%chk=000126536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126536

0 1
 S  -2.2000000E-03   3.035200     -0.2934000    
 O   -1.385000      -1.886700      0.5046000    
 O   -3.094200     -0.4161000      0.2678000    
 O  -0.1690000     -0.4668000      -2.185300    
 O    2.730300      4.0800001E-02  0.7182000    
 N   0.4789000     -4.2199999E-02  2.9500000E-02
 C  -0.8371000      0.4516000      0.4462000    
 C   -1.249900       1.705600     -0.3287000    
 C   -1.895500     -0.6374000      0.3901000    
 C   0.6954000     -0.4723000      -1.303700    
 C    1.531600     -8.3700001E-02  0.9770000    
 C    2.077200     -0.9721000      -1.645400    
 C    1.119600     -0.2558000       2.423100    
 H  -0.8134000      0.7519000       1.497900    
 H   -2.174500       2.114700      9.4700001E-02
 H   -1.470600       1.480000      -1.376500    
 H    2.403300      -1.746200     -0.9463000    
 H    2.050100      -1.429900      -2.640300    
 H    2.784400     -0.1402000      -1.686200    
 H   0.8944000      0.7179000       2.865600    
 H    1.953100     -0.7013000       2.976000    
 H   0.2676000     -0.9321000       2.522800    
 H   0.9668000       2.356600     -0.9247000    
 H   -2.084800      -2.573400      0.4728000    


%chk=000126536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126536

0 1
S -0.098701 3.093470 0.335143
O -1.465725 -2.013460 0.412644
O -3.089388 -0.470176 -0.217348
O -0.369929 -0.603324 -2.006747
O 2.761706 -0.498984 0.735775
N 0.533513 -0.150200 0.070115
C -0.834110 0.327563 0.419102
C -1.199992 1.673366 -0.245559
C -1.914933 -0.723555 0.114838
C 0.669269 -0.611500 -1.285530
C 1.581083 -0.195019 1.049953
C 1.997119 -1.099382 -1.812846
C 1.212932 0.125965 2.493653
H -0.862499 0.475749 1.510715
H -2.219727 1.959998 0.053821
H -1.167256 1.598711 -1.340420
H 2.376918 -1.949111 -1.221176
H 1.841191 -1.400542 -2.860097
H 2.774925 -0.321354 -1.744667
H 0.863977 1.168478 2.603968
H 2.123626 -0.008200 3.095364
H 0.431249 -0.554622 2.877812
H 1.022163 2.740000 -0.399114
H -2.190912 -2.665771 0.216401


