%chk=000016091.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016091

0 1
 Br  -1.634400       2.215100     -0.3890000    
 C  -3.2900002E-02  0.2330000      0.9185000    
 C   -1.465900      0.4249000      0.4019000    
 C    1.055400      0.1683000     -0.1612000    
 C   -1.914100     -0.6394000     -0.6021000    
 C    2.425400     -0.1208000      0.4562000    
 C   -1.937700      -2.046300     -1.5200000E-02
 C    3.504200     -0.2348000     -0.6092000    
 H   0.2117000       1.048700       1.612200    
 H   5.2000000E-03 -0.6849000       1.518200    
 H   -2.155300      0.4446000       1.253700    
 H    1.103600       1.109700     -0.7187000    
 H   0.8283000     -0.6253000     -0.8807000    
 H   -1.296400     -0.6262000      -1.507100    
 H   -2.932100     -0.4016000     -0.9383000    
 H    2.387900      -1.055800       1.027400    
 H    2.693100      0.6782000       1.157400    
 H  -0.9296000      -2.399300      0.2211000    
 H   -2.372200      -2.745700     -0.7368000    
 H   -2.542100      -2.081600      0.8966000    
 H    3.589700      0.6944000      -1.181600    
 H    3.282900      -1.049200      -1.306400    
 H    4.474500     -0.4389000     -0.1457000    


%chk=000016091-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016091

0 1
Br -1.622046 2.301689 -0.353702
C -0.021804 0.177606 0.943557
C -1.460038 0.390095 0.441606
C 1.068441 0.056325 -0.142619
C -1.980443 -0.604175 -0.610788
C 2.486760 -0.059178 0.462118
C -2.016780 -2.055519 -0.068331
C 3.584265 -0.203388 -0.613840
H 0.236568 0.999268 1.638380
H -0.031777 -0.751240 1.555378
H -2.157563 0.458107 1.295156
H 1.022207 0.941710 -0.806423
H 0.874123 -0.830297 -0.779610
H -1.349789 -0.553063 -1.516617
H -2.998373 -0.299348 -0.914418
H 2.525015 -0.928437 1.150886
H 2.690217 0.837871 1.081585
H -1.004080 -2.437790 0.152374
H -2.473301 -2.727030 -0.817257
H -2.618648 -2.125597 0.857064
H 3.582398 0.665490 -1.298392
H 3.424255 -1.111604 -1.225096
H 4.589593 -0.274395 -0.159812


