%chk=000057964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057964

0 1
 Br  -2.916900       1.806600      0.4939000    
 O   0.6135000      -1.499400      0.1167000    
 N  -0.3974000      0.3322000     -0.8892000    
 C    1.916200      0.5068000     -0.2574000    
 C    3.094900     -0.2241000      0.3788000    
 C   0.6628000     -0.3482000     -0.3081000    
 C    4.328200      0.6615000      0.4488000    
 C   -1.700200     -0.2673000      -1.054800    
 C   -2.547100      2.4000001E-03  0.1510000    
 C   -3.054000     -0.9704000      0.9203000    
 H    2.169600      0.8067000      -1.281200    
 H    1.686500       1.414800      0.3130000    
 H    3.328800      -1.127700     -0.1967000    
 H    2.829500     -0.5529000       1.390800    
 H    4.639700      0.9798000     -0.5512000    
 H    4.135500       1.555800       1.050000    
 H    5.160100      0.1173000      0.9067000    
 H  -0.2681000       1.291600      -1.197800    
 H   -2.155200      0.1671000      -1.951700    
 H   -1.580100      -1.342000      -1.232800    
 H   -3.679800     -0.7515000       1.779300    
 H   -2.851700      -2.015100      0.7087000    


%chk=000057964-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057964

0 1
Br -2.981333 1.782593 1.016167
O 0.583753 -1.533007 -0.823816
N -0.413936 0.565372 -0.895005
C 2.041770 0.438062 -0.628712
C 2.876575 -0.156700 0.532906
C 0.693483 -0.269238 -0.781446
C 4.292653 0.450552 0.603653
C -1.773961 0.018786 -1.006135
C -2.518542 -0.023113 0.316344
C -2.861917 -1.119893 1.022342
H 2.601386 0.297997 -1.575143
H 1.909741 1.529133 -0.488002
H 2.931001 -1.251324 0.390819
H 2.345263 0.012299 1.489969
H 4.853681 0.260847 -0.331039
H 4.256248 1.545670 0.758385
H 4.870189 0.012254 1.437621
H -0.298024 1.574957 -0.794943
H -2.348072 0.606862 -1.745144
H -1.667788 -1.017537 -1.374171
H -3.400706 -1.072945 1.972051
H -2.576662 -2.107626 0.640400


