%chk=000056048.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056048

0 1
 O   -2.493200      -1.253300      8.2099997E-02
 O   0.7461000       1.843600      2.6100000E-02
 N    2.777900      6.0899999E-02  0.4937000    
 N    1.445900     -0.3212000      0.4157000    
 N   -1.116100      -1.136200      0.2264000    
 C    3.563000     -0.6455000     -0.5096000    
 C  -0.8974000      0.1556000      8.0899999E-02
 C   -2.030300      0.9153000     -0.1510000    
 C   -3.026400     -2.5100000E-02 -0.1424000    
 C   0.4841000      0.6503000      0.1756000    
 C    5.029000     -0.2798000     -0.3780000    
 C   -4.482500      3.5599999E-02 -0.3195000    
 H    3.454400      -1.730700     -0.3933000    
 H    3.217300     -0.3798000      -1.515500    
 H    3.103500     -0.1918000       1.426200    
 H   -2.134400       1.979200     -0.3039000    
 H    1.213800      -1.301600      0.5446000    
 H    5.183300      0.7960000     -0.5143000    
 H    5.422800     -0.5606000      0.6047000    
 H    5.618600     -0.8027000      -1.138000    
 H   -4.994700     -0.3403000      0.5716000    
 H   -4.816900       1.062900     -0.4944000    
 H   -4.791600     -0.5716000      -1.175900    


%chk=000056048-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056048

0 1
O -2.585339 -1.310250 0.125062
O 0.729106 1.921418 -0.015808
N 2.834012 0.003430 0.490350
N 1.457259 -0.285295 0.442526
N -1.134379 -1.186563 0.274552
C 3.648920 -0.673461 -0.546133
C -0.890015 0.135087 0.095555
C -2.084817 0.889846 -0.159268
C -3.117953 -0.030975 -0.135171
C 0.509982 0.693032 0.162556
C 5.129343 -0.303353 -0.357538
C -4.598331 0.043838 -0.318293
H 3.529996 -1.784924 -0.521328
H 3.293584 -0.327492 -1.533175
H 3.209417 -0.085196 1.444428
H -2.132168 1.960793 -0.332166
H 1.116964 -1.256730 0.530338
H 5.259064 0.791128 -0.408686
H 5.514357 -0.654397 0.619318
H 5.744884 -0.769500 -1.146621
H -5.128862 -0.313187 0.582570
H -4.902915 1.084040 -0.513587
H -4.925908 -0.582090 -1.167679


