%chk=000044276.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044276

0 1
 C   -3.397700      0.2970000      0.8798000    
 C   -1.009300      0.9537000      0.3171000    
 C   -2.364300       1.297600      0.4634000    
 C   -4.060200     -0.4482000     -0.2900000    
 C  -8.4600002E-02   1.937600     -7.6700002E-02
 C    1.756900      0.2742000      1.2900000E-02
 C   0.8028000     -0.6952000      0.4081000    
 C   -5.160400      -1.412500      0.1641000    
 C  -0.5521000     -0.3496000      0.5539000    
 C    1.271100       1.586200     -0.2214000    
 C    3.137300     -0.1148000     -0.1267000    
 C   -2.798000       2.601100      0.2224000    
 C   -5.810100      -2.112800      -1.029900    
 C  -0.5372000       3.246800     -0.3157000    
 C    3.508200      -1.459500      0.1351000    
 C    1.206100      -2.009800      0.6572000    
 C   -1.884800       3.575300     -0.1670000    
 C    2.538200      -2.386500      0.5228000    
 C    4.178200      0.7661000     -0.5153000    
 C    4.845800      -1.871600      8.2000000E-03
 C   -6.929200      -3.042700     -0.5888000    
 C    5.504800      0.3437000     -0.6376000    
 C    5.838600     -0.9759000     -0.3757000    
 H   -3.006100     -0.4104000       1.619000    
 H   -4.186500      0.8250000       1.435400    
 H   -3.297500      -1.004800     -0.8488000    
 H   -4.486900      0.2818000     -0.9901000    
 H   -4.735200      -2.159400      0.8453000    
 H   -5.922300     -0.8582000      0.7253000    
 H   -1.239500      -1.141000      0.8440000    
 H    1.959600       2.372000     -0.5274000    
 H   -3.845000       2.872100      0.3306000    
 H   -5.056300      -2.689500      -1.578400    
 H   -6.216700      -1.367400      -1.723400    
 H   0.1598000       4.024500     -0.6214000    
 H   0.4840000      -2.765200      0.9616000    
 H   -2.219900       4.590900     -0.3562000    
 H    2.807700      -3.421100      0.7269000    
 H    3.977600       1.811700     -0.7336000    
 H    5.128200      -2.903500      0.2094000    
 H   -7.716200      -2.489500     -6.6500001E-02
 H   -7.378600      -3.533800      -1.457600    
 H   -6.551100      -3.819900      8.3099999E-02
 H    6.272800       1.050500     -0.9381000    
 H    6.867600      -1.309000     -0.4694000    


%chk=000044276-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044276

0 1
C -3.540935 0.456722 0.938894
C -1.071489 1.032919 0.390637
C -2.452131 1.449712 0.559487
C -4.024419 -0.410830 -0.258878
C -0.075904 2.009612 -0.029946
C 1.708211 0.282521 0.018781
C 0.714757 -0.690505 0.449157
C -5.148028 -1.395614 0.132251
C -0.631296 -0.298889 0.620185
C 1.277278 1.605698 -0.203462
C 3.103891 -0.151048 -0.160469
C -2.782217 2.789359 0.328622
C -5.633448 -2.263647 -1.051289
C -0.476662 3.370434 -0.261563
C 3.452478 -1.524970 0.100386
C 1.120881 -2.060303 0.698120
C -1.802924 3.752118 -0.082312
C 2.429403 -2.459424 0.532408
C 4.139327 0.732956 -0.586325
C 4.801746 -1.958482 -0.068404
C -6.767715 -3.235549 -0.660295
C 5.461529 0.289284 -0.747755
C 5.799682 -1.067343 -0.486962
H -3.199482 -0.215119 1.751371
H -4.411775 1.010182 1.340245
H -3.167906 -0.972059 -0.682252
H -4.381797 0.261226 -1.064727
H -4.792337 -2.058435 0.949541
H -6.007970 -0.828089 0.546422
H -1.350325 -1.058323 0.946888
H 1.991608 2.373098 -0.521098
H -3.821688 3.112749 0.462823
H -4.775788 -2.837545 -1.457561
H -5.978828 -1.601015 -1.870868
H 0.278060 4.099815 -0.578573
H 0.356883 -2.776214 1.023800
H -2.108229 4.790327 -0.253054
H 2.724426 -3.497888 0.724123
H 3.910427 1.782345 -0.796364
H 5.048079 -3.007495 0.135576
H -7.649088 -2.683936 -0.281839
H -7.095207 -3.844316 -1.523040
H -6.439371 -3.928884 0.137172
H 6.235692 0.991287 -1.076477
H 6.832200 -1.410443 -0.613476


