%chk=000163344.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163344

0 1
 S    2.036000     -2.3300000E-02  8.5000001E-02
 O  -0.2246000      -1.989600      2.9999999E-02
 O    2.378500     -0.6403000      -1.388900    
 O    2.754800       1.236300      0.1975000    
 O    2.219400      -1.075700       1.070900    
 N   -2.956200      -1.397100     -3.9600000E-02
 C   0.3247000      0.3374000      4.1800000E-02
 C  -0.6241000     -0.6847000      1.8900000E-02
 C   -1.983500     -0.3739000     -1.5500000E-02
 C  -8.5800000E-02   1.670400      3.0500000E-02
 C   -2.394000      0.9592000     -2.6799999E-02
 C   -1.445200       1.981400     -3.7000000E-03
 H   0.6268000       2.489500      4.5400001E-02
 H   -3.450100       1.215400     -5.3700000E-02
 H   -1.765100       3.019200     -1.3200000E-02
 H   -3.939600      -1.162600     -6.3800000E-02
 H   -2.666600      -2.366200     -3.0999999E-02
 H   0.7386000      -2.065000     -4.7699999E-02
 H    2.221300     -3.2000002E-02  -2.149000    


%chk=000163344-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163344

0 1
S 2.020109 -0.004228 -0.006087
O -0.389274 -2.044472 0.201992
O 2.330687 0.085789 -1.829078
O 2.935867 1.115285 0.705115
O 2.187559 -1.575664 0.451568
N -2.987780 -1.448356 0.148803
C 0.212380 0.377557 -0.018229
C -0.699784 -0.699736 0.075159
C -2.104077 -0.386964 0.054117
C -0.166858 1.735021 -0.128115
C -2.498638 0.969169 -0.059550
C -1.545632 2.012507 -0.142564
H 0.586399 2.524928 -0.185059
H -3.567824 1.209609 -0.073647
H -1.885996 3.049275 -0.222314
H -3.991948 -1.301354 0.141004
H -2.611164 -2.390217 0.232694
H 0.618636 -2.169162 0.307117
H 3.322639 0.039413 -1.965828


