%chk=000133842.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133842

0 1
 S   -3.873600      -2.208500     -0.2761000    
 O   -1.370700      0.4986000      -1.665200    
 O  -0.9794000       4.104700      0.7547000    
 O   0.2781000       2.816100     -0.6331000    
 N   -1.419300     -0.4297000      0.4623000    
 C   -1.134700      -1.785500      5.6699999E-02
 C   0.1816000      -2.273600      0.6906000    
 C   -2.284200      -2.723500      0.4493000    
 C    1.361800      -1.391100      0.3586000    
 C    2.116500      -1.663800     -0.7709000    
 C    1.667800     -0.3259000       1.190300    
 C   -1.513500      0.6092000     -0.4501000    
 C   -1.797600       1.932900      0.2238000    
 C    3.206400     -0.8489000      -1.077100    
 C    2.757600      0.4889000      0.8838000    
 C    3.526900      0.2275000     -0.2499000    
 C  -0.7237000       2.972500      5.2400000E-02
 H   -1.016600      -1.816000      -1.034400    
 H   7.6700002E-02  -2.327500       1.783100    
 H   0.3934000      -3.301000      0.3658000    
 H   -2.073500      -3.745500      0.1176000    
 H   -2.411400      -2.743400       1.537400    
 H   -1.548800     -0.2496000       1.453500    
 H    1.872900      -2.498100      -1.422300    
 H    1.077700     -0.1139000       2.077200    
 H   -2.725200       2.323000     -0.2099000    
 H   -1.958200       1.792200       1.298200    
 H    3.805000      -1.052000      -1.960300    
 H    3.006600       1.327400       1.527700    
 H   -3.501200      -2.323100      -1.559400    
 H    4.375100      0.8624000     -0.4888000    
 H  -0.2706000       4.773500      0.6417000    


%chk=000133842-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133842

0 1
S -3.875879 -2.124713 -0.157452
O -1.844228 0.142091 -1.910707
O -1.270616 4.020803 0.762277
O -1.084951 2.030592 1.922077
N -1.312949 -0.238367 0.331480
C -1.030352 -1.670486 0.164569
C 0.267444 -2.056305 0.940509
C -2.206075 -2.568770 0.619512
C 1.511400 -1.358307 0.410112
C 2.112291 -1.788898 -0.801107
C 2.082276 -0.255636 1.094629
C -1.682386 0.559792 -0.721127
C -1.953498 2.046647 -0.412038
C 3.252855 -1.135524 -1.316675
C 3.225917 0.400605 0.583527
C 3.814799 -0.036910 -0.624734
C -1.395822 2.637995 0.865179
H -0.869154 -1.826175 -0.918943
H 0.122496 -1.821103 2.013876
H 0.384933 -3.154952 0.867309
H -1.976780 -3.621315 0.379022
H -2.377480 -2.484179 1.707086
H -1.203823 0.203237 1.255066
H 1.685791 -2.642664 -1.343267
H 1.631587 0.090624 2.033276
H -1.602630 2.637466 -1.273373
H -3.054844 2.174867 -0.389359
H 3.704353 -1.481992 -2.253136
H 3.656374 1.249030 1.127720
H -3.379853 -1.880153 -1.429186
H 4.701444 0.469922 -1.021811
H -0.930740 4.391077 1.622891


