%chk=000139409.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139409

0 1
 S    4.566300      -1.517800      0.6466000    
 N    2.363500     -0.1950000     -0.3795000    
 C  -0.3850000      0.9239000     -0.2560000    
 C   0.8509000       1.733800     -0.4588000    
 C  -0.7286000     -6.7199998E-02  -1.175400    
 C   -1.197400       1.157800      0.8536000    
 C   -2.696900     -0.5905000      0.1239000    
 C    2.096700       1.125900      0.1962000    
 C   -1.884600     -0.8244000     -0.9855000    
 C   -2.353400      0.4005000       1.043500    
 C   -3.932200      -1.400700      0.3274000    
 C    3.300600     -0.7463000      6.3900001E-02
 H    1.029700       1.862600      -1.534600    
 H   0.6972000       2.746700     -6.4800002E-02
 H  -0.1066000     -0.2591000      -2.045800    
 H  -0.9393000       1.925300       1.578500    
 H    2.946700       1.799600      2.4000000E-02
 H    1.940700       1.049600       1.281200    
 H   -2.140800      -1.594700      -1.708200    
 H   -2.977000      0.5904000       1.913100    
 H   -4.702000     -0.8232000      0.8505000    
 H   -4.362200      -1.713100     -0.6303000    
 H   -3.702700      -2.293900      0.9169000    


%chk=000139409-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139409

0 1
S 3.597529 -2.445015 -0.653082
N 2.613626 0.112877 0.089935
C -0.327837 1.009930 -0.241531
C 0.914152 1.871026 -0.408863
C -0.522075 -0.159590 -1.019473
C -1.314619 1.342441 0.721513
C -2.647422 -0.645025 0.132871
C 2.121195 1.400144 0.462226
C -1.662197 -0.971203 -0.835121
C -2.454566 0.529678 0.904746
C -3.859238 -1.535061 0.348308
C 3.029021 -0.971861 -0.222866
H 1.239128 1.893659 -1.465579
H 0.701674 2.914193 -0.107489
H 0.220170 -0.434878 -1.778626
H -1.195408 2.250116 1.327621
H 2.943083 2.138504 0.369712
H 1.814546 1.374121 1.526422
H -1.789306 -1.870831 -1.449622
H -3.208290 0.813026 1.649763
H -4.725003 -0.959231 0.720328
H -4.160564 -2.042096 -0.585356
H -3.643999 -2.324725 1.094562


