%chk=000133117.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133117

0 1
 S   -5.124800      0.4502000      8.8100001E-02
 S   -3.235000     -5.9000000E-02 -0.6625000    
 O  -0.2541000     -0.3299000      0.1031000    
 O    1.508300      -1.760100     -0.2484000    
 O   -4.923300       1.371100       1.190200    
 O   -5.867400     -0.7816000      0.2742000    
 N    5.428900      0.6963000      8.8999998E-03
 N    1.741400      0.5382000     -0.4738000    
 C    4.018700      0.6886000      0.3965000    
 C    3.132300      0.5757000     -0.8352000    
 C    5.761900     -0.5199000     -0.7318000    
 C    6.282700      0.8260000       1.189100    
 C   -1.095800      -1.449600      0.4007000    
 C   -2.501800     -0.9727000      0.7290000    
 C    1.042700     -0.6258000     -0.2100000    
 C   -5.914700       1.352400      -1.218100    
 H    3.803100     -0.1337000       1.092400    
 H    3.772500       1.619800      0.9230000    
 H    3.273000       1.437500      -1.496900    
 H    3.321900     -0.3330000      -1.412800    
 H    1.241200       1.419000     -0.4010000    
 H    5.359700     -0.5028000      -1.749200    
 H    5.426200      -1.430000     -0.2210000    
 H    6.848000     -0.5993000     -0.8650000    
 H    7.336900      0.8922000      0.8975000    
 H    6.167500     -1.8300001E-02   1.878500    
 H    6.051400       1.749100       1.732500    
 H  -0.6867000      -1.981800       1.267600    
 H   -1.112800      -2.135200     -0.4555000    
 H   -2.472500     -0.2966000       1.589500    
 H   -3.140800      -1.825400      0.9769000    
 H   -5.996600      0.7087000      -2.095900    
 H   -6.910300       1.643800     -0.8766000    
 H   -5.324000       2.242400      -1.443200    


%chk=000133117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133117

0 1
S -5.449675 0.289378 0.044560
S -3.267686 1.298981 0.678811
O -0.336830 0.167403 0.757956
O 0.963175 -1.120915 -0.735241
O -6.724553 1.120922 0.617687
O -5.284946 -1.311263 0.369304
N 5.488928 0.395707 -0.174928
N 1.731197 0.912071 0.171542
C 4.165690 0.389152 0.486326
C 3.053663 0.894421 -0.468283
C 5.670893 -0.721919 -1.125427
C 6.612770 0.494159 0.778554
C -1.415530 -0.841925 0.629328
C -2.607566 -0.305839 1.405643
C 0.823578 -0.103502 -0.008214
C -5.434746 0.485657 -1.851338
H 3.880838 -0.623366 0.867935
H 4.214718 1.064753 1.361886
H 3.315139 1.909725 -0.815884
H 2.978042 0.238671 -1.351406
H 1.472757 1.671917 0.801827
H 4.863451 -0.728196 -1.876582
H 5.679583 -1.722362 -0.623786
H 6.628398 -0.597224 -1.661715
H 7.561187 0.598563 0.221138
H 6.707715 -0.396224 1.450436
H 6.490361 1.390852 1.411699
H -1.066016 -1.800380 1.058986
H -1.647524 -1.000320 -0.438355
H -2.361592 -0.109981 2.461064
H -3.447395 -1.037094 1.358537
H -4.544772 -0.048913 -2.207403
H -6.373483 0.038199 -2.206943
H -5.382068 1.565191 -2.046914


