%chk=000099786.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099786

0 1
 S   -1.712200      0.9956000     -0.2630000    
 O    3.788400      0.7219000       1.580500    
 O    4.710000      0.7058000     -0.6462000    
 O   -3.049800      -2.467500      0.5656000    
 O   -5.539400       1.801400     -0.1180000    
 N   -3.886400     -0.3354000      0.2075000    
 N   -4.188100       1.989700     -0.2409000    
 C    2.933700      0.1791000      0.6711000    
 C   0.9407000     -0.8360000     -0.1302000    
 C    3.459900      0.1700000     -0.6004000    
 C    1.674600     -0.3176000      0.9394000    
 C    1.478400     -0.8452000      -1.429300    
 C    2.756100     -0.3362000      -1.673800    
 C  -0.3922000      -1.371500      0.1008000    
 C    4.912000       1.052800      0.7388000    
 C   -1.548900     -0.6789000      6.4199999E-02
 C   -2.883900      -1.282600      0.3094000    
 C   -3.452700      0.8545000     -7.5499997E-02
 H    1.277100     -0.3017000       1.949200    
 H   0.9054000      -1.249800      -2.260900    
 H    3.174300     -0.3412000      -2.673900    
 H  -0.4128000      -2.437100      0.3193000    
 H    5.796100      0.5208000       1.108600    
 H    5.096000       2.131200      0.8073000    
 H   -3.834800       2.901700     -0.5033000    
 H   -5.793100       2.540300      0.4606000    


%chk=000099786-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099786

0 1
S -1.717230 1.317410 0.630742
O 3.573338 1.662137 0.822701
O 5.063393 0.020100 -0.102740
O -3.199685 -1.917886 -1.167725
O -5.819874 1.761497 0.874699
N -4.029554 0.026519 -0.085947
N -4.413598 2.015263 1.025167
C 2.839827 0.606126 0.228466
C 0.932571 -0.689893 -0.491861
C 3.721807 -0.357404 -0.313900
C 1.457219 0.478060 0.160782
C 1.841077 -1.652501 -1.032839
C 3.246319 -1.505165 -0.954725
C -0.491793 -0.969161 -0.644395
C 5.005902 1.329638 0.609320
C -1.616650 -0.289483 -0.263793
C -3.007224 -0.830931 -0.563550
C -3.552642 1.110652 0.515948
H 0.814940 1.247880 0.593707
H 1.430147 -2.538942 -1.527925
H 3.927397 -2.249676 -1.372983
H -0.741189 -1.906319 -1.166629
H 5.502723 1.224244 1.588184
H 5.466223 2.102429 -0.029732
H -4.220005 2.897598 1.492080
H -5.805040 0.871907 0.383847


