%chk=000029404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029404

1 1
 O    2.249600      0.4068000     -1.3000000E-02
 O    1.353100      -1.718800      4.9000001E-03
 N   -2.577900      0.1481000      5.2999998E-03
 C   -1.299100     -0.6759000      4.8500001E-02
 C   -3.780500     -0.7737000      0.1494000    
 C   -2.571000       1.155200       1.146200    
 C   -2.661100      0.8864000      -1.322900    
 C  -8.8799998E-02  0.2422000     -2.9999999E-02
 C    1.229100     -0.5019000     -1.4500000E-02
 C    3.568500     -0.1482000      1.4000000E-02
 C    4.578200      0.9798000      1.2200000E-02
 H   -1.324500      -1.383000     -0.7894000    
 H   -1.300000      -1.249600      0.9834000    
 H   -3.706600      -1.290100       1.111000    
 H   -4.691900     -0.1696000      0.1107000    
 H   -3.764600      -1.492700     -0.6750000    
 H   -1.859900       1.958300      0.9372000    
 H   -3.573300       1.590300       1.217300    
 H   -2.326300      0.6333000       2.075900    
 H   -1.927100       1.694800      -1.353200    
 H   -2.499000      0.1708000      -2.134200    
 H   -3.662700       1.321400      -1.404600    
 H  -8.3099999E-02  0.8265000     -0.9543000    
 H  -4.8000000E-02  0.9182000      0.8295000    
 H    3.691400     -0.7535000      0.9189000    
 H    3.717200     -0.7795000     -0.8691000    
 H    5.599900      0.5903000      3.2600001E-02
 H    4.455700       1.605100     -0.8784000    
 H    4.430400       1.630700      0.8803000    


%chk=000029404-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029404

1 1
O 2.345121 0.400719 -0.126954
O 1.217107 -1.331304 0.961919
N -2.630372 0.179967 -0.019703
C -1.226069 -0.469645 -0.072174
C -3.664246 -0.946389 -0.104300
C -2.835180 0.931681 1.295245
C -2.832307 1.133373 -1.195448
C -0.042931 0.510468 -0.096115
C 1.226536 -0.261748 0.307195
C 3.685895 -0.202296 0.244516
C 4.755028 0.715177 -0.329745
H -1.217288 -1.107516 -0.972891
H -1.138508 -1.128006 0.809604
H -3.508269 -1.640747 0.735203
H -4.675018 -0.514156 -0.050686
H -3.536673 -1.481489 -1.057416
H -2.147706 1.787553 1.347132
H -3.873264 1.295424 1.337841
H -2.643210 0.245331 2.133742
H -2.117927 1.965082 -1.118000
H -2.667833 0.584554 -2.135283
H -3.861008 1.524380 -1.165854
H 0.122388 0.973820 -1.081969
H -0.156374 1.328151 0.640821
H 3.721302 -0.273722 1.345650
H 3.716195 -1.221349 -0.178873
H 5.752451 0.308508 -0.084348
H 4.675090 0.786248 -1.427330
H 4.684767 1.729632 0.096922


