%chk=000031568.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031568

0 1
 S    4.315600       1.736400      0.5892000    
 O    1.882000      5.2700002E-02 -0.2975000    
 O   0.6746000      -1.783900      0.4020000    
 C   -2.981500      0.5319000     -0.1952000    
 C   -1.788400     -0.3864000      8.6900003E-02
 C   -4.297600     -0.1287000      0.2154000    
 C  -0.4533000      0.2599000     -0.2826000    
 C   -5.482200      0.7948000     -2.0199999E-02
 C   0.7361000     -0.6369000     -1.8800000E-02
 C    3.101800     -0.6591000     -6.5300003E-02
 C    4.292900      0.2192000     -0.4140000    
 H   -3.009600      0.7813000      -1.262800    
 H   -2.855000       1.472700      0.3541000    
 H   -1.776800     -0.6581000       1.150100    
 H   -1.907900      -1.323000     -0.4722000    
 H   -4.442500      -1.054600     -0.3532000    
 H   -4.262800     -0.4017000       1.276600    
 H  -0.4520000      0.5160000      -1.348100    
 H  -0.3219000       1.177900      0.3018000    
 H   -5.383600       1.716100      0.5628000    
 H   -5.564800       1.064400      -1.077900    
 H   -6.412500      0.3018000      0.2786000    
 H    3.150500     -0.9737000      0.9845000    
 H    3.118700      -1.553300     -0.6997000    
 H    4.240900      0.5247000      -1.463800    
 H    5.228700     -0.3246000     -0.2554000    
 H    3.130800       2.210800      0.1770000    


%chk=000031568-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031568

0 1
S 4.474590 1.670689 0.814996
O 1.926046 0.065898 -0.320980
O 0.722767 -1.843154 0.255526
C -3.014612 0.511555 -0.202900
C -1.794247 -0.368328 0.144960
C -4.349269 -0.088334 0.295014
C -0.470234 0.248940 -0.346868
C -5.570976 0.786828 -0.058237
C 0.733573 -0.641840 -0.092289
C 3.189069 -0.703928 -0.129964
C 4.334206 0.252451 -0.432451
H -3.068164 0.654059 -1.303027
H -2.884634 1.523373 0.235878
H -1.743919 -0.522072 1.240517
H -1.914983 -1.374460 -0.299441
H -4.478282 -1.099932 -0.140831
H -4.297999 -0.228610 1.393939
H -0.518035 0.442661 -1.438135
H -0.284507 1.233512 0.122728
H -5.483153 1.792876 0.394016
H -5.661549 0.918608 -1.153131
H -6.511412 0.334191 0.305975
H 3.225544 -1.085506 0.905383
H 3.184723 -1.564484 -0.825993
H 4.237912 0.676915 -1.444532
H 5.297028 -0.279709 -0.357532
H 3.200717 2.164401 0.589679


