%chk=000062744.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062744

0 1
 Br  -6.321400       1.591000     -5.9500001E-02
 Br   6.321300       1.591200      5.9500001E-02
 O   -2.609500     -3.2200001E-02 -0.3439000    
 O    2.609500     -3.2200001E-02  0.3438000    
 O   -4.527000     -0.6745000      0.7594000    
 O    4.527100     -0.6746000     -0.7593000    
 C   -1.943400      -1.195500      0.1267000    
 C    1.943500      -1.195700     -0.1267000    
 C  -0.5431000      -1.190400     -0.3931000    
 C   0.5432000      -1.190400      0.3931000    
 C   -3.917500      0.1127000      4.9600001E-02
 C    3.917500      0.1127000     -4.9600001E-02
 C   -4.452700       1.388900     -0.5372000    
 C    4.452600       1.389000      0.5371000    
 H   -1.961500      -1.210300       1.222900    
 H   -2.457500      -2.088400     -0.2473000    
 H    1.961600      -1.210600      -1.222900    
 H    2.457600      -2.088500      0.2476000    
 H  -0.4219000      -1.192900      -1.473500    
 H   0.4219000      -1.192700       1.473500    
 H   -4.405200       1.361300      -1.627600    
 H   -3.921800       2.251700     -0.1304000    
 H    4.404900       1.361500       1.627500    
 H    3.921700       2.251800      0.1301000    


%chk=000062744-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062744

0 1
Br -3.483051 2.655542 -1.267925
Br 3.476901 2.663097 1.253759
O -2.550374 0.001232 0.921698
O 2.550938 -0.001118 -0.922068
O -3.849099 -0.915853 -0.793005
O 3.848579 -0.912383 0.796523
C -1.717749 -1.255576 0.946636
C 1.718413 -1.258063 -0.943385
C -0.665617 -1.220849 -0.128915
C 0.666282 -1.220466 0.132068
C -3.575668 0.030250 -0.020350
C 3.575516 0.031150 0.020560
C -4.309450 1.354592 0.045949
C 4.309368 1.355267 -0.049379
H -1.283275 -1.259308 1.957492
H -2.404209 -2.111489 0.810422
H 1.283932 -1.264689 -1.954224
H 2.404958 -2.113522 -0.804785
H -1.033136 -1.221712 -1.164231
H 1.033784 -1.218526 1.167389
H -4.219211 1.828896 1.031538
H -5.351944 1.234829 -0.276076
H 4.223629 1.824349 -1.037878
H 5.350382 1.237249 0.277989


