%chk=000081605.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081605

0 1
 S  -0.9902000      0.1725000      0.6627000    
 S   -2.968100      0.1217000     -2.6699999E-02
 O   -3.754600       1.177300      0.9346000    
 O   -2.971200      0.6576000      -1.374400    
 O   -3.488100      -1.204000      0.2468000    
 N    1.932500      0.1823000     -0.2654000    
 N    3.857400       1.475300     -0.1224000    
 N    4.037000     -0.7212000      0.4591000    
 C  -0.1651000      -1.012800     -0.4355000    
 C    1.312100      -1.125000     -9.3000002E-02
 C    3.198200      0.2763000      1.4100000E-02
 H  -0.2923000     -0.6770000      -1.470100    
 H  -0.6470000      -1.990000     -0.3323000    
 H    1.770900      -1.855900     -0.7699000    
 H    1.429400      -1.488600      0.9357000    
 H    3.372000       2.306200     -0.4426000    
 H    4.844700       1.565000      9.0700001E-02
 H    5.016000     -0.5349000      0.6483000    
 H    3.715600      -1.670500      0.6116000    
 H   -3.715100      0.9793000       1.899700    


%chk=000081605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081605

0 1
S -0.112267 0.521811 -0.014859
S -2.713089 0.397142 -0.133491
O -2.987509 1.107021 1.605458
O -3.571531 1.364532 -1.126050
O -3.169889 -1.173311 -0.105976
N 1.877930 -0.221472 -0.008730
N 3.324114 1.606801 0.095258
N 4.195608 -0.560782 0.427759
C -0.062836 -1.313046 -0.598253
C 1.393683 -1.605454 -0.164314
C 3.095441 0.245981 0.173161
H -0.203891 -1.340514 -1.687877
H -0.853347 -1.884026 -0.092020
H 1.966790 -2.181903 -0.917112
H 1.416897 -2.150732 0.800523
H 2.562876 2.199526 -0.231498
H 4.089419 2.036894 0.608821
H 5.137506 -0.239780 0.214383
H 4.064555 -1.535987 0.682687
H -3.956360 1.360899 1.643130


