%chk=000052159.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052159

0 1
 O   0.9901000       1.297700      0.6589000    
 N  -0.5408000     -9.1100000E-02 -0.4207000    
 N    1.669400     -0.7030000     -0.3055000    
 C   -1.709900      2.7000001E-02  0.4004000    
 C   -1.524300      0.8853000     -0.7869000    
 C   -2.683900      -1.079000      0.3806000    
 C   0.7302000      0.2679000      3.7500001E-02
 C    3.069200     -0.6049000      3.5700001E-02
 H   -1.549700      0.4433000       1.385800    
 H   -2.032700      0.6487000      -1.710500    
 H   -1.231800       1.916700     -0.6499000    
 H   -3.666800     -0.7226000      0.7048000    
 H   -2.798800      -1.521800     -0.6148000    
 H   -2.372000      -1.872900       1.066900    
 H    1.358800      -1.500400     -0.8520000    
 H    3.434900      -1.604600      0.2814000    
 H    3.217800      6.6900000E-02  0.8845000    
 H    3.607500     -0.2225000     -0.8351000    


%chk=000052159-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052159

0 1
O 1.173492 1.572067 -0.080608
N -0.558127 0.009805 -0.697310
N 1.596519 -0.731032 -0.218247
C -1.635440 -0.079567 0.387869
C -1.609752 1.076722 -0.596990
C -2.618404 -1.227485 0.284076
C 0.786432 0.384897 -0.295668
C 3.010846 -0.653145 0.151503
H -1.288024 0.165372 1.402090
H -2.321675 1.089828 -1.428621
H -1.272638 2.055934 -0.237138
H -3.547106 -0.993059 0.837214
H -2.878899 -1.418469 -0.771131
H -2.193158 -2.156200 0.707056
H 1.190779 -1.613903 -0.530558
H 3.234760 -1.295083 1.023874
H 3.230800 0.394539 0.412136
H 3.666795 -0.950522 -0.688448


