%chk=000081986.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081986

0 1
 S    2.340500     -8.6199999E-02 -8.8200003E-02
 O    2.801100     -0.1510000       1.479100    
 O    2.619200      -1.392400     -0.6669000    
 O    2.903500       1.120200     -0.6746000    
 N   -2.450200      -1.954400      2.9000000E-03
 N   -3.558500      0.6678000      4.8999999E-02
 C   0.6080000      0.1277000     -4.8599999E-02
 C   -1.616700     -0.8137000     -7.1999999E-03
 C  -0.2327000     -0.9854000     -3.9000001E-02
 C   -2.159800      0.4710000      1.4900000E-02
 C   6.4700000E-02   1.412300     -2.6600000E-02
 C   -1.319200       1.583900      5.2999998E-03
 H   0.1821000      -1.990300     -4.8500001E-02
 H   0.6993000       2.294000     -2.5500000E-02
 H   -1.729100       2.590500      2.4300000E-02
 H   -3.455500      -1.865800      2.4400000E-02
 H   -2.034900      -2.876800     -1.4700000E-02
 H   -3.930000       1.608800      6.2199999E-02
 H   -4.195700     -0.1150000      5.3399999E-02
 H    2.423800     -0.8985000       2.000000    


%chk=000081986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081986

0 1
S 2.333377 -0.195428 -0.050751
O 2.587074 -0.222723 1.802006
O 2.670284 -1.677896 -0.612726
O 3.111175 1.098325 -0.638981
N -2.641792 -1.919768 -0.045765
N -3.636953 0.660676 0.059260
C 0.506199 0.088962 -0.036546
C -1.726824 -0.846826 -0.038023
C -0.330430 -1.042401 -0.039639
C -2.249713 0.495462 0.004882
C 0.035768 1.411043 -0.050092
C -1.360931 1.600186 -0.034456
H 0.103632 -2.046994 -0.086667
H 0.730290 2.255191 -0.070094
H -1.767539 2.617672 -0.016847
H -3.479317 -1.826904 -0.623336
H -2.269494 -2.864952 0.034759
H -4.025184 1.601168 0.082380
H -4.197215 -0.081736 0.478216
H 3.567494 -0.356356 1.958120


