%chk=000083327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083327

0 1
 S  -0.6867000     -0.3656000      -1.185600    
 C   -3.205000      0.2872000     -4.2500000E-02
 C   -1.684000      0.2933000      0.1868000    
 C   -3.756300      -1.113400     -0.3177000    
 C   -3.978000      0.9549000       1.096900    
 C   0.9289000     -0.1672000     -0.5017000    
 C    1.514300      -1.192900      0.2564000    
 C    1.650900       1.018500     -0.7067000    
 C    2.790900      -1.036700      0.7963000    
 C    2.927500       1.174700     -0.1669000    
 C    3.497600      0.1472000      0.5847000    
 H   -3.403500      0.8899000     -0.9399000    
 H   -1.357600       1.322800      0.3746000    
 H   -1.454000     -0.2876000       1.087800    
 H   -3.530700      -1.793500      0.5108000    
 H   -4.844700      -1.083600     -0.4398000    
 H   -3.343800      -1.543100      -1.235200    
 H   -3.847800      0.4042000       2.034400    
 H   -5.049000      0.9978000      0.8725000    
 H   -3.627100       1.980200       1.254200    
 H   0.9808000      -2.124100      0.4342000    
 H    1.225400       1.832700      -1.289200    
 H    3.234800      -1.836600       1.381600    
 H    3.477800       2.096400     -0.3314000    
 H    4.491600      0.2689000       1.005200    


%chk=000083327-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083327

0 1
S -0.714867 -0.606019 -1.074665
C -3.244423 0.284307 -0.109016
C -1.753417 0.249422 0.286121
C -3.853542 -1.134371 -0.206125
C -4.022189 1.149363 0.915212
C 0.978418 -0.281225 -0.410306
C 1.744291 -1.356315 0.099451
C 1.527060 1.023539 -0.449971
C 3.057887 -1.124366 0.571894
C 2.834565 1.253456 0.035905
C 3.603020 0.180174 0.546229
H -3.322537 0.771006 -1.103160
H -1.349106 1.269731 0.403961
H -1.600048 -0.313082 1.224133
H -3.789688 -1.651043 0.771054
H -4.919302 -1.082801 -0.495311
H -3.324697 -1.754795 -0.951439
H -3.948721 0.717268 1.931745
H -5.093441 1.198158 0.646518
H -3.632208 2.183520 0.953582
H 1.311143 -2.361500 0.125070
H 0.940440 1.846489 -0.873051
H 3.649138 -1.960237 0.962375
H 3.255486 2.264732 0.003988
H 4.619040 0.358990 0.915607


