%chk=000227373.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227373

0 1
 Br  0.8222000      -4.231900      1.0700000E-02
 O  -0.4641000      -1.360500      0.4081000    
 C   -3.680200      0.6247000      0.1722000    
 C   -2.639900     -0.3938000      0.6656000    
 C   -1.335700     -0.3697000     -0.1225000    
 C   0.7752000      -1.389500     -0.2862000    
 C   -3.100200       2.038900      0.2492000    
 C   -4.147600      0.3351000      -1.254900    
 C    1.425200     -3.1599998E-02 -0.1471000    
 C    1.664400      -2.490000      0.2815000    
 C    1.196500      0.7148000      0.9966000    
 C    2.236200      0.4385000      -1.166700    
 C    1.796100       1.967800       1.124700    
 C    2.835900       1.691300      -1.038500    
 C    2.616000       2.455900      0.1072000    
 H   -4.549100      0.5664000      0.8394000    
 H   -3.066100      -1.404800      0.6306000    
 H   -2.418300     -0.2095000       1.725000    
 H   -1.537900     -0.6251000      -1.169100    
 H  -0.9263000      0.6379000     -0.1031000    
 H   0.5679000      -1.596000      -1.345500    
 H   -3.896600       2.776400      9.7800002E-02
 H   -2.344300       2.227500     -0.5195000    
 H   -2.656800       2.233200       1.231400    
 H   -3.349100      0.4768000      -1.989900    
 H   -4.968400       1.006700      -1.529500    
 H   -4.515200     -0.6926000      -1.341800    
 H    2.642300      -2.535700     -0.2060000    
 H    1.796300      -2.398700       1.364100    
 H   0.5923000      0.3489000       1.821800    
 H    2.414300     -0.1508000      -2.061400    
 H    1.631100       2.560100       2.019900    
 H    3.474900       2.071100      -1.830300    
 H    3.084400       3.430600      0.2079000    


%chk=000227373-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227373

0 1
Br 0.682983 -4.161494 -0.250703
O -0.479841 -1.120533 0.434544
C -3.938772 0.538138 0.149468
C -2.736767 -0.302353 0.666757
C -1.477401 -0.239867 -0.205440
C 0.781684 -1.196157 -0.300418
C -3.626678 2.054768 0.106317
C -4.465139 0.039527 -1.219333
C 1.635654 0.067856 -0.122512
C 1.546774 -2.398389 0.264141
C 1.652854 0.744856 1.123045
C 2.442996 0.546977 -1.183230
C 2.470244 1.881877 1.304862
C 3.262653 1.684014 -1.001871
C 3.279863 2.352905 0.244246
H -4.753141 0.388814 0.889472
H -3.038657 -1.364224 0.751937
H -2.465039 0.035965 1.686102
H -1.675903 -0.609690 -1.234044
H -1.076489 0.792866 -0.272038
H 0.588389 -1.359655 -1.383563
H -4.538491 2.636479 -0.123736
H -2.877358 2.292515 -0.672138
H -3.231654 2.410317 1.076583
H -3.735174 0.228037 -2.029058
H -5.401533 0.560950 -1.491814
H -4.674008 -1.046388 -1.196598
H 2.569068 -2.454991 -0.136399
H 1.550719 -2.384474 1.364629
H 1.006741 0.381817 1.930534
H 2.426763 0.034479 -2.153881
H 2.475886 2.401563 2.269648
H 3.880614 2.050315 -1.829293
H 3.913561 3.235580 0.385484


