%chk=000081866.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081866

0 1
 S    2.212000     -0.1893000      0.4323000    
 O    2.128200      -1.460800       1.140800    
 O    3.013500      0.8943000      0.9887000    
 O   -4.094600     -0.2526000     -0.2416000    
 O   -2.838600      -2.114900      0.1055000    
 N    2.686200     -0.4909000      -1.196700    
 N    3.992400     -0.9381000      -1.152600    
 C   0.5940000      0.4199000      0.1897000    
 C  -0.4880000     -0.4602000      0.1725000    
 C   0.3836000       1.787200      1.1500000E-02
 C   -1.780300      2.7000001E-02 -2.3100000E-02
 C  -0.9087000       2.274400     -0.1841000    
 C   -1.990700       1.394300     -0.2015000    
 C   -2.908700     -0.8903000     -4.1400000E-02
 H  -0.3252000      -1.526900      0.3041000    
 H    1.211600       2.490500      1.3800000E-02
 H   -1.071800       3.339000     -0.3247000    
 H   -2.979600       1.816300     -0.3573000    
 H    2.104700      -1.151900      -1.729000    
 H    4.306000     -0.9956000      -2.120500    
 H    3.962900      -1.898300     -0.8103000    
 H   -4.849000     -0.8797000     -0.2517000    


%chk=000081866-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081866

0 1
S 2.023707 -0.756223 0.263642
O 1.740257 -2.027561 1.274349
O 3.116890 0.429155 0.681447
O -4.439228 0.123977 0.016878
O -3.370061 -1.915814 0.324743
N 3.208125 -1.313273 -1.710879
N 4.279943 -0.513296 -1.546891
C 0.377889 0.159487 0.073662
C -0.804854 -0.583219 0.175505
C 0.405079 1.548816 -0.142111
C -2.035109 0.111294 0.040079
C -0.829993 2.226275 -0.269589
C -2.044426 1.512305 -0.184943
C -3.294215 -0.678264 0.145124
H -0.796629 -1.659579 0.378130
H 1.362901 2.078552 -0.170486
H -0.840861 3.309273 -0.428320
H -3.004419 2.026192 -0.282685
H 3.418593 -2.252188 -1.295627
H 4.184623 0.422116 -1.946443
H 4.947273 -0.601836 -0.767766
H -5.245585 -0.452789 0.096581


