%chk=000112061.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112061

0 1
 O   -5.354800      -2.141300      0.2413000    
 C   -1.181600      0.7892000     -0.1844000    
 C   -2.492400     -7.9999998E-04 -0.2756000    
 C   2.7799999E-02 -0.1499000     -0.1762000    
 C   -3.743000      0.8979000     -0.3608000    
 C    1.369900      0.5859000     -0.1213000    
 C    2.575600     -0.3529000     -3.8899999E-02
 C    3.888900      0.4339000      6.9999998E-04
 C   -5.003800      6.8700001E-02 -0.6557000    
 C    5.096000     -0.5056000      5.0299998E-02
 C   -3.922300       1.769800      0.8853000    
 C    6.437100      0.2309000      6.6699997E-02
 C   -5.336600     -0.9283000      0.4264000    
 C    7.639200     -0.6977000      0.1422000    
 H   -1.105800       1.477000      -1.034800    
 H   -1.164300       1.393900      0.7288000    
 H   -2.568800     -0.6674000      0.5924000    
 H   -2.455700     -0.6429000      -1.165000    
 H  -4.7200002E-02 -0.8234000      0.6866000    
 H   5.5999998E-03 -0.7812000      -1.073200    
 H   -3.610400       1.576700      -1.214200    
 H    1.375900       1.254100      0.7489000    
 H    1.463700       1.222800      -1.009700    
 H    2.493000     -0.9794000      0.8573000    
 H    2.573500      -1.024900     -0.9056000    
 H    3.899600       1.092400      0.8775000    
 H    3.961900       1.074200     -0.8866000    
 H   -4.881000     -0.4765000      -1.599000    
 H   -5.873000      0.7255000     -0.7741000    
 H    5.069000      -1.177500     -0.8166000    
 H    5.023500      -1.138700      0.9434000    
 H   -3.899300       1.173900       1.803300    
 H   -4.875600       2.307900      0.8506000    
 H   -3.131300       2.523100      0.9554000    
 H    6.522700      0.8490000     -0.8350000    
 H    6.465100      0.9143000      0.9239000    
 H   -5.588800     -0.5063000       1.413500    
 H    7.607000      -1.304100       1.052900    
 H    8.567700     -0.1183000      0.1505000    
 H    7.665300      -1.372400     -0.7191000    


%chk=000112061-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112061

0 1
O -5.621407 -2.163013 0.323801
C -1.206728 0.762088 -0.185500
C -2.545145 -0.008366 -0.240416
C 0.024416 -0.172642 -0.174569
C -3.801295 0.892843 -0.383778
C 1.366919 0.587827 -0.089075
C 2.599413 -0.344310 -0.083675
C 3.941370 0.415851 0.015665
C -5.072767 0.024706 -0.655049
C 5.174813 -0.515149 0.016984
C -3.988101 1.848992 0.821766
C 6.516178 0.245657 0.125756
C -5.416384 -0.932954 0.470966
C 7.743229 -0.691629 0.124342
H -1.140160 1.444398 -1.059573
H -1.175820 1.405441 0.716748
H -2.645614 -0.634183 0.671891
H -2.515338 -0.715725 -1.095127
H -0.054955 -0.872692 0.683435
H 0.015700 -0.802038 -1.088905
H -3.663327 1.521847 -1.288847
H 1.376417 1.211884 0.829282
H 1.444346 1.292721 -0.943525
H 2.517697 -1.054658 0.765688
H 2.595581 -0.962629 -1.005747
H 3.946139 1.030878 0.940151
H 4.022041 1.129290 -0.831393
H -4.958616 -0.558034 -1.587359
H -5.941215 0.707110 -0.782482
H 5.175415 -1.126187 -0.910048
H 5.093049 -1.232533 0.860539
H -3.986427 1.302086 1.783257
H -4.941148 2.405701 0.747092
H -3.172379 2.591539 0.864219
H 6.596562 0.963806 -0.715984
H 6.514576 0.854276 1.053256
H -5.499311 -0.468513 1.487328
H 7.700948 -1.400544 0.972904
H 8.688613 -0.123963 0.205115
H 7.785017 -1.287580 -0.807032


