%chk=000139090.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139090

0 1
 S    4.240000     -0.2193000     -0.5516000    
 S   -4.240600      0.2190000      0.5501000    
 C   0.2758000      0.6308000     -0.1642000    
 C  -0.2759000     -0.6302000      0.1646000    
 C    1.659400      0.7401000     -0.3790000    
 C   -1.659600     -0.7394000      0.3795000    
 C   0.5719000      -1.744900      0.2686000    
 C  -0.5724000       1.745300     -0.2686000    
 C    2.487000     -0.3780000     -0.2710000    
 C   -2.487300      0.3784000      0.2721000    
 C    1.944300      -1.618100      5.2099999E-02
 C   -1.944700       1.618400     -5.1700000E-02
 C    4.711600      0.9784000      0.7280000    
 C   -4.709500     -0.9805000     -0.7289000    
 H    2.082200       1.709200     -0.6400000    
 H   -2.082300      -1.708700      0.6401000    
 H   0.1695000      -2.724100      0.5200000    
 H  -0.1701000       2.724500     -0.5203000    
 H    2.573600      -2.500500      0.1402000    
 H   -2.574100       2.500700     -0.1401000    
 H    4.401200      0.6231000       1.714400    
 H    4.257900       1.953300      0.5328000    
 H    5.798500       1.095500      0.7249000    
 H   -5.796400      -1.097600     -0.7280000    
 H   -4.256200      -1.955200     -0.5313000    
 H   -4.397000     -0.6266000      -1.715100    


%chk=000139090-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139090

0 1
S 4.337867 -0.594756 0.312177
S -4.337375 0.594271 -0.312494
C 0.337578 0.634639 0.078451
C -0.337109 -0.635113 -0.078673
C 1.764954 0.672400 0.199941
C -1.764488 -0.672870 -0.200196
C 0.460320 -1.828444 -0.107998
C -0.459857 1.827970 0.107820
C 2.513027 -0.508348 0.167662
C -2.512554 0.507873 -0.167906
C 1.847265 -1.771573 0.011635
C -1.846799 1.771100 -0.011811
C 4.811860 1.210243 0.492729
C -4.811224 -1.210760 -0.492886
H 2.247280 1.648734 0.318197
H -2.246816 -1.649201 -0.318487
H -0.034387 -2.799749 -0.227167
H 0.034852 2.799270 0.227022
H 2.439832 -2.693122 -0.012706
H -2.439380 2.692638 0.012605
H 4.362345 1.640908 1.401288
H 4.512740 1.781189 -0.400382
H 5.908759 1.218194 0.584908
H -5.908178 -1.218828 -0.584414
H -4.511503 -1.781720 0.400018
H -4.362211 -1.641344 -1.401735


