%chk=000125916.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125916

0 1
 S   -1.437100     -0.1152000      -1.249000    
 O    1.780400       2.022800      -1.212200    
 O    1.257800       2.608000      0.9169000    
 N    2.869800      -2.480900     -0.2678000    
 C    1.085800     -0.7176000     -0.3079000    
 C  -0.3892000     -0.5049000      1.8300001E-02
 C    1.954800      0.3202000      0.4386000    
 C    1.468900      -2.182500      7.1999999E-03
 C  -0.9721000     -0.5947000       1.231800    
 C   -2.755100     -5.4299999E-02 -0.1577000    
 C   -2.368800     -0.3299000       1.135500    
 C    1.611300       1.759100      0.1103000    
 C   -4.106500      0.2700000     -0.6641000    
 H    1.243400     -0.5658000      -1.385600    
 H    1.857800      0.1945000       1.524100    
 H    3.017600      0.1924000      0.2037000    
 H   0.8464000      -2.862400     -0.5868000    
 H    1.271400      -2.418700       1.059400    
 H  -0.4591000     -0.8332000       2.154400    
 H   -3.051100     -0.3418000       1.976100    
 H    3.469700      -1.953200      0.3638000    
 H    3.107600      -2.173800      -1.210000    
 H   -4.842100      0.2700000      0.1473000    
 H   -4.123900       1.262600      -1.126500    
 H   -4.433600     -0.4651000      -1.407100    
 H    1.574300       2.957300      -1.427500    


%chk=000125916-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125916

0 1
S -1.619574 -0.846568 -1.247660
O 2.248333 2.144855 -0.732700
O 1.711619 2.486427 1.499640
N 2.761546 -2.499270 -0.657518
C 1.093971 -0.556631 -0.337859
C -0.364900 -0.288101 -0.051441
C 2.031978 0.183049 0.652273
C 1.402133 -2.108150 -0.302504
C -0.983865 0.300360 1.041819
C -2.957483 -0.240993 -0.179638
C -2.427285 0.325470 0.967609
C 1.963397 1.691741 0.566852
C -4.392334 -0.390791 -0.603122
H 1.342328 -0.199171 -1.357984
H 1.814443 -0.107494 1.694307
H 3.068218 -0.127834 0.412248
H 0.689321 -2.604611 -0.988347
H 1.174568 -2.485933 0.712330
H -0.428862 0.731881 1.878563
H -3.058239 0.760980 1.747153
H 3.484811 -2.447094 0.057440
H 3.076644 -2.316975 -1.609832
H -5.054193 0.038165 0.169362
H -4.600941 0.133037 -1.554972
H -4.676630 -1.451161 -0.739971
H 2.179395 3.137712 -0.750849


