%chk=000136431.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136431

0 1
 S    2.120300      0.6470000     -0.6836000    
 C   -2.305000     -0.1580000      0.1351000    
 C   0.3954000      0.3331000     -0.3642000    
 C   -1.793900       1.132500      0.2726000    
 C   -1.466000      -1.203000     -0.2521000    
 C  -0.4437000       1.378000      2.2900000E-02
 C  -0.1157000     -0.9575000     -0.5017000    
 C    2.923800     -0.4327000      0.5344000    
 C   -3.748300     -0.4209000      0.4028000    
 C    4.433100     -0.3185000      0.4339000    
 H  -6.3400000E-02   2.390400      0.1350000    
 H   0.5164000      -1.785900     -0.8114000    
 H   -2.437900       1.955100      0.5720000    
 H   -1.853500      -2.212000     -0.3661000    
 H    2.596000     -0.1475000       1.539200    
 H    2.629900      -1.472400      0.3615000    
 H   -3.901400      -1.437500      0.7808000    
 H   -4.140900      0.2649000       1.161400    
 H   -4.329500     -0.2971000     -0.5164000    
 H    4.794400     -0.6222000     -0.5544000    
 H    4.772900      0.7042000      0.6302000    
 H    4.906600     -0.9719000       1.174300    


%chk=000136431-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000136431

0 1
S 2.184274 0.319294 -0.976713
C -2.354160 -0.204371 0.140081
C 0.405231 0.108803 -0.522360
C -1.663884 0.998841 0.440258
C -1.634025 -1.247744 -0.498233
C -0.298864 1.159410 0.110746
C -0.268852 -1.096142 -0.830281
C 2.986453 -0.277738 0.653013
C -3.830034 -0.360019 0.463894
C 4.513140 -0.193749 0.521628
H 0.221048 2.096011 0.338918
H 0.275579 -1.904992 -1.329201
H -2.199132 1.819584 0.933525
H -2.146246 -2.187077 -0.740451
H 2.607873 0.369057 1.462251
H 2.645115 -1.311798 0.828619
H -4.089089 -1.411215 0.681626
H -4.121246 0.252338 1.335331
H -4.458516 -0.037511 -0.389146
H 4.880462 -0.832506 -0.301367
H 4.841303 0.842776 0.325767
H 4.993173 -0.533151 1.458299


