%chk=000139927.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139927

0 1
 Br -3.0000001E-04 -3.0000001E-04  -3.136800    
 C  -1.9999999E-04 -3.0000001E-04  -1.199300    
 C  -9.9999997E-05 -1.9999999E-04   1.427800    
 C   0.2537000       1.409500     -0.5964000    
 C    1.093700     -0.9250000     -0.5963000    
 C   -1.348000     -0.4852000     -0.5963000    
 C   0.2503000       1.390400      0.8364000    
 C    1.079000     -0.9123000      0.8364000    
 C   -1.329700     -0.4786000      0.8364000    
 C   0.4711000       2.615800      -1.253400    
 C    2.030300      -1.715700      -1.253300    
 C   -2.501400     -0.8999000      -1.253200    
 C   0.4585000       2.544300       1.580400    
 C    1.974900      -1.668800       1.580400    
 C   -2.432800     -0.8754000       1.580500    
 C   0.6803000       3.776400     -0.4995000    
 C    2.931200      -2.476800     -0.4995000    
 C   -3.611200      -1.298800     -0.4993000    
 C   0.6742000       3.741500      0.9016000    
 C    2.904300      -2.453800      0.9016000    
 C   -3.577700      -1.286900      0.9018000    
 H  -9.9999997E-05 -9.9999997E-05   2.522200    
 H   0.4851000       2.693400      -2.334400    
 H    2.090500      -1.766400      -2.334400    
 H   -2.575700     -0.9265000      -2.334300    
 H   0.4544000       2.521100       2.664900    
 H    1.957100      -1.653400       2.665000    
 H   -2.410600     -0.8675000       2.665100    
 H   0.8506000       4.721600      -1.008900    
 H    3.664900      -3.096500      -1.009000    
 H   -4.515000      -1.623600      -1.008700    
 H   0.8394000       4.657700       1.462100    
 H    3.615600      -3.054500       1.462100    
 H   -4.453700      -1.601800       1.462300    


%chk=000139927-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000139927

0 1
Br 0.001659 -0.001392 -3.175968
C 0.000652 -0.000631 -1.155963
C 0.000823 -0.000374 1.457407
C 0.254208 1.407523 -0.564483
C 1.092941 -0.923942 -0.563974
C -1.345201 -0.483962 -0.564140
C 0.251600 1.390823 0.859295
C 1.079754 -0.913130 0.859605
C -1.328961 -0.478427 0.859445
C 0.469275 2.611622 -1.254705
C 2.027292 -1.713295 -1.254177
C -2.496775 -0.896625 -1.254220
C 0.463879 2.573907 1.586969
C 1.997343 -1.689434 1.587495
C -2.459890 -0.885212 1.587326
C 0.683493 3.806570 -0.520493
C 2.953935 -2.497548 -0.519891
C -3.638928 -1.307963 -0.519888
C 0.681458 3.790691 0.891927
C 2.941225 -2.487625 0.892528
C -3.623271 -1.303487 0.892527
H 0.000734 -0.000150 2.559079
H 0.471316 2.629647 -2.348926
H 2.041673 -1.724146 -2.348397
H -2.514411 -0.901069 -2.348466
H 0.460228 2.553322 2.682980
H 1.981291 -1.675851 2.683510
H -2.439981 -0.878207 2.683357
H 0.851228 4.747259 -1.056563
H 3.683928 -3.114253 -1.055775
H -4.538350 -1.630834 -1.055801
H 0.847567 4.718747 1.450238
H 3.661066 -3.096332 1.451021
H -4.510199 -1.622821 1.451118


