%chk=000029494.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029494

0 1
 S  -0.1633000      0.3709000      -1.025400    
 S    1.843500       2.202300      0.1598000    
 O   -3.073600     -0.1258000      -1.066700    
 N    2.177300     -0.5347000      2.4100000E-02
 C   -1.196700      0.1626000      0.4445000    
 C    1.407100      0.6172000     -0.2309000    
 C    3.486100     -0.4742000      0.6795000    
 C    1.758100      -1.895300     -0.3261000    
 C   -2.649800     -7.4199997E-02  8.6900003E-02
 C   -3.588700     -0.2487000       1.254300    
 H  -0.8401000     -0.6960000       1.021100    
 H   -1.141700       1.063700       1.062200    
 H    3.750300      0.5158000       1.050100    
 H    4.247000     -0.7910000     -4.0600002E-02
 H    3.481800      -1.166100       1.527900    
 H    2.639500      -2.503800     -0.5528000    
 H    1.106000      -1.923200      -1.199900    
 H    1.236400      -2.323600      0.5346000    
 H   -4.605600     -0.4169000      0.8888000    
 H   -3.279500      -1.113300       1.846900    
 H   -3.579600      0.6541000       1.869900    


%chk=000029494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029494

0 1
S -0.222784 -1.844496 0.630769
S 0.580451 1.136003 1.197852
O -2.466912 -0.345411 -0.948791
N 2.167796 -0.766641 0.013158
C -1.731592 -0.980854 1.309167
C 0.970574 -0.412802 0.582291
C 3.289594 0.190501 -0.087842
C 2.418800 -2.122335 -0.527528
C -2.498169 -0.121517 0.284414
C -3.325353 0.997795 0.900058
H -2.387090 -1.803953 1.655216
H -1.421444 -0.370316 2.173836
H 2.996693 1.138066 0.387651
H 3.534081 0.376418 -1.150288
H 4.180709 -0.218746 0.423151
H 3.378540 -2.114025 -1.066661
H 1.619525 -2.415796 -1.231422
H 2.471584 -2.875588 0.280998
H -4.016549 1.417001 0.152856
H -3.890565 0.647053 1.783637
H -2.633387 1.789443 1.245678


