%chk=000043225.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043225

0 1
 S   -3.096500       1.089300     -0.9876000    
 S   -2.449000     -0.9566000       1.095400    
 S    2.457100      0.9449000      -1.109400    
 S    3.091200      -1.081500      0.9968000    
 C   -1.847400      0.5509000      0.2421000    
 C    1.842300     -0.5441000     -0.2335000    
 C  -0.5417000      0.2300000     -0.4848000    
 C   0.5443000     -0.1983000      0.4955000    
 C   -1.648400       1.659500       1.275300    
 C    1.625000      -1.663700      -1.250900    
 C   -4.440900      1.8800000E-02 -0.4202000    
 C   -3.828900      -1.307500     -2.2299999E-02
 C    3.847500       1.293300     -4.1999999E-03
 C    4.445400     -3.4899998E-02  0.4079000    
 H  -0.7325000     -0.5571000      -1.223900    
 H  -0.2335000       1.120000      -1.045200    
 H   0.7449000      0.5985000       1.222100    
 H   0.2318000      -1.076600       1.071100    
 H   -1.172100       2.540300      0.8276000    
 H   -2.604000       1.990400       1.702700    
 H   -1.028500       1.349900       2.123800    
 H    1.134900      -2.530500     -0.7907000    
 H    1.011000      -1.357100      -2.104700    
 H    2.575100      -2.016000      -1.673400    
 H   -5.172400     -0.1131000      -1.223000    
 H   -4.952400      0.4964000      0.4228000    
 H   -4.563000      -1.940900      0.4844000    
 H   -3.457100      -1.858100     -0.8935000    
 H    3.487500       1.859900      0.8616000    
 H    4.586500       1.910900     -0.5233000    
 H    4.946400     -0.5300000     -0.4314000    
 H    5.182900      9.8399997E-02   1.205000    


%chk=000043225-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043225

0 1
S -3.174286 1.282511 -0.864541
S -2.600106 -0.788519 1.372722
S 2.598266 0.793122 -1.366787
S 3.173192 -1.287064 0.861904
C -1.829625 0.675219 0.402984
C 1.828932 -0.675753 -0.403707
C -0.606875 0.215724 -0.427059
C 0.605051 -0.220626 0.427365
C -1.530511 1.807140 1.401254
C 1.531480 -1.803545 -1.407122
C -4.475142 -0.046334 -0.510686
C -3.757081 -1.307178 -0.021573
C 3.755312 1.306190 0.029638
C 4.473749 0.043485 0.513333
H -0.929877 -0.609297 -1.086817
H -0.300055 1.054056 -1.086518
H 0.926559 0.603248 1.089302
H 0.299127 -1.060891 1.084676
H -1.043352 2.652488 0.881018
H -2.462273 2.169098 1.863174
H -0.853739 1.460746 2.203706
H 1.045511 -2.651994 -0.890808
H 0.854244 -1.454315 -2.207938
H 2.463725 -2.162223 -1.870658
H -5.007280 -0.224467 -1.461503
H -5.175181 0.332255 0.250723
H -4.459631 -2.040845 0.410060
H -3.173225 -1.782123 -0.827249
H 3.171290 1.777549 0.837316
H 4.457623 2.041828 -0.398994
H 5.173601 -0.331811 -0.249868
H 5.006079 0.217723 1.464753


