%chk=000131689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131689

0 1
 S   -1.649300      4.6700001E-02  -1.466700    
 O    1.742500       1.866300      -1.155900    
 O    1.082100       2.551100      0.9040000    
 N    2.295700      -2.696000     -4.1400000E-02
 C   0.7032000     -0.7722000     -0.2795000    
 C    1.595100      0.1962000      0.5303000    
 C   0.9108000      -2.258800      9.3500003E-02
 C  -0.7682000     -0.4120000     -9.9299997E-02
 C   -1.468600     -0.4156000       1.053900    
 C    1.425400       1.652700      0.1483000    
 C   -2.817200     -1.9500000E-02  0.8205000    
 C   -3.051500      0.2610000     -0.5077000    
 H   0.9751000     -0.6629000      -1.339400    
 H    1.385100      0.1073000       1.603500    
 H    2.657800     -3.7999999E-02  0.4003000    
 H   0.2836000      -2.890800     -0.5466000    
 H   0.5936000      -2.448900       1.125600    
 H   -1.070500     -0.6800000       2.024900    
 H    2.882200      -2.212300      0.6364000    
 H    2.649500      -2.436400     -0.9612000    
 H   -3.576800      5.6200001E-02   1.587700    
 H   -3.979000      0.5818000     -0.9606000    
 H    1.649500       2.810600      -1.404500    


%chk=000131689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131689

0 1
S -1.966594 -1.074024 -1.332029
O 1.908602 1.951483 -0.835431
O 1.210045 2.483242 1.313650
N 2.359180 -2.662373 -0.343565
C 0.688332 -0.700866 -0.290948
C 1.571152 0.115512 0.689744
C 0.983383 -2.245271 -0.107905
C -0.783695 -0.405274 -0.120629
C -1.461583 0.293618 0.870253
C 1.523981 1.611886 0.472791
C -2.896962 0.317861 0.704277
C -3.337694 -0.362181 -0.416886
H 1.001193 -0.430636 -1.320166
H 1.287972 -0.084438 1.737254
H 2.616112 -0.221520 0.539807
H 0.311121 -2.795904 -0.793558
H 0.690743 -2.537216 0.918557
H -0.953705 0.804415 1.692048
H 3.035619 -2.572998 0.411618
H 2.735633 -2.565069 -1.285373
H -3.572756 0.830504 1.393151
H -4.351473 -0.503595 -0.786879
H 1.851495 2.939342 -0.943680


