%chk=000092042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092042

0 1
 Br   2.108200       3.877700      0.1360000    
 C    2.169900       1.943700     -0.2486000    
 C    3.194100       1.297300      0.7077000    
 C   0.7802000       1.405100     -0.1951000    
 C    3.480700     -0.1440000      0.3570000    
 C   -1.819500      0.3981000     -9.4400004E-02
 C   0.1653000      0.9437000      -1.359100    
 C   9.5299996E-02   1.362600       1.019400    
 C   -1.134700      0.4404000      -1.308700    
 C   -1.204600      0.8592000       1.069700    
 C   -3.167700     -0.1247000     -4.1600000E-02
 C    2.709200      -1.145900      0.9230000    
 C    4.509100     -0.4362000     -0.5241000    
 C   -4.254800      0.7301000     -0.2249000    
 C   -3.380600      -1.483400      0.1918000    
 C    2.973500      -2.476600      0.5992000    
 C    4.773300      -1.767000     -0.8479000    
 C    4.005400      -2.787200     -0.2862000    
 C   -5.554500      0.2263000     -0.1744000    
 C   -4.680400      -1.987100      0.2421000    
 C   -5.767300      -1.132200      5.9099998E-02
 H    2.559800       1.904700      -1.273300    
 H    2.868200       1.361300       1.754200    
 H    4.139700       1.856600      0.6759000    
 H   0.6861000      0.9693000      -2.312600    
 H   0.5515000       1.717400       1.939300    
 H   -1.599200      8.4600002E-02  -2.225300    
 H   -1.724500      0.8335000       2.024500    
 H    1.910700     -0.9206000       1.622900    
 H    5.110700      0.3514000     -0.9684000    
 H   -4.106700       1.791900     -0.4080000    
 H   -2.544600      -2.163600      0.3366000    
 H    2.377200      -3.271100       1.038500    
 H    5.576400      -2.008900      -1.537800    
 H    4.211400      -3.823400     -0.5381000    
 H   -6.401000      0.8917000     -0.3169000    
 H   -4.846300      -3.044900      0.4239000    
 H   -6.779300      -1.524500      9.8300003E-02


%chk=000092042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000092042

0 1
Br 2.231201 3.973865 -0.549403
C 2.238259 1.876164 -0.531475
C 3.233723 1.431210 0.567160
C 0.822167 1.382249 -0.402759
C 3.544884 -0.058839 0.444103
C -1.860714 0.375779 -0.199826
C 0.187872 0.767272 -1.511775
C 0.090436 1.498077 0.808476
C -1.126280 0.269147 -1.411985
C -1.222870 1.005914 0.906923
C -3.251620 -0.148885 -0.091030
C 2.799625 -1.029892 1.160238
C 4.583645 -0.498145 -0.417722
C -4.212720 0.489562 0.741529
C -3.655698 -1.303794 -0.817209
C 3.086138 -2.406510 1.020838
C 4.871820 -1.873910 -0.561389
C 4.122476 -2.833481 0.158466
C -5.529045 -0.008099 0.844597
C -4.971825 -1.802058 -0.715756
C -5.916348 -1.156990 0.116246
H 2.645421 1.657205 -1.531484
H 2.816316 1.668538 1.561277
H 4.159850 2.021255 0.452861
H 0.728235 0.682239 -2.462375
H 0.546167 1.992690 1.673871
H -1.598318 -0.178205 -2.293597
H -1.755971 1.086526 1.860772
H 1.990991 -0.706759 1.826256
H 5.176920 0.242859 -0.969007
H -3.937647 1.400271 1.285683
H -2.926061 -1.833182 -1.440467
H 2.502794 -3.143917 1.583694
H 5.681382 -2.196160 -1.226041
H 4.346302 -3.900801 0.051550
H -6.254980 0.505779 1.484626
H -5.257898 -2.698276 -1.277682
H -6.938427 -1.543397 0.195516


