%chk=000161432.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161432

0 1
 S    2.423400      -1.266200      0.1490000    
 S   -2.321200      -1.414600      0.1126000    
 S  -0.1023000       2.697400      0.1257000    
 O    2.459100     -0.2202000       1.371400    
 O   -1.497900      -1.925400       1.397400    
 O   -1.010900       2.216700       1.363700    
 O    3.799300      -1.312100     -0.4465000    
 O   -3.043200      -2.597900     -0.4604000    
 O  -0.7578000       3.906500     -0.4727000    
 N   1.4100000E-02 -1.8200001E-02 -0.4402000    
 C    1.403700     -0.1630000     -0.9038000    
 C  -0.8052000      -1.156300     -0.8877000    
 C  -0.5610000       1.253200     -0.9084000    
 H    1.448800     -0.5456000      -1.930600    
 H    1.930600      0.7986000     -0.9005000    
 H   -1.112800      -1.043100      -1.934200    
 H  -0.2519000      -2.100200     -0.8173000    
 H  -0.2634000       1.474100      -1.940700    
 H   -1.656900       1.232400     -0.8942000    
 H    3.334300     -0.2515000       1.824300    
 H   -1.995700      -2.637800       1.862900    
 H   -1.415900       2.994600       1.814300    


%chk=000161432-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161432

0 1
S 2.004455 -0.918352 0.828875
S -1.832176 -1.278277 0.802969
S -0.197548 2.219520 0.778641
O 2.470463 0.950395 0.600505
O -0.404871 -2.582827 0.647876
O -2.046182 1.661617 0.594302
O 3.339382 -1.818698 0.555903
O -3.250007 -2.024587 0.485856
O -0.107703 3.819373 0.462893
N 0.001493 -0.014056 -1.110659
C 1.219168 -0.758796 -1.027152
C -1.253476 -0.694765 -1.045859
C 0.039035 1.414082 -1.061444
H 1.084142 -1.815098 -1.291926
H 2.065066 -0.270732 -1.531956
H -2.094746 -0.053376 -1.337679
H -1.243830 -1.677362 -1.538999
H 1.019600 1.817834 -1.343999
H -0.809794 1.892135 -1.570795
H 3.034091 1.214676 1.379476
H -0.472362 -3.192564 1.433950
H -2.547000 2.031255 1.373323


