%chk=000132940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132940

0 1
 Br   3.331300      -3.790900      0.2731000    
 O  -0.2528000      0.7655000       1.706100    
 O    2.184900       2.136900     -0.1060000    
 O   0.6425000      -2.308800      0.7285000    
 O    4.725200       1.163000     -0.5824000    
 N   -4.519700      0.3371000     -0.1600000    
 N  -0.7897000      0.5091000     -0.5366000    
 C   -3.119100     -0.1074000     -0.1573000    
 C   -3.104000      -1.181800      -1.246900    
 C   -4.539500      -1.688500      -1.332900    
 C   -5.305300     -0.8927000     -0.2892000    
 C   -2.128700       1.011900     -0.4533000    
 C   -4.890700       1.084300       1.035600    
 C   -6.342200       1.515100      0.9926000    
 C   5.5300001E-02  0.4246000      0.5672000    
 C    1.423200     -9.4700001E-02  0.3100000    
 C    2.426900      0.7972000     -1.6300000E-02
 C    1.655900      -1.453500      0.4037000    
 C    3.712000      0.3119000     -0.2582000    
 C    2.941100      -1.938900      0.1619000    
 C    3.969100      -1.056300     -0.1690000    
 C    2.435200       2.755800      -1.365300    
 C    5.489300       1.701200      0.4949000    
 H   -2.869700     -0.5853000      0.8015000    
 H   -2.802400     -0.7827000      -2.223100    
 H   -2.414100      -1.994100     -0.9924000    
 H   -4.602400      -2.765100      -1.144900    
 H   -4.939000      -1.498600      -2.336200    
 H   -5.339800      -1.456500      0.6522000    
 H   -6.330000     -0.7095000     -0.6276000    
 H   -2.164700       1.783700      0.3227000    
 H   -2.353200       1.495400      -1.411000    
 H   -4.707900      0.5045000       1.949200    
 H   -4.281400       1.992200       1.105900    
 H  -0.4468000      0.2059000      -1.443800    
 H   -6.575100       2.048700      6.4700000E-02
 H   -7.029900      0.6692000       1.090000    
 H   -6.551800       2.195900       1.825000    
 H    4.974700      -1.423700     -0.3606000    
 H  -0.1928000      -1.829400      0.8479000    
 H    1.685800       3.539700      -1.509300    
 H    3.421100       3.228700      -1.361800    
 H    2.353100       2.049900      -2.199300    
 H    5.995400      0.9002000       1.043000    
 H    6.245500       2.371300      7.7000000E-02
 H    4.849800       2.274900       1.173100    


%chk=000132940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132940

0 1
Br 4.311059 -2.377741 3.321784
O -0.673686 -0.527210 2.098147
O 1.677596 1.092081 -1.081630
O 1.360246 -1.551271 3.050957
O 4.497333 0.581675 -1.113052
N -4.379552 0.358461 -0.041309
N -0.627777 0.891927 0.269395
C -2.944376 0.103305 -0.367973
C -2.859980 0.166174 -1.922876
C -4.196007 0.828378 -2.355738
C -5.180799 0.309092 -1.289070
C -2.071098 1.169873 0.353732
C -4.906384 -0.402984 1.111032
C -6.244438 0.154704 1.629784
C -0.003824 0.043424 1.134586
C 1.465349 -0.206674 0.998280
C 2.277220 0.301763 -0.060459
C 2.084302 -1.017576 2.024980
C 3.672887 0.069650 -0.080219
C 3.484119 -1.269276 1.951336
C 4.267038 -0.728329 0.923729
C 1.800858 0.538064 -2.459881
C 4.736037 2.042605 -1.022481
H -2.616564 -0.894447 -0.000583
H -1.971965 0.724417 -2.273177
H -2.793776 -0.854806 -2.341529
H -4.497917 0.557702 -3.381988
H -4.125736 1.929663 -2.293032
H -5.508438 -0.733155 -1.538371
H -6.086503 0.935805 -1.205025
H -2.361470 1.197609 1.417748
H -2.267877 2.162750 -0.087954
H -5.030563 -1.487634 0.854453
H -4.153994 -0.355652 1.920644
H -0.033973 1.304006 -0.465223
H -6.136924 1.221134 1.895994
H -7.044500 0.067258 0.872445
H -6.569857 -0.402166 2.527391
H 5.344063 -0.910202 0.875924
H 0.356951 -1.258028 2.886575
H 1.345925 1.293438 -3.118499
H 2.863623 0.388498 -2.709103
H 1.248349 -0.416976 -2.527813
H 5.243820 2.288558 -0.071006
H 5.391441 2.287098 -1.872176
H 3.784367 2.600415 -1.096348


