%chk=000116349.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116349

0 1
 S   0.9315000      0.7247000     -0.6959000    
 N   -2.810000     -0.3990000      0.4122000    
 N    3.200800      0.8008000      0.6427000    
 N    2.577600      -1.312800     -0.2071000    
 C   -1.755200      0.3480000     -0.2666000    
 C  -0.3916000     -0.1960000      0.1410000    
 C   -4.124200      8.0499999E-02  1.0300000E-02
 C    2.371000     -4.6200000E-02 -3.6600001E-02
 H   -1.828100       1.411700     -6.8999999E-03
 H   -1.878900      0.2528000      -1.352800    
 H  -0.3145000      -1.256300     -0.1228000    
 H  -0.2481000     -0.1046000       1.223400    
 H   -2.705900     -0.2980000       1.421400    
 H   -4.264500       1.135100      0.2692000    
 H   -4.896400     -0.4977000      0.5272000    
 H   -4.282600     -4.8799999E-02  -1.065300    
 H    4.059800      0.4687000       1.067300    
 H    2.980900       1.785800      0.7432000    
 H    1.808700      -1.706900     -0.7590000    


%chk=000116349-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116349

0 1
S 0.935026 1.025795 -0.407153
N -2.878400 -0.426933 0.272425
N 3.541817 0.810966 0.250783
N 2.473981 -1.267888 0.438315
C -1.806028 0.512616 -0.112001
C -0.443268 -0.179612 0.063222
C -4.241431 -0.003172 -0.101858
C 2.422586 0.002689 0.163452
H -1.819931 1.470931 0.463721
H -1.951187 0.775863 -1.177216
H -0.393233 -1.066085 -0.590147
H -0.280423 -0.481105 1.113820
H -2.813619 -0.693089 1.263772
H -4.547626 0.988649 0.311411
H -4.969664 -0.758302 0.242859
H -4.319663 0.055576 -1.203181
H 4.430368 0.366181 0.473761
H 3.471744 1.824305 0.221593
H 1.619251 -1.815583 0.257320


