154 -2.133134


