%chk=000004379.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004379

0 1
 S   6.6399999E-02   1.379300      0.5035000    
 O  -0.1831000       1.360900       1.933000    
 O   0.3503000       2.641000     -0.1551000    
 O   -3.738800      -2.029600      3.9299998E-02
 O   -4.040500      0.1899000     -0.3217000    
 N   -1.225300      0.5819000     -0.3149000    
 C    1.440500      0.3053000      0.1957000    
 C   -1.863200     -0.5764000      0.3612000    
 C   -1.090800      0.3661000      -1.778000    
 C    2.218900      0.5144000     -0.9275000    
 C    1.705400     -0.7194000       1.085200    
 C    3.301200     -0.3315000      -1.169900    
 C    2.787800      -1.565300      0.8428000    
 C   -3.314300     -0.7455000     -8.7000001E-03
 C    3.585600      -1.371300     -0.2848000    
 H   -1.836800     -0.4580000       1.448500    
 H   -1.316000      -1.489100      9.9799998E-02
 H  -0.6102000       1.227400      -2.250600    
 H   -2.077500      0.2657000      -2.239100    
 H  -0.5079000     -0.5346000      -1.990400    
 H    2.011400       1.314800      -1.630700    
 H    1.091600     -0.8906000       1.964000    
 H    3.921700     -0.1815000      -2.048600    
 H    3.008200      -2.376200       1.530800    
 H    4.427800      -2.030500     -0.4741000    
 H   -4.685200      -2.112800     -0.2051000    


%chk=000004379-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004379

0 1
S 0.037756 1.372040 0.477924
O -0.362745 1.256553 2.050781
O 0.349630 2.772809 -0.278266
O -3.817019 -1.905274 0.730841
O -4.089033 -0.325325 -0.953848
N -1.438546 0.638168 -0.445266
C 1.530605 0.230088 0.190768
C -1.892688 -0.601391 0.201607
C -1.221243 0.601918 -1.906218
C 2.366072 0.496814 -0.907279
C 1.740119 -0.821265 1.099705
C 3.470617 -0.362646 -1.113252
C 2.850142 -1.668789 0.875664
C -3.364775 -0.871836 -0.100741
C 3.706199 -1.442200 -0.228651
H -1.787388 -0.487721 1.296642
H -1.322056 -1.510546 -0.105437
H -0.803408 1.571171 -2.224822
H -2.215927 0.488552 -2.370780
H -0.560198 -0.228627 -2.242477
H 2.176329 1.360031 -1.553547
H 1.083310 -0.948556 1.966684
H 4.147116 -0.182458 -1.955090
H 3.049283 -2.494519 1.566553
H 4.566157 -2.100367 -0.392708
H -4.771110 -2.102225 0.525811


