%chk=000008570.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008570

0 1
 O   -4.933200      -1.227700      0.2049000    
 O    4.794900      -1.531200      4.8000000E-02
 O   -1.269700       1.013300       2.268500    
 O    2.548100       2.635800     -0.4901000    
 O  -6.0999999E-03   2.605700     -0.4334000    
 C   -1.272500      0.7034000     -0.1100000    
 C    1.279900      0.6260000     -0.1689000    
 C   1.1000000E-02   1.379200     -0.2422000    
 C   -1.871100      0.5429000       1.139600    
 C    2.488800       1.288200     -0.2956000    
 C   -1.904200      0.2153000      -1.253800    
 C    1.222300     -0.7434000      2.9200001E-02
 C   -3.101500     -0.1058000       1.245300    
 C    3.676100      0.5597000     -0.2220000    
 C   -3.733100     -0.5942000      0.1015000    
 C    3.636500     -0.8204000     -2.3200000E-02
 C   -3.134400     -0.4337000      -1.148000    
 C    2.409600      -1.471900      0.1024000    
 C   -5.523100      -1.702600      -1.004300    
 C    4.681800      -2.938700      0.2523000    
 H   -1.447300      0.3354000      -2.233000    
 H   0.2932000      -1.293700      0.1332000    
 H   -3.568600     -0.2314000       2.219000    
 H    4.636700       1.059800     -0.3189000    
 H   -3.569400     -0.7882000      -2.076200    
 H    2.306900      -2.540400      0.2585000    
 H  -0.4384000       1.464000       2.049600    
 H    3.479800       2.907300     -0.5534000    
 H   -6.471600      -2.179200     -0.7358000    
 H   -4.903200      -2.470100      -1.480000    
 H   -5.760800     -0.8793000      -1.686500    
 H    4.168800      -3.426800     -0.5834000    
 H    4.216500      -3.169200       1.216700    
 H    5.698600      -3.343600      0.2833000    


%chk=000008570-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008570

0 1
O -5.265790 -0.592466 -0.386085
O 4.936624 -1.506346 -0.711414
O -2.293281 2.205657 2.060515
O 2.151278 2.426192 -0.500724
O 0.189704 2.056331 1.682899
C -1.291396 0.592784 0.498187
C 1.278075 0.354847 0.372070
C 0.051142 1.055925 0.867834
C -2.444234 1.199347 1.139576
C 2.356071 1.070797 -0.229792
C -1.529309 -0.406558 -0.489088
C 1.453732 -1.032310 0.594043
C -3.747426 0.765565 0.822409
C 3.552055 0.415612 -0.583572
C -3.935668 -0.243112 -0.144239
C 3.702645 -0.968714 -0.330419
C -2.822385 -0.832678 -0.818916
C 2.647052 -1.707330 0.261095
C -5.539441 -1.621059 -1.396484
C 5.159538 -2.936207 -0.470316
H -0.672495 -0.838069 -1.016076
H 0.644120 -1.590806 1.076142
H -4.607424 1.223104 1.316323
H 4.380264 0.952765 -1.060002
H -2.964281 -1.596606 -1.587317
H 2.743841 -2.774816 0.473961
H -1.272660 2.407964 2.112418
H 2.966363 2.843027 -0.876007
H -6.634314 -1.721225 -1.408703
H -5.078892 -2.588471 -1.119341
H -5.181641 -1.307382 -2.395532
H 4.432848 -3.555256 -1.030570
H 5.099729 -3.173850 0.608996
H 6.176861 -3.132155 -0.838570


