%chk=000044993.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044993

0 1
 O   -2.582500     -0.7129000     -0.5301000    
 N   9.4599999E-02 -0.3270000      0.2450000    
 N    2.285500      -1.088500      0.1112000    
 N    1.922200       1.113800     -0.3501000    
 C  -0.8297000      0.7921000      0.1155000    
 C   -2.240100      0.3082000      0.3981000    
 C    1.350000     -8.5800000E-02  1.0500000E-02
 H  -0.5779000       1.591400      0.8216000    
 H  -0.7920000       1.188800     -0.9065000    
 H   -2.958600       1.125900      0.2903000    
 H   -2.328400     -0.1018000       1.409300    
 H    2.016400      -2.031600      0.3695000    
 H    3.268700     -0.9165000     -6.7599997E-02
 H    2.921100       1.189300     -0.5096000    
 H    1.376200       1.959800     -0.4680000    
 H   -1.930400      -1.427600     -0.4310000    


%chk=000044993-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044993

0 1
O -2.517960 -0.941500 -0.295519
N 0.070714 -0.281820 -0.016576
N 2.252101 -1.141647 0.127644
N 2.001860 1.160222 -0.257437
C -0.874630 0.854790 -0.013997
C -2.233073 0.280254 0.452213
C 1.365753 -0.073129 -0.057819
H -0.565088 1.691736 0.655542
H -0.996485 1.264659 -1.041443
H -3.058253 0.986052 0.252981
H -2.187177 0.072623 1.543339
H 1.816916 -2.035449 0.348642
H 3.138819 -1.155265 -0.373438
H 2.954517 1.311757 0.065433
H 1.448044 1.969317 -0.522260
H -1.620960 -1.385000 -0.359204


