%chk=000020818.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020818

0 1
 S    2.844300     -1.2700000E-02 -5.4699998E-02
 O    1.224000     -8.0000004E-03 -0.2668000    
 O    3.428900      0.1673000      -1.567100    
 O    3.190200       1.182000      0.6926000    
 O    3.252500      -1.318600      0.4288000    
 C   -1.055900     -4.9999999E-03  0.4102000    
 C   0.3641000     -1.0200000E-02  0.8661000    
 C   -1.716900       1.205500      0.2013000    
 C   -1.723100      -1.210600      0.1924000    
 C   -3.044900       1.210600     -0.2253000    
 C   -3.051200      -1.205400     -0.2343000    
 C   -3.711900      5.2000000E-03 -0.4432000    
 H   0.5704000      0.8697000       1.486900    
 H   0.5697000     -0.8960000       1.478900    
 H   -1.207300       2.151300      0.3654000    
 H   -1.218500      -2.160200      0.3495000    
 H   -3.559400       2.153100     -0.3886000    
 H   -3.570700      -2.143900     -0.4046000    
 H   -4.745800      9.1000004E-03 -0.7756000    
 H    3.026400     -0.4221000      -2.247400    


%chk=000020818-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020818

0 1
S 3.028554 -0.023201 0.005096
O 1.196315 0.281348 -0.226590
O 3.219296 -0.325719 -1.779610
O 3.868521 1.289202 0.364985
O 3.223695 -1.369821 0.861991
C -1.055220 0.044173 0.471888
C 0.354177 0.087466 1.006188
C -1.803367 1.241961 0.332224
C -1.637529 -1.190771 0.083720
C -3.118364 1.204601 -0.179494
C -2.951864 -1.228418 -0.428347
C -3.694067 -0.030351 -0.560982
H 0.519240 0.943334 1.684268
H 0.649393 -0.857599 1.497597
H -1.353392 2.198551 0.622684
H -1.061082 -2.117825 0.187150
H -3.692436 2.131771 -0.280582
H -3.398407 -2.184936 -0.720270
H -4.714996 -0.059562 -0.957478
H 2.286432 -0.473104 -2.119937


