%chk=000048666.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048666

1 1
 O  -0.8203000     -4.4599999E-02  0.6181000    
 O   -1.664800      -1.374800      -1.076500    
 N    1.313500       1.657600     -0.1366000    
 N   -3.107800      4.8599999E-02  6.4199999E-02
 C    1.493100      0.1454000      1.8100001E-02
 C    2.648800       2.270700     -0.5485000    
 C   0.8384000       2.234400       1.194000    
 C   0.2789000       2.009900      -1.203500    
 C   0.4104000     -0.5818000      0.3841000    
 C    2.735600     -0.3408000     -0.2258000    
 C   0.5894000      -1.958200      0.5231000    
 C    2.914800      -1.717300     -8.7499999E-02
 C    1.841700      -2.525900      0.2872000    
 C   -1.861400     -0.5268000     -0.2068000    
 C   -4.279200     -0.3476000     -0.7042000    
 C   -3.331000       1.051300       1.100700    
 H    2.947800       1.900000      -1.535100    
 H    2.493800       3.352900     -0.6387000    
 H    3.391500       2.121300      0.2428000    
 H    1.480200       1.850200       1.993500    
 H   0.9450000       3.323300       1.138100    
 H  -0.2106000       2.007900       1.381700    
 H  -0.7327000       1.820100     -0.8458000    
 H   0.3670000       3.079500      -1.422100    
 H   0.4967000       1.427700      -2.104200    
 H    3.623700      0.1989000     -0.5198000    
 H  -0.2302000      -2.601400      0.8330000    
 H    3.889400      -2.161200     -0.2699000    
 H    1.982400      -3.597000      0.3995000    
 H   -5.019300     -0.7762000     -2.2299999E-02
 H   -4.029800      -1.087600      -1.468600    
 H   -4.697600      0.5387000      -1.189900    
 H   -4.131300      0.7036000       1.760400    
 H   -3.633900       1.985800      0.6198000    
 H   -2.438400       1.232400       1.700900    


%chk=000048666-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000048666

1 1
O -0.904753 0.248884 0.447338
O -1.749814 -0.541218 -1.620170
N 1.476894 1.766387 -0.300841
N -3.212393 -0.038414 0.163368
C 1.526565 0.272066 0.007577
C 2.863779 2.360104 -0.553916
C 0.867557 2.536228 0.884390
C 0.646356 1.997339 -1.577888
C 0.327790 -0.436312 0.300785
C 2.754274 -0.425247 -0.026032
C 0.374349 -1.828211 0.524605
C 2.791640 -1.816341 0.206838
C 1.598563 -2.521606 0.473310
C -2.005931 -0.179650 -0.449528
C -4.437559 -0.280230 -0.634162
C -3.411146 0.338543 1.577536
H 3.324089 1.876395 -1.426964
H 2.732093 3.432866 -0.760250
H 3.492345 2.232113 0.339046
H 1.494482 2.355883 1.770457
H 0.857389 3.608355 0.633562
H -0.150052 2.165931 1.056995
H -0.353616 1.568638 -1.449743
H 0.587160 3.081741 -1.760940
H 1.151552 1.489952 -2.412765
H 3.695350 0.085552 -0.237255
H -0.559684 -2.356465 0.740832
H 3.750558 -2.341022 0.174204
H 1.620776 -3.601384 0.646478
H -5.000053 -1.131835 -0.211734
H -4.159704 -0.511595 -1.672349
H -5.081100 0.617476 -0.616816
H -4.093684 -0.386327 2.056073
H -3.866816 1.343604 1.647959
H -2.453455 0.336799 2.113399


