%chk=000148679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148679

1 1
 Br  -1.022900       2.926800      0.5083000    
 O   0.4126000     -0.2982000      0.1021000    
 O  -0.3367000     -0.8622000      -2.000200    
 N    4.129400     -3.2699998E-02  0.3041000    
 C    2.691200     -1.5300000E-02  0.8016000    
 C    4.288500      0.9771000     -0.8233000    
 C    5.065900      0.3313000       1.447300    
 C    4.472100      -1.423900     -0.2090000    
 C    1.760100     -0.3481000     -0.3474000    
 C  -0.5399000     -0.5774000     -0.8302000    
 C   -1.898500     -0.4904000     -0.2373000    
 C   -2.585900      0.7066000     -0.2519000    
 C   -2.434500      -1.636300      0.3178000    
 C   -3.860900      0.7610000      0.3113000    
 C   -2.008300       1.946800     -0.8517000    
 C   -3.709600      -1.582000      0.8809000    
 C   -4.422700     -0.3832000      0.8776000    
 H    2.596400     -0.7412000       1.618100    
 H    2.478700      0.9802000       1.209900    
 H    3.854100       1.930300     -0.5075000    
 H    5.359400       1.102800      -1.013900    
 H    3.818600      0.6042000      -1.736700    
 H    4.933700     -0.4022000       2.248100    
 H    6.095400      0.3107000       1.077600    
 H    4.807200       1.334500       1.798900    
 H    4.192200      -2.158300      0.5519000    
 H    3.960600      -1.615600      -1.155200    
 H    5.552400      -1.462000     -0.3835000    
 H    1.845500      0.3715000      -1.166000    
 H    1.935100      -1.357300     -0.7308000    
 H   -1.884500      -2.572900      0.3236000    
 H   -4.428400       1.688000      0.3171000    
 H   -2.788500       2.621100      -1.219200    
 H   -1.323500       1.753400      -1.681400    
 H   -4.147000      -2.472800       1.321900    
 H   -5.415300     -0.3408000       1.316300    


%chk=000148679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148679

1 1
Br -0.079499 2.657631 1.053007
O 0.404055 -1.641050 0.019362
O 0.433914 0.216846 -1.374686
N 3.810730 -0.005002 0.147637
C 2.546478 -0.689366 0.719054
C 3.443538 0.960118 -0.986213
C 4.453618 0.800742 1.279840
C 4.809561 -1.046360 -0.350627
C 1.860809 -1.714291 -0.223096
C -0.223790 -0.527269 -0.603744
C -1.633326 -0.372623 -0.179360
C -2.220360 0.933740 -0.095169
C -2.388366 -1.521061 0.170767
C -3.563851 1.035315 0.341818
C -1.474279 2.193018 -0.421671
C -3.733265 -1.395487 0.575885
C -4.321877 -0.113658 0.660875
H 2.854988 -1.168016 1.663589
H 1.841328 0.126632 0.953236
H 2.816456 1.765223 -0.573756
H 4.375263 1.368637 -1.406708
H 2.864163 0.431919 -1.754522
H 4.799371 0.112155 2.066089
H 5.306609 1.367253 0.876156
H 3.705810 1.495932 1.690725
H 5.013871 -1.766858 0.456613
H 4.392709 -1.566788 -1.224804
H 5.741952 -0.537684 -0.639569
H 2.064972 -1.511208 -1.289248
H 2.127934 -2.751869 0.022224
H -1.919430 -2.507393 0.114293
H -4.019757 2.027141 0.435538
H -2.121166 3.079966 -0.425632
H -0.850527 2.131142 -1.320751
H -4.314043 -2.287517 0.829366
H -5.362592 -0.006410 0.982683


