%chk=000093193.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093193

0 1
 O   -2.581100      0.7544000     -0.4702000    
 N  -0.6194000      0.1974000     -1.8900000E-02
 N   -1.863200      0.2602000      0.4047000    
 C   0.1297000      -1.029600      0.3495000    
 C    1.549300      -1.011800     -0.2592000    
 C    2.316500      0.2523000      9.7800002E-02
 C    1.506600       1.474300     -0.2993000    
 C   0.1148000       1.427500      0.3257000    
 C  -0.5532000      -2.324800     -0.1301000    
 H   0.2247000      -1.080900       1.443900    
 H    1.487400      -1.095700      -1.352700    
 H    2.115900      -1.882900      9.2200004E-02
 H    3.285500      0.2610000     -0.4132000    
 H    2.518200      0.2721000       1.175600    
 H    2.026600       2.383600      2.2800000E-02
 H    1.420500       1.524000      -1.392100    
 H   0.2063000       1.526000       1.417000    
 H  -0.4312000       2.313300     -2.8000001E-02
 H   -1.530000      -2.461100      0.3460000    
 H  -0.7022000      -2.317800      -1.215700    
 H   5.5199999E-02  -3.200400      0.1220000    


%chk=000093193-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093193

0 1
O -2.403154 1.179826 -0.645106
N -0.559540 0.142122 0.137128
N -1.818111 0.049032 -0.430928
C 0.192787 -1.114868 0.398815
C 1.573377 -1.023663 -0.311122
C 2.329663 0.274392 0.057014
C 1.467865 1.521831 -0.249681
C 0.097204 1.428746 0.459307
C -0.595112 -2.370219 -0.008020
H 0.378322 -1.146656 1.495987
H 1.407872 -1.066672 -1.406141
H 2.169328 -1.913337 -0.031980
H 3.286928 0.324068 -0.494932
H 2.583743 0.259503 1.137376
H 1.982684 2.443898 0.079648
H 1.304985 1.606174 -1.341517
H 0.230772 1.493224 1.558293
H -0.595167 2.227900 0.142507
H -1.557027 -2.439042 0.525216
H -0.812402 -2.374178 -1.089215
H 0.011882 -3.260981 0.235150


