%chk=000023473.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023473

0 1
 S   -1.625100      -1.492800       1.306000    
 S   -2.492500     -0.8857000      -1.491400    
 O    1.547100      4.4799998E-02 -0.9410000    
 O    2.189600     -0.3874000       1.251400    
 N    3.127200      -1.561800     -0.5161000    
 C   -1.128300     -0.7541000     -0.2877000    
 C  -0.6253000      0.6641000     -0.1387000    
 C   -3.379000      -1.712600      0.9073000    
 C   -3.478200      -2.083400     -0.5581000    
 C   0.6883000      0.9934000     -0.4730000    
 C   -1.490800       1.648000      0.3392000    
 C    1.136100       2.306700     -0.3295000    
 C   -1.042800       2.961200      0.4828000    
 C   0.2706000       3.290500      0.1485000    
 C    2.289000     -0.6241000      5.0999999E-02
 C    4.014100      -2.406800      0.2492000    
 H  -0.3427000      -1.407200     -0.6760000    
 H   -3.917400     -0.7834000       1.124000    
 H   -3.804800      -2.498100       1.538800    
 H   -3.092400      -3.091600     -0.7448000    
 H   -4.517100      -2.054700     -0.8997000    
 H   -2.519000       1.420100      0.6067000    
 H    2.157900       2.570700     -0.5886000    
 H   -1.716600       3.727500      0.8548000    
 H   0.6194000       4.312900      0.2601000    
 H    3.119100      -1.664400      -1.526300    
 H    3.748900      -3.447900      5.0000001E-02
 H    3.935300      -2.202000       1.319400    
 H    5.036500      -2.223200     -8.9599997E-02


%chk=000023473-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023473

0 1
S -2.558449 -1.088520 1.616745
S -2.410778 -0.971438 -1.482868
O 1.358075 -0.366020 -0.266700
O 3.369835 0.275061 0.858768
N 3.160168 -1.717018 -0.374513
C -1.396824 -0.734884 0.115090
C -0.786286 0.645302 0.154734
C -4.046315 -1.710185 0.618905
C -3.543492 -2.270244 -0.715152
C 0.615756 0.820160 0.000130
C -1.585082 1.802777 0.327306
C 1.210614 2.101877 0.023606
C -1.010564 3.088627 0.352495
C 0.389106 3.233989 0.203125
C 2.721521 -0.524982 0.147487
C 4.515172 -2.219892 -0.134028
H -0.619917 -1.509173 0.137885
H -4.743644 -0.872471 0.461834
H -4.525840 -2.493621 1.230980
H -2.980118 -3.207262 -0.574454
H -4.367330 -2.433787 -1.431466
H -2.664182 1.669162 0.456630
H 2.292069 2.206794 -0.077583
H -1.644365 3.970814 0.490534
H 0.846202 4.229146 0.226361
H 2.502434 -2.248545 -0.945446
H 4.493963 -3.190162 0.395219
H 5.044417 -1.487117 0.495168
H 5.070954 -2.339688 -1.082090


