%chk=000020677.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020677

0 1
 Br   6.670400      0.6178000     -2.4700001E-02
 Br  -6.656400      0.6344000     -0.1042000    
 C   1.1800000E-02 -0.4954000      2.0800000E-02
 C    1.285400      0.3532000      2.0600000E-02
 C   -1.275000      0.3336000      9.0099998E-02
 C    2.537700     -0.5272000     -2.6400000E-02
 C   -2.547500     -0.5174000      6.0600001E-02
 C    3.813200      0.3219000      2.0000001E-03
 C   -3.832500      0.3169000      6.0899999E-02
 C    5.084700     -0.5107000     -4.9300000E-02
 C   -5.091800     -0.5270000     -5.0500002E-02
 H  -8.7000001E-03  -1.113000     -0.8857000    
 H   3.5900000E-02  -1.185700      0.8732000    
 H    1.307200      0.9777000      0.9218000    
 H    1.275600       1.029500     -0.8425000    
 H   -1.266900      0.9389000       1.004900    
 H   -1.292000       1.034800     -0.7534000    
 H    2.525100      -1.139200     -0.9363000    
 H    2.539300      -1.215000      0.8278000    
 H   -2.553600      -1.192400      0.9251000    
 H   -2.533100      -1.150000     -0.8358000    
 H    3.799200       1.020100     -0.8448000    
 H    3.816200      0.9381000      0.9101000    
 H   -3.868200      0.9194000      0.9775000    
 H   -3.793400       1.027900     -0.7745000    
 H    5.165200      -1.176700      0.8143000    
 H    5.141600      -1.102900     -0.9669000    
 H   -5.109300      -1.116000     -0.9713000    
 H   -5.218300      -1.188200      0.8109000    


%chk=000020677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020677

0 1
Br 6.809189 0.615052 0.007774
Br -6.812683 0.609680 0.049436
C -0.001197 -0.520713 -0.001796
C 1.287535 0.331812 0.027899
C -1.290440 0.330716 0.035823
C 2.577624 -0.520616 -0.011344
C -2.579694 -0.523225 0.002244
C 3.859776 0.351390 0.018396
C -3.862352 0.347728 0.041982
C 5.117335 -0.518230 -0.029894
C -5.119891 -0.522224 -0.001064
H -0.003562 -1.150429 -0.916154
H 0.001840 -1.221017 0.859648
H 1.291599 0.961091 0.941999
H 1.285285 1.031644 -0.833362
H -1.290333 0.958413 0.951005
H -1.293260 1.031997 -0.824147
H 2.573352 -1.148125 -0.926861
H 2.580583 -1.219830 0.850560
H -2.576969 -1.224104 0.862755
H -2.580352 -1.148957 -0.914423
H 3.857072 1.048771 -0.840814
H 3.870072 0.969626 0.936184
H -3.867604 0.963203 0.961692
H -3.865406 1.047654 -0.815124
H 5.210278 -1.181949 0.844386
H 5.196183 -1.101157 -0.961328
H -5.204154 -1.102941 -0.933422
H -5.208026 -1.187862 0.872250


