%chk=000080328.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080328

0 1
 S    1.858800       1.298800      0.2567000    
 O   -1.122100       1.786600     -1.8100001E-02
 C   -1.807300     -0.4054000     -0.4752000    
 C   -3.182900     -0.1058000     -1.8100001E-02
 C   -2.371600      -1.170900      0.6593000    
 C  -0.7281000      0.6116000     -0.1704000    
 C   0.6241000      0.1632000     -8.7499999E-02
 C    1.123700      -1.110400     -0.2491000    
 C    2.538700      -1.154500     -8.8100001E-02
 C    3.066700      8.6900003E-02  0.1904000    
 H   -1.709300     -0.9116000      -1.429800    
 H   -4.006100     -0.4256000     -0.6463000    
 H   -3.390300      0.7924000      0.5501000    
 H   -2.013400     -0.9685000       1.661400    
 H   -2.649900      -2.203300      0.4862000    
 H   0.5183000      -1.979800     -0.4723000    
 H    3.138900      -2.051200     -0.1722000    
 H    4.104000      0.3402000      0.3580000    


%chk=000080328-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080328

0 1
S 1.935508 1.227022 0.652510
O -1.063222 1.360028 1.019163
C -1.745213 -0.716946 -0.006367
C -3.123711 -0.164605 -0.459309
C -3.008385 -0.862237 0.882999
C -0.719254 0.285474 0.424517
C 0.699091 0.001182 0.141735
C 1.311729 -1.092247 -0.477790
C 2.740916 -0.987511 -0.560480
C 3.229927 0.189753 -0.004289
H -1.386450 -1.618793 -0.507128
H -3.616114 -0.679637 -1.288662
H -3.216700 0.924747 -0.448485
H -3.025855 -0.230476 1.775325
H -3.420384 -1.868278 0.999245
H 0.754915 -1.949306 -0.863571
H 3.381196 -1.748961 -1.011722
H 4.264205 0.523492 0.067309


