%chk=000031892.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031892

0 1
 S    2.625500     -1.1500000E-02 -0.5174000    
 O   0.6929000      -2.314500      5.4499999E-02
 C   -1.906000      0.2459000      7.3500000E-02
 C   0.8550000      6.3900001E-02 -0.2832000    
 C   -1.273000     -0.9948000      0.1503000    
 C   0.1074000      -1.085700     -2.8000001E-02
 C   -1.158200       1.395600     -0.1814000    
 C   0.2222000       1.304600     -0.3600000    
 C   -3.381800      0.3436000      0.2643000    
 C    3.216000       1.053100      0.8274000    
 H   -1.851700      -1.894200      0.3473000    
 H   -1.640300       2.367400     -0.2472000    
 H   0.7804000       2.214300     -0.5666000    
 H   -3.741500     -0.4232000      0.9588000    
 H   -3.663000       1.314600      0.6861000    
 H   -3.893700      0.2168000     -0.6948000    
 H    2.822600      0.7076000       1.787300    
 H    2.915300       2.090900      0.6629000    
 H    4.307900       1.011500      0.8629000    
 H    1.649000      -2.206000     -8.9500003E-02


%chk=000031892-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031892

0 1
S 2.663638 0.250793 -0.741106
O 0.904175 -2.067900 0.220687
C -1.957267 0.294397 0.075293
C 0.844530 0.306767 -0.425737
C -1.192481 -0.878703 0.270856
C 0.197824 -0.881713 0.016615
C -1.306200 1.474210 -0.378711
C 0.082645 1.476253 -0.630119
C -3.456927 0.282659 0.315756
C 3.298229 0.746149 0.981213
H -1.658281 -1.807586 0.615912
H -1.888902 2.388664 -0.536410
H 0.583311 2.383429 -0.984731
H -3.736437 -0.434369 1.107051
H -3.827143 1.280559 0.608638
H -4.000111 -0.013107 -0.602780
H 2.913186 0.048933 1.739873
H 2.975118 1.773543 1.202733
H 4.397222 0.693846 0.934482
H 1.848871 -1.916926 -0.082315


