%chk=000076096.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076096

0 1
 S   0.9981000      5.9000002E-03 -0.6078000    
 O    1.292100      -1.247800      -1.297900    
 O    1.243900       1.270800      -1.294200    
 O    4.103700     -1.4000000E-03  0.7475000    
 N    1.756000     -4.9000001E-03  0.8501000    
 C  -0.6985000      6.9999998E-04 -0.1961000    
 C   -1.377500       1.206700     -2.2000000E-02
 C   -1.374700      -1.209200     -3.9700001E-02
 C   -2.732700       1.202700      0.3085000    
 C   -2.729900      -1.213200      0.2906000    
 C   -3.408900     -7.1999999E-03  0.4647000    
 C    2.928400     -3.1999999E-03  0.7964000    
 H  -0.8706000       2.161400     -0.1296000    
 H  -0.8645000      -2.160300     -0.1631000    
 H   -3.261100       2.141600      0.4463000    
 H   -3.256200      -2.155100      0.4142000    
 H   -4.463800     -1.0300000E-02  0.7230000    


%chk=000076096-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076096

0 1
S 0.969753 0.008820 -0.899545
O 1.313396 -1.395738 -1.629100
O 1.305633 1.423728 -1.612652
O 4.240960 -0.006870 1.303849
N 1.819670 -0.000368 0.863843
C -0.804741 0.001583 -0.282610
C -1.424301 1.242927 -0.075241
C -1.419232 -1.244710 -0.090473
C -2.768781 1.223402 0.362783
C -2.763784 -1.236186 0.347675
C -3.430296 -0.009099 0.575926
C 3.064282 -0.002789 1.010460
H -0.890052 2.179930 -0.259379
H -0.881027 -2.177156 -0.285970
H -3.292762 2.168519 0.535899
H -3.283868 -2.185514 0.509077
H -4.471050 -0.013277 0.916360


