%chk=000038563.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038563

0 1
 Br   5.942500       2.492300     -0.2773000    
 Br  -3.279400     -0.2547000      -2.518000    
 N   1.5500000E-02  -1.394100      0.1749000    
 C    1.073500      -2.207900     -0.4113000    
 C    2.223200      -1.352600     -0.9470000    
 C    2.864700     -0.4663000      0.1263000    
 C  -0.5754000     -0.5123000     -0.8334000    
 C   -1.016200      -2.242800      0.7739000    
 C    3.961200      0.4212000     -0.4739000    
 C   -1.627900      0.3883000     -0.2435000    
 C  -0.4248000      -3.167300       1.824500    
 C    4.624100       1.325900      0.5534000    
 C   -2.849300      0.5884000     -0.8745000    
 C   -1.338000       1.018800      0.9607000    
 C   -3.795800       1.431900     -0.2927000    
 C   -2.284600       1.862300       1.542300    
 C   -3.513300       2.068900      0.9157000    
 H    1.530400      -2.870300      0.3309000    
 H   0.6899000      -2.846600      -1.217700    
 H    1.916300     -0.7557000      -1.812300    
 H    2.993500      -2.034000      -1.333200    
 H    3.289900      -1.094400      0.9182000    
 H    2.112900      0.1794000      0.5935000    
 H  -0.9373000      -1.123300      -1.663700    
 H   0.1669000      0.1759000      -1.252700    
 H   -1.533900      -2.844700      1.5500000E-02
 H   -1.780100      -1.649300       1.286400    
 H    4.721600     -0.2119000     -0.9485000    
 H    3.526400       1.034600      -1.273600    
 H   0.1165000      -4.011300       1.386300    
 H   0.2381000      -2.631600       2.512800    
 H   -1.233200      -3.600100       2.425100    
 H    5.154100      0.7488000       1.316200    
 H    3.897600       1.983000       1.039500    
 H  -0.3823000      0.8894000       1.461100    
 H   -4.758800       1.605400     -0.7662000    
 H   -2.063200       2.361500       2.481200    
 H   -4.249700       2.726400       1.368200    


%chk=000038563-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038563

0 1
Br 5.836031 2.624222 0.401302
Br -3.603895 0.078812 -2.712783
N -0.100710 -1.626983 -0.052960
C 1.065739 -2.232454 -0.750173
C 2.146197 -1.196997 -1.138446
C 2.810620 -0.531988 0.087374
C -1.037103 -0.964717 -0.989890
C -0.810427 -2.568909 0.859814
C 3.838763 0.555072 -0.318524
C -1.814365 0.193540 -0.363883
C -0.027353 -2.875982 2.149368
C 4.471470 1.197027 0.916532
C -2.951011 0.772921 -0.977847
C -1.391261 0.765241 0.864428
C -3.651524 1.859136 -0.414792
C -2.072143 1.852568 1.450355
C -3.207472 2.401451 0.812740
H 1.521693 -2.974373 -0.069055
H 0.745251 -2.795380 -1.662174
H 1.704235 -0.412109 -1.785125
H 2.915465 -1.708732 -1.752312
H 3.312084 -1.311194 0.698861
H 2.014730 -0.093635 0.719981
H -1.760149 -1.693054 -1.430413
H -0.459272 -0.568193 -1.847173
H -1.067147 -3.522543 0.333296
H -1.770424 -2.094463 1.135394
H 4.629559 0.109713 -0.952045
H 3.338667 1.333233 -0.925884
H 0.931852 -3.385585 1.946948
H 0.191890 -1.941968 2.696604
H -0.621425 -3.536289 2.807697
H 5.043919 0.479962 1.525714
H 3.739404 1.731889 1.541589
H -0.505286 0.321395 1.331724
H -4.524913 2.275078 -0.925316
H -1.718870 2.271027 2.399090
H -3.747219 3.244461 1.257085


