%chk=000104704.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104704

0 1
 S    3.149800      0.2532000     -0.2133000    
 O   -4.038600     -0.4240000     -0.5910000    
 O    4.346100      0.7306000      0.4551000    
 O    3.189100     -0.9453000      -1.027500    
 N    1.881600      0.1725000      0.9450000    
 C  -0.5247000      0.2170000      0.3500000    
 C   0.6678000     -0.4916000      0.5698000    
 C   -1.693300     -0.4918000     -1.6799999E-02
 C   0.7075000      -1.879100      0.4298000    
 C  -0.5828000       1.613700      0.4861000    
 C   -1.635000      -1.888400     -0.1532000    
 C   -2.885700      0.2167000     -0.2366000    
 C  -0.4418000      -2.576100      6.8899997E-02
 C   -1.776000       2.301400      0.2637000    
 C   -2.925400       1.604300     -9.6799999E-02
 C    2.561500       1.586800      -1.233000    
 H    1.775400      0.9811000       1.569600    
 H    1.623000      -2.435300      0.6146000    
 H   0.2848000       2.205000      0.7648000    
 H   -2.495400      -2.482700     -0.4470000    
 H  -0.4098000      -3.656500     -3.9500002E-02
 H   -1.807800       3.381700      0.3720000    
 H   -3.850800       2.147600     -0.2680000    
 H    1.634100       1.287500      -1.723300    
 H    2.418000       2.474000     -0.6140000    
 H    3.323600       1.788600      -1.989400    
 H   -4.040100      -1.331600     -0.2498000    


%chk=000104704-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104704

0 1
S 3.328984 0.416070 -0.011705
O -4.160031 -0.350324 -0.586214
O 4.257052 1.530935 0.716791
O 3.873300 -1.064071 -0.380486
N 1.827111 0.179539 1.193206
C -0.580497 0.296440 0.480910
C 0.664812 -0.434107 0.665837
C -1.734157 -0.435543 -0.009581
C 0.751544 -1.798539 0.325592
C -0.707648 1.692619 0.769589
C -1.597782 -1.818386 -0.359451
C -2.984564 0.275281 -0.148427
C -0.376087 -2.481394 -0.203903
C -1.933572 2.345020 0.595310
C -3.081347 1.639052 0.142892
C 2.623997 1.164252 -1.642858
H 1.713465 1.106309 1.634857
H 1.699667 -2.318877 0.487312
H 0.150051 2.270714 1.131066
H -2.446095 -2.386288 -0.764183
H -0.285809 -3.538285 -0.473604
H -2.019876 3.414422 0.813939
H -4.045814 2.138989 0.019761
H 1.824869 0.488666 -1.976925
H 2.260849 2.169896 -1.392222
H 3.474549 1.182112 -2.338417
H -4.041871 -1.325203 -0.698883


