%chk=000029649.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029649

0 1
 S  -0.8367000       2.322900     -0.7677000    
 O   -1.327700      -1.302300      -1.081900    
 O   -2.299100     -0.7560000      0.8938000    
 O    2.880900     -0.3602000      0.6310000    
 N   0.9052000     -0.2551000     -0.6094000    
 C  -2.9600000E-02 -2.2299999E-02  0.4934000    
 C  -0.2086000       1.480000      0.7198000    
 C   -1.334900     -0.7097000      0.1387000    
 C    2.250500     -0.3973000     -0.4178000    
 H   0.3731000     -0.5021000       1.392300    
 H  -0.9185000       1.660700       1.533400    
 H   0.7447000       1.944000      0.9934000    
 H   0.5411000     -0.2937000      -1.557300    
 H    2.761600     -0.5599000      -1.381200    
 H   0.2117000       2.044800      -1.556400    
 H   -2.178200      -1.750800      -1.276100    


%chk=000029649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029649

0 1
S -0.837287 2.419538 -0.730780
O -1.439738 -1.366956 -1.098921
O -2.358664 -0.648416 0.911921
O 2.817980 0.084440 0.639764
N 0.939746 -0.372299 -0.668459
C -0.014247 -0.097556 0.414192
C -0.171261 1.416213 0.725645
C -1.384464 -0.713091 0.139494
C 2.299535 -0.285418 -0.451792
H 0.374257 -0.559277 1.346376
H -0.910955 1.553308 1.529666
H 0.800849 1.824559 1.038342
H 0.567492 -0.738011 -1.548236
H 2.897951 -0.573366 -1.344801
H 0.308308 2.326583 -1.503612
H -2.354001 -1.727251 -1.250800