%chk=000166531.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166531

0 1
 O  -0.5893000      0.5244000      0.5793000    
 O   0.2061000       2.941800     -0.5375000    
 O  -0.7040000     -0.3939000      -1.560600    
 N    5.316400      -2.935000      2.1900000E-02
 C    4.055400     -0.9567000      0.8153000    
 C    3.035800      7.1500003E-02  0.4590000    
 C    4.337000      -1.918600     -0.3477000    
 C    1.682600     -0.1802000      0.6860000    
 C    3.435000       1.284700     -0.1018000    
 C   0.7631000      0.7880000      0.3462000    
 C    1.128300       1.994500     -0.2086000    
 C    2.481300       2.246200     -0.4357000    
 C   -2.642200     -0.3302000     -0.1733000    
 C   -1.243400     -8.7800004E-02 -0.4878000    
 C   -3.305400      -1.419700     -0.7380000    
 C   -3.321000      0.5264000      0.6936000    
 C   -4.647200      -1.652500     -0.4362000    
 C   -4.662800      0.2933000      0.9955000    
 C   -5.325700     -0.7961000      0.4305000    
 H    4.986200     -0.4635000       1.126000    
 H    3.715500      -1.520900       1.694300    
 H    4.714600      -1.362000      -1.213200    
 H    3.410500      -2.413600     -0.6618000    
 H    1.359200      -1.121500       1.121000    
 H    4.486000       1.492000     -0.2854000    
 H    2.806100       3.186900     -0.8722000    
 H    4.963000      -3.481400      0.8064000    
 H    5.434100      -3.588000     -0.7517000    
 H   -2.790700      -2.098700      -1.412900    
 H   -2.834800       1.390600       1.138500    
 H   -5.163500      -2.501000     -0.8756000    
 H   -5.192400      0.9617000       1.668000    
 H   0.6645000       3.713300     -0.9124000    
 H   -6.370700     -0.9771000      0.6651000    


%chk=000166531-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166531

0 1
O -0.571271 0.216957 0.422289
O -0.013409 2.545035 -0.973102
O -1.010184 -0.263878 -1.833280
N 5.680369 -2.814425 0.442913
C 4.286470 -0.813196 0.925523
C 3.172017 0.095255 0.434953
C 4.567397 -1.985240 -0.054437
C 1.810392 -0.251654 0.630791
C 3.458727 1.287301 -0.275582
C 0.780668 0.563321 0.135688
C 1.073155 1.762724 -0.560026
C 2.425559 2.115631 -0.766341
C -2.830872 -0.293953 -0.203830
C -1.425888 -0.117870 -0.666282
C -3.794444 -0.712578 -1.158727
C -3.221468 -0.055303 1.139569
C -5.137759 -0.893809 -0.772670
C -4.567572 -0.237960 1.520642
C -5.526588 -0.657440 0.568035
H 5.229444 -0.251878 1.054223
H 4.025582 -1.240019 1.915340
H 4.859757 -1.565888 -1.035437
H 3.613905 -2.544077 -0.217777
H 1.535763 -1.163068 1.173298
H 4.502891 1.576875 -0.440913
H 2.670643 3.042359 -1.301235
H 5.491422 -3.278113 1.337208
H 6.077729 -3.457882 -0.247226
H -3.469499 -0.886750 -2.189943
H -2.470856 0.272612 1.863418
H -5.880024 -1.216989 -1.510421
H -4.870591 -0.052736 2.556869
H 0.287369 3.291222 -1.547437
H -6.571236 -0.797687 0.868105


