%chk=000087198.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087198

0 1
 S    1.278800      -1.443800     -8.7700002E-02
 N   0.7497000       1.066600      0.2288000    
 C   -1.202000     -0.4195000      0.5427000    
 C   -2.134600      0.3059000     -0.4281000    
 C   0.2470000     -0.1308000      0.2445000    
 C   -3.592800     -1.3800000E-02 -0.1403000    
 C    2.561600     -0.3224000     -0.2832000    
 C    2.092300      0.9579000     -7.6600000E-02
 H   -1.406500      -1.496800      0.5098000    
 H   -1.411300     -9.1200002E-02   1.568600    
 H   -1.984000       1.390200     -0.3596000    
 H   -1.899600      1.7400000E-02  -1.460000    
 H   -3.787100      -1.086400     -0.2414000    
 H   -3.868500      0.2920000      0.8740000    
 H   -4.242900      0.5164000     -0.8434000    
 H    3.563800     -0.6417000     -0.5306000    
 H    2.693400       1.855000     -0.1380000    


%chk=000087198-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087198

0 1
S 1.081437 -1.160515 -0.875910
N 1.003470 0.903784 0.816196
C -1.238253 -0.240642 0.644722
C -2.177305 0.119859 -0.542070
C 0.217720 -0.043093 0.332338
C -3.663733 -0.068088 -0.174139
C 2.555470 -0.176158 -0.604554
C 2.308358 0.839376 0.302238
H -1.426654 -1.288635 0.949719
H -1.474055 0.404062 1.510874
H -1.987820 1.168354 -0.840475
H -1.922287 -0.509930 -1.416671
H -3.877388 -1.118131 0.101173
H -3.945388 0.569568 0.684555
H -4.319811 0.198989 -1.022164
H 3.480945 -0.416859 -1.122760
H 3.042596 1.573058 0.636427


