%chk=000134030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134030

0 1
 S   -2.481900      0.7182000       1.072700    
 N    2.632700       1.186700     -0.1501000    
 N    3.037000     -0.9949000     -0.2823000    
 N    4.821000      0.5790000     -0.6866000    
 C    1.436900      0.5753000      0.1276000    
 C    1.715400     -0.7858000      3.8600001E-02
 C  -0.8395000      0.1444000      0.6680000    
 C   0.1743000       1.080600      0.4393000    
 C   -3.458500      1.8400000E-02 -0.2867000    
 C   -4.928500      0.3938000     -0.1368000    
 C   0.6849000      -1.712300      0.2713000    
 C  -0.5907000      -1.227600      0.5859000    
 C    3.556800      0.2077000     -0.3877000    
 C   -5.759900     -0.1834000      -1.273100    
 H   1.9999999E-04   2.150000      0.4982000    
 H   -3.357400      -1.071700     -0.2886000    
 H   -3.065800      0.3975000      -1.236500    
 H   -5.323900      1.7999999E-02  0.8146000    
 H   -5.046000       1.484400     -0.1342000    
 H    2.801100       2.183400     -0.1747000    
 H   0.8687000      -2.780300      0.2121000    
 H   -1.380200      -1.952000      0.7748000    
 H   -5.697600      -1.276200      -1.289200    
 H   -6.811600      9.4999999E-02  -1.152300    
 H   -5.417500      0.1952000      -2.241500    
 H    5.545700     -0.1070000     -0.8719000    
 H    5.109000       1.551200     -0.7400000    


%chk=000134030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134030

0 1
S -2.556257 0.485794 1.293456
N 2.546154 1.246023 -0.284545
N 3.139100 -0.969528 -0.204624
N 4.832308 0.615959 -0.860288
C 1.383987 0.553803 0.121067
C 1.780717 -0.827994 0.163161
C -0.843602 -0.015069 0.817950
C 0.084944 0.985167 0.438318
C -3.477998 0.067265 -0.327963
C -4.980971 0.337385 -0.148824
C 0.838761 -1.807881 0.546474
C -0.468971 -1.386917 0.877096
C 3.554961 0.284475 -0.461373
C -5.777211 0.003945 -1.431810
H -0.219846 2.035667 0.404406
H -3.282061 -0.995177 -0.554336
H -3.044970 0.691722 -1.128556
H -5.363885 -0.266175 0.696881
H -5.135605 1.400211 0.121534
H 2.627671 2.251906 -0.415260
H 1.125456 -2.862554 0.593129
H -1.214342 -2.121622 1.199129
H -5.663814 -1.061603 -1.705534
H -6.854793 0.204417 -1.289694
H -5.429215 0.612010 -2.287727
H 5.499006 -0.143805 -0.961181
H 5.125177 1.570174 -1.039986


