%chk=000052687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052687

0 1
 S    1.884300       1.084900      2.8899999E-02
 O   -2.407300      0.4003000     -0.2150000    
 N  -0.4180000     -0.2132000     -0.1797000    
 N   -1.644000     -0.4842000      0.1854000    
 C   0.5797000      -1.200400      0.2431000    
 C    1.931000     -0.7004000     -0.2579000    
 C   7.4400000E-02   1.113000      0.1953000    
 H   0.3738000      -2.190900     -0.1814000    
 H   0.5984000      -1.308100       1.337400    
 H    2.762800      -1.163200      0.2799000    
 H    2.050600     -0.8853000      -1.330200    
 H  -0.3274000       1.898100     -0.4543000    
 H  -0.1555000       1.364400       1.238000    


%chk=000052687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052687

0 1
S 1.897362 1.154444 -0.136155
O -2.328165 0.417112 -0.754440
N -0.410913 -0.199247 0.259461
N -1.556937 -0.561843 -0.455812
C 0.626666 -1.231016 0.436834
C 1.863594 -0.744580 -0.354293
C 0.056278 1.178373 0.425390
H 0.227918 -2.188311 0.063860
H 0.871581 -1.329941 1.509955
H 2.802520 -1.148895 0.052523
H 1.777461 -0.971931 -1.427648
H -0.552427 1.842398 -0.208518
H 0.027862 1.498438 1.478343


