%chk=000018468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018468

0 1
 O  -0.3175000       1.291000      -1.075900    
 O    1.176600     -0.4732000       1.630900    
 O  -0.9510000      -1.605700      -1.100300    
 O    3.030400     -5.7100002E-02 -0.4198000    
 O    1.381100       2.064500      0.3862000    
 O   -3.338500      7.9899997E-02  0.5147000    
 C   0.8855000     -0.9443000      0.3164000    
 C  -0.6240000     -0.8581000      6.9700003E-02
 C    1.639400     -9.3999997E-02 -0.7124000    
 C   -1.083900      0.6042000     -7.5999998E-02
 C    1.085500       1.330300     -0.7989000    
 C   -2.551000      0.7117000     -0.4783000    
 C   0.5117000      -1.248500       2.616200    
 C  -0.5907000      -2.971200     -0.9584000    
 C    3.601000      -1.358500     -0.4351000    
 C   0.8714000       3.387900      0.3162000    
 C   -4.726100      0.1412000      0.2047000    
 H    1.250400      -1.972200      0.2736000    
 H   -1.206000      -1.301400      0.8831000    
 H    1.499600     -0.5510000      -1.702400    
 H  -0.9555000       1.112400      0.8882000    
 H    1.577700       1.840000      -1.636400    
 H   -2.724800      0.2529000      -1.459500    
 H   -2.831100       1.769300     -0.5621000    
 H    1.068300      -1.137200       3.552000    
 H   0.4877000      -2.315000       2.369200    
 H  -0.4944000     -0.8622000       2.802200    
 H  -0.7702000      -3.353200      5.2000001E-02
 H   0.4461000      -3.134200      -1.265600    
 H   -1.215900      -3.548500      -1.646800    
 H    3.257100      -1.947800      -1.291200    
 H    3.407200      -1.882900      0.5048000    
 H    4.685800      -1.243300     -0.5202000    
 H  -0.2222000       3.396800      0.3049000    
 H    1.262500       3.909600     -0.5628000    
 H    1.203000       3.925700       1.208900    
 H   -4.930300     -0.3759000     -0.7377000    
 H   -5.059300       1.181700      0.1450000    
 H   -5.279200     -0.3581000       1.004600    


%chk=000018468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018468

0 1
O -0.326585 1.251996 -1.114935
O 1.187081 -0.427453 1.799952
O -0.702761 -1.717157 -1.158242
O 3.140405 0.164286 -0.351032
O 1.290319 2.179448 0.420182
O -3.345757 -0.227800 0.370900
C 0.969260 -0.910309 0.434418
C -0.547603 -0.932734 0.081928
C 1.713619 -0.018250 -0.586777
C -1.088299 0.499729 -0.088794
C 1.101322 1.384453 -0.763759
C -2.534355 0.546631 -0.580670
C 1.005110 -1.471382 2.808476
C -1.631715 -2.844110 -1.022875
C 3.895463 -1.085966 -0.340564
C 1.044894 3.609221 0.188077
C -4.773773 -0.124153 0.080800
H 1.342509 -1.955060 0.339005
H -1.109793 -1.410492 0.909181
H 1.553526 -0.530965 -1.564286
H -0.986383 1.012588 0.888737
H 1.540549 1.880369 -1.652579
H -2.596918 0.106539 -1.597169
H -2.880431 1.600781 -0.618130
H 1.276375 -1.008091 3.769975
H 1.672054 -2.340091 2.616659
H -0.043592 -1.833210 2.864838
H -2.635821 -2.499688 -0.707154
H -1.259856 -3.590881 -0.289063
H -1.685333 -3.312027 -2.019300
H 3.678148 -1.706142 -1.238025
H 3.690299 -1.682321 0.571700
H 4.957222 -0.792683 -0.345357
H 0.003848 3.792939 -0.141033
H 1.745593 4.010942 -0.572956
H 1.227646 4.102793 1.154698
H -5.013858 -0.509854 -0.933363
H -5.124127 0.927317 0.152019
H -5.291881 -0.733612 0.838216


