%chk=000051863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051863

0 1
 O   -2.333700      0.5228000      0.8758000    
 O   -4.430000     -0.7878000     -0.3832000    
 O    3.497700      0.9488000      -1.576600    
 O    5.477300      0.9039000      0.2027000    
 C  -0.3042000     -0.6556000      0.3037000    
 C    1.072400     -0.5923000     -1.8600000E-02
 C   -1.004800      0.5341000      0.5607000    
 C    1.707900      0.6589000     -7.4199997E-02
 C   -3.208900       1.232400      3.8999999E-03
 C  -0.3574000       1.768600      0.5010000    
 C   0.9964000       1.830700      0.1841000    
 C   -4.580000      0.5690000      3.2000002E-02
 C  -0.9397000      -1.906800      0.3593000    
 C    1.773000      -1.782000     -0.2756000    
 C    3.124300      0.8042000     -0.3982000    
 C  -0.2281000      -3.078700      0.1011000    
 C    1.125600      -3.016400     -0.2158000    
 C   -5.554600       1.265500     -0.9054000    
 C    4.166800      0.7807000      0.7234000    
 H   -2.811600       1.217600      -1.020100    
 H   -3.284600       2.272500      0.3406000    
 H  -0.8928000       2.690900      0.7094000    
 H   -4.973700      0.5504000       1.053500    
 H    1.487700       2.799800      0.1438000    
 H   -1.995200      -1.992000      0.6068000    
 H    2.830500      -1.778400     -0.5285000    
 H  -0.7313000      -4.040100      0.1480000    
 H    1.678600      -3.929300     -0.4169000    
 H   -6.521600      0.7510000     -0.8988000    
 H   -5.711500       2.307700     -0.6115000    
 H   -5.194600       1.242700      -1.940000    
 H    4.092000     -0.1668000       1.264100    
 H    3.978000       1.619400       1.399800    
 H   -4.070700     -0.7879000      -1.286900    
 H    6.088500      0.8896000      0.9587000    


%chk=000051863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051863

0 1
O -2.369518 0.066089 -0.005683
O -4.967303 -0.551049 -1.200377
O 3.725727 2.147011 -0.701852
O 5.145555 -0.353044 0.344152
C -0.127636 -0.754394 0.154251
C 1.305234 -0.542538 0.131909
C -1.010825 0.364947 -0.082746
C 1.813052 0.799385 -0.098104
C -3.340073 1.122570 -0.323134
C -0.498267 1.638012 -0.378168
C 0.905149 1.835460 -0.388739
C -4.744610 0.511806 -0.207518
C -0.658637 -2.065877 0.367698
C 2.153400 -1.694095 0.262623
C 3.244316 1.197796 -0.001655
C 0.197703 -3.156450 0.537435
C 1.610386 -2.966481 0.469779
C -5.829256 1.602949 -0.295767
C 4.187161 0.538450 1.024965
H -3.158011 1.504877 -1.350424
H -3.227088 1.960067 0.395954
H -1.158584 2.486401 -0.576225
H -4.815218 -0.023411 0.754849
H 1.312468 2.830679 -0.596288
H -1.744501 -2.193205 0.373281
H 3.238191 -1.587092 0.156479
H -0.212648 -4.159274 0.696913
H 2.279258 -3.829312 0.562253
H -6.825064 1.129932 -0.270865
H -5.762352 2.313808 0.548248
H -5.746004 2.181184 -1.237172
H 3.662149 -0.094423 1.753811
H 4.718708 1.355721 1.552326
H -4.958230 -0.152824 -2.109197
H 5.623072 0.183425 -0.340911


