%chk=000137636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137636

0 1
 Br  -3.253400      0.5288000     -0.2392000    
 C  -0.5529000     -0.3489000     -0.2271000    
 C  -0.1766000       1.040000      0.3067000    
 C   0.5163000      -1.385100      0.1444000    
 C    1.213000       1.466100     -0.1613000    
 C    1.904800     -0.9549000     -0.3231000    
 C    2.271600      0.4296000      0.2021000    
 C   -1.922800     -0.7754000      0.2975000    
 H  -0.5994000     -0.2893000      -1.323800    
 H  -0.2007000       1.037400       1.404200    
 H  -0.8705000       1.817200     -2.5599999E-02
 H   0.2683000      -2.354800     -0.3035000    
 H   0.5312000      -1.532000       1.232000    
 H    1.474100       2.430600      0.2888000    
 H    1.203500       1.612900      -1.248300    
 H    1.934900     -0.9493000      -1.419700    
 H    2.649200      -1.685500      1.2800000E-02
 H    3.241800      0.7341000     -0.2065000    
 H    2.382600      0.3883000       1.292600    
 H   -1.952600     -0.8288000       1.389700    
 H   -2.236100      -1.736200     -0.1205000    


%chk=000137636-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137636

0 1
Br -3.470856 0.371646 -0.384473
C -0.564090 -0.309873 -0.219064
C -0.152056 1.075053 0.338074
C 0.505601 -1.382546 0.151468
C 1.253518 1.490672 -0.155728
C 1.912480 -0.966820 -0.343748
C 2.316160 0.424019 0.199645
C -1.926785 -0.786050 0.291366
H -0.607815 -0.244287 -1.326279
H -0.153183 1.028995 1.448325
H -0.902841 1.832762 0.046040
H 0.226170 -2.363607 -0.281475
H 0.529558 -1.508241 1.254587
H 1.531081 2.469209 0.281007
H 1.227050 1.628296 -1.256530
H 1.914558 -0.940720 -1.452864
H 2.655101 -1.729456 -0.038879
H 3.304980 0.717432 -0.202745
H 2.421730 0.367949 1.303049
H -2.010880 -0.734790 1.389438
H -2.183182 -1.794844 -0.069013


