%chk=000125337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125337

0 1
 S    3.660400      -1.253700     -0.1339000    
 S    3.150600       1.446900       1.115300    
 O   -3.118500     -0.9085000       1.062200    
 N    1.417000      2.1199999E-02 -0.3156000    
 N   -3.623900      0.9166000     -0.2448000    
 C   -1.455600     -0.1100000     -0.4583000    
 C  -0.6280000      -1.287300      7.0100002E-02
 C  -0.7281000       1.218200     -0.2189000    
 C   0.7830000      -1.276700     -0.5107000    
 C   0.6850000       1.187500     -0.7938000    
 C   -2.799100     -8.6400002E-02  0.2068000    
 C    2.657100      0.1323000      0.2217000    
 H   -1.616700     -0.2455000      -1.536200    
 H   -1.117800      -2.238500     -0.1717000    
 H  -0.5591000      -1.234800       1.165200    
 H  -0.6778000       1.422100      0.8591000    
 H   -1.269400       2.056900     -0.6706000    
 H    1.311400      -2.103700     -3.0800000E-02
 H   0.7519000      -1.472300      -1.589400    
 H   0.6317000       1.094000      -1.886200    
 H    1.192300       2.134900     -0.5980000    
 H   -4.558200       1.029300      0.1346000    
 H   -3.359800       1.554800     -0.9879000    
 H    4.755800     -0.8333000      0.5152000    


%chk=000125337-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125337

0 1
S 3.443743 -1.646292 0.518438
S 3.674696 1.443900 0.464995
O -2.800237 0.097416 1.639798
N 1.495378 0.016661 -0.411629
N -3.928081 0.355482 -0.370888
C -1.459147 0.115385 -0.418166
C -0.675424 -1.166677 -0.035760
C -0.583820 1.361162 -0.103156
C 0.710578 -1.207105 -0.716610
C 0.792754 1.269996 -0.792424
C -2.773380 0.182964 0.376819
C 2.752079 0.043448 0.133135
H -1.674935 0.097594 -1.508089
H -1.242105 -2.070185 -0.331299
H -0.559486 -1.192361 1.062605
H -0.449717 1.433086 0.991559
H -1.089150 2.286426 -0.439016
H 1.262418 -2.101167 -0.388071
H 0.593966 -1.273365 -1.818945
H 0.676311 1.276262 -1.896592
H 1.437668 2.116483 -0.506895
H -4.820697 0.421369 0.119214
H -3.913502 0.418885 -1.387039
H 4.614293 -1.115368 1.021416


