%chk=000023711.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023711

0 1
 O    2.841700      0.4682000      0.3523000    
 O   -2.817700     -0.4955000      0.2373000    
 O    1.984200      -1.574400     -0.3036000    
 O   -2.008600       1.601700     -0.2960000    
 C    4.168900     -6.7400001E-02  0.3262000    
 C   -4.140500      3.5700001E-02  0.3682000    
 C    4.486200     -0.5728000      -1.071900    
 C    5.148900       1.020100      0.7430000    
 C   -4.568000      0.6662000     -0.9473000    
 C   -5.088000      -1.088600      0.7617000    
 C    1.853100     -0.4030000      1.4000000E-02
 C   -1.856600      0.4066000     -9.8800004E-02
 C   0.5670000      0.3236000      0.1000000    
 C  -0.5707000     -0.3203000     -0.1853000    
 H    4.237500     -0.8879000       1.051200    
 H   -4.146500      0.7861000       1.168600    
 H    5.565700     -0.7142000      -1.197300    
 H    4.033800      -1.542600      -1.292100    
 H    4.142200      0.1312000      -1.837800    
 H    6.177400      0.6471000      0.7643000    
 H    4.894900       1.399000       1.738900    
 H    5.098100       1.875300      5.9900001E-02
 H   -5.653600      0.8143000     -0.9715000    
 H   -4.131500       1.653800      -1.113300    
 H   -4.289700      3.6800001E-02  -1.800100    
 H   -6.109800     -0.7224000      0.9006000    
 H   -4.755700      -1.556300       1.694800    
 H   -5.096400      -1.877300      1.3000000E-03
 H   0.5830000       1.371200      0.3814000    
 H  -0.5991000      -1.373400     -0.4435000    


%chk=000023711-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023711

0 1
O 2.947967 0.473313 0.187292
O -2.947783 -0.494927 0.189568
O 2.016169 -1.674765 0.068757
O -2.016575 1.654905 0.276011
C 4.340661 -0.112190 0.141342
C -4.340554 0.090923 0.228981
C 4.712671 -0.379373 -1.324213
C 5.232486 0.917859 0.836648
C -4.734991 0.518178 -1.192035
C -5.222464 -1.010250 0.819992
C 1.882498 -0.426086 0.136726
C -1.882643 0.405975 0.213239
C 0.596523 0.317247 0.184698
C -0.596617 -0.337181 0.163116
H 4.305441 -1.065004 0.702292
H -4.296029 0.976049 0.891086
H 5.743034 -0.775512 -1.381666
H 4.033370 -1.122918 -1.773506
H 4.665925 0.554523 -1.911746
H 6.272871 0.547345 0.874882
H 4.889577 1.102711 1.868837
H 5.223287 1.876205 0.288432
H -5.764838 0.919835 -1.188891
H -4.060611 1.305902 -1.567385
H -4.700682 -0.345066 -1.879962
H -6.262720 -0.648509 0.910042
H -4.866952 -1.304442 1.822114
H -5.218684 -1.903963 0.171657
H 0.638947 1.410258 0.239234
H -0.639082 -1.430244 0.109660


