%chk=000079823.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079823

0 1
 S    2.209200       1.104000      0.3076000    
 O   -2.705900       1.100900     -0.1751000    
 N  -0.4040000      0.9963000      5.1899999E-02
 N   0.7196000      -1.086000      0.1789000    
 C   0.7200000      0.2084000      0.1686000    
 C   -1.669500      0.4546000     -6.8000004E-02
 C   -1.684000      -1.027300     -5.7700001E-02
 C  -0.5165000      -1.672500      6.2399998E-02
 C    3.331000     -7.8400001E-02 -0.4686000    
 H  -0.3001000       2.006300      5.3900000E-02
 H   -2.629500      -1.547000     -0.1464000    
 H  -0.5105000      -2.757900      7.1699999E-02
 H    3.424200     -0.9834000      0.1380000    
 H    4.321900      0.3754000     -0.5580000    
 H    2.982500     -0.3428000      -1.470900    


%chk=000079823-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079823

0 1
S 2.232353 1.254352 -0.190774
O -2.804870 1.160148 0.226217
N -0.473049 1.019355 0.022051
N 0.709926 -1.040316 -0.196313
C 0.691431 0.286139 -0.117054
C -1.788254 0.421198 0.097457
C -1.738770 -1.034223 0.007323
C -0.524762 -1.686671 -0.131859
C 3.475444 -0.147001 -0.366497
H -0.453641 2.044497 0.078665
H -2.684974 -1.576841 0.054544
H -0.474495 -2.777922 -0.201163
H 3.402409 -0.807939 0.507144
H 4.458506 0.345575 -0.416932
H 3.261148 -0.709751 -1.284509


