%chk=000076397.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076397

0 1
 S    1.353200     -0.5392000      -1.091700    
 C    2.351600      0.3390000      0.1439000    
 C    2.053600     -0.2136000       1.532500    
 C    3.829900      0.2070000     -0.2018000    
 C  -0.3023000     -0.2172000     -0.5149000    
 C  -0.7634000       1.095500     -0.4148000    
 C   -1.136900      -1.278200     -0.1639000    
 C   -2.059100       1.347100      3.6300000E-02
 C   -2.432700      -1.026600      0.2871000    
 C   -2.893800      0.2861000      0.3872000    
 H    2.094200       1.403400      0.1189000    
 H    2.704500      0.2647000       2.273900    
 H    1.026000     -1.7000001E-02   1.852800    
 H    2.235800      -1.292900       1.592200    
 H    4.442000      0.7554000      0.5230000    
 H    4.047200      0.6234000      -1.191900    
 H    4.160500     -0.8378000     -0.1873000    
 H  -0.1348000       1.938100     -0.6909000    
 H  -0.7948000      -2.307700     -0.2345000    
 H   -2.419000       2.369000      0.1125000    
 H   -3.082700      -1.852600      0.5606000    
 H   -3.902800      0.4820000      0.7381000    


%chk=000076397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076397

0 1
S 1.362889 -0.560443 -1.103075
C 2.404500 0.305802 0.273103
C 2.218818 -0.401842 1.623165
C 3.861802 0.305519 -0.218424
C -0.344282 -0.187538 -0.511123
C -0.846964 1.136259 -0.552326
C -1.171788 -1.242836 -0.057555
C -2.167164 1.404168 -0.123885
C -2.498582 -0.973143 0.353809
C -2.996823 0.350075 0.327532
H 2.015558 1.339023 0.321536
H 2.791889 0.125450 2.411392
H 1.156888 -0.419333 1.924943
H 2.580874 -1.444301 1.568299
H 4.508423 0.804977 0.527326
H 3.965502 0.836966 -1.180631
H 4.233149 -0.727587 -0.350109
H -0.214075 1.945457 -0.933297
H -0.774616 -2.262734 -0.026946
H -2.550438 2.430309 -0.156653
H -3.136384 -1.794424 0.699554
H -4.022977 0.558076 0.650663


