%chk=000122841.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122841

0 1
 O    3.744000      0.2270000     -0.1680000    
 O  -0.3672000      -2.104900      0.5840000    
 O  -0.3267000       2.665300      0.1354000    
 O   -2.277700      0.4130000       1.684500    
 C  -0.3400000      0.2759000      0.3593000    
 C   -2.716000      0.1935000     -0.6755000    
 C   -1.820300      0.3031000      0.5492000    
 C    1.695600     -0.9611000      0.2092000    
 C   0.3122000     -0.9379000      0.3871000    
 C   -4.057000     -0.4662000     -0.3533000    
 C   0.3236000       1.467700      0.1620000    
 C    2.392800      0.2301000      7.6000001E-03
 C    1.706700       1.444500     -1.5900001E-02
 C    2.432800      -2.261700      0.2339000    
 C   -4.925900     -0.5973000      -1.593600    
 C    4.223100      0.1090000      -1.505900    
 H   -2.195200     -0.3894000      -1.443800    
 H   -2.873600       1.205800      -1.064200    
 H   -4.592900      0.1221000      0.4009000    
 H   -3.887900      -1.458700      8.1100002E-02
 H    2.257000       2.369200     -0.1726000    
 H    3.468500      -2.140500      0.5678000    
 H    1.973800      -2.969300      0.9328000    
 H    2.437000      -2.709000     -0.7651000    
 H   -5.137200      0.3843000      -2.029700    
 H   -5.880200      -1.069200      -1.339900    
 H   -4.434100      -1.212700      -2.353700    
 H   -1.312800      -1.935200      0.7199000    
 H   0.3201000       3.375600     -1.5900001E-02
 H    3.909200      0.9726000      -2.100800    
 H    3.864400     -0.8152000      -1.969600    
 H    5.315800      8.3499998E-02  -1.477100    


%chk=000122841-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122841

0 1
O 3.752570 0.725721 -0.258838
O 0.214106 -2.404651 0.838227
O -0.836686 1.928955 -1.165344
O -2.126085 -1.810263 0.386182
C -0.398985 -0.262192 -0.182859
C -2.951326 0.228303 -0.616572
C -1.817604 -0.651889 -0.119011
C 1.996761 -0.916457 0.307597
C 0.599712 -1.197242 0.315571
C -4.344846 -0.412733 -0.470214
C 0.092089 0.987275 -0.687173
C 2.397887 0.324157 -0.235654
C 1.464327 1.275081 -0.720028
C 2.959408 -1.900507 0.935223
C -5.457956 0.524333 -0.985169
C 4.635723 -0.030453 -1.169308
H -2.750037 0.501808 -1.671232
H -2.904913 1.197077 -0.080180
H -4.522633 -0.670876 0.590052
H -4.368798 -1.372241 -1.019436
H 1.845783 2.225317 -1.110053
H 3.872242 -1.387304 1.281670
H 2.475484 -2.398039 1.791624
H 3.250598 -2.705519 0.232675
H -5.469882 1.479308 -0.425811
H -6.453373 0.057274 -0.873573
H -5.317577 0.765299 -2.056272
H -0.840509 -2.431008 0.775204
H -0.365633 2.746576 -1.465257
H 4.321843 0.121958 -2.219885
H 4.638625 -1.110870 -0.938967
H 5.641584 0.387700 -1.013090


