%chk=000137833.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137833

0 1
 S    4.108900       1.454500       1.221200    
 O   -3.204200     -0.1121000      0.3252000    
 O   -2.166500       1.799200     -0.3999000    
 N    2.703700      0.2980000     -0.8728000    
 C  -0.8769000     -0.1625000     -8.7700002E-02
 C   0.3210000      0.4383000     -0.4751000    
 C  -0.8934000      -1.505000      0.2907000    
 C    1.502300     -0.3036000     -0.4840000    
 C   0.2877000      -2.246800      0.2818000    
 C    1.485500      -1.646100     -0.1055000    
 C   -2.108700      0.6106000     -7.8100003E-02
 C   -4.452200      0.5894000      0.3581000    
 C    3.292900      0.7861000      2.5900001E-02
 H   0.3446000       1.483900     -0.7745000    
 H   -1.804800      -2.009800      0.5987000    
 H   0.2752000      -3.292300      0.5759000    
 H    2.399300      -2.234800     -0.1106000    
 H   -4.398300       1.423300       1.064400    
 H   -5.224700     -0.1070000      0.6947000    
 H   -4.711800      0.9457000     -0.6432000    


%chk=000137833-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137833

0 1
S 5.185283 1.732860 -0.306640
O -3.348836 -0.166001 0.161260
O -2.229295 1.864894 -0.062812
N 2.706265 0.372956 -0.089380
C -0.953652 -0.214681 0.081000
C 0.283870 0.462237 -0.019151
C -0.992639 -1.627338 0.206942
C 1.493056 -0.278066 0.006783
C 0.215759 -2.356658 0.231572
C 1.456987 -1.696197 0.133080
C -2.196386 0.615235 0.049455
C -4.627952 0.582873 0.139802
C 3.760210 0.954119 -0.183193
H 0.294869 1.552192 -0.115246
H -1.958877 -2.131720 0.283628
H 0.193726 -3.446893 0.328239
H 2.397318 -2.255742 0.152010
H -4.665069 1.296596 0.979735
H -5.405405 -0.187385 0.237134
H -4.729633 1.135720 -0.809017


