%chk=000161712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161712

0 1
 S    2.785300      0.1285000     -0.5703000    
 O   -2.398500       1.605900      0.4677000    
 O    3.792800     -0.7512000      0.3219000    
 O   -3.378700     -0.1313000     -0.6247000    
 O    2.872100       1.544500     -9.5799997E-02
 N   -1.391600      -1.819700      1.2800000E-02
 C   5.5100001E-02  0.1480000     -0.1896000    
 C   -1.208800     -0.4356000      0.4519000    
 C    1.316200     -0.6144000      0.2078000    
 C   -2.444000      0.3253000      1.8400000E-02
 H   0.1565000       1.200200      0.1071000    
 H  -4.7499999E-02  0.1591000      -1.283700    
 H   -1.147100     -0.4144000       1.545200    
 H    1.448900     -0.5856000       1.294700    
 H    1.277300      -1.659300     -0.1147000    
 H   -1.484400      -1.858500      -1.001400    
 H   -2.255000      -2.197300      0.4010000    
 H   -3.196500       2.113500      0.2069000    
 H    4.592900     -0.2249000      0.5562000    


%chk=000161712-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161712

0 1
S 2.852676 0.115796 -0.630334
O -2.479090 1.568365 0.790656
O 3.855535 -0.621879 0.806141
O -3.261553 0.201116 -0.920876
O 2.679831 1.732008 -0.406108
N -1.430098 -1.872881 -0.057289
C 0.039816 0.129632 -0.292825
C -1.240757 -0.478506 0.359498
C 1.274934 -0.635071 0.181003
C -2.434820 0.423526 -0.009360
H 0.131623 1.196549 -0.020091
H -0.065310 0.067724 -1.394185
H -1.119528 -0.439726 1.457072
H 1.472569 -0.525374 1.260010
H 1.260423 -1.697361 -0.104691
H -1.773372 -1.952074 -1.022319
H -2.005089 -2.426139 0.585797
H -3.227929 2.159121 0.503458
H 4.815141 -0.412026 0.625843


