%chk=000077968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077968

0 1
 Br  -2.212800       1.356200      2.6400000E-02
 C  -0.8565000     -0.1008000     -4.4999998E-03
 C   0.5238000      0.5871000      1.8900000E-02
 C    1.719700     -0.3711000      2.8100001E-02
 C   -1.111000     -0.9628000       1.233200    
 C   -1.100100     -0.8993000      -1.286100    
 C    3.036900      0.3907000     -1.6000001E-02
 H   0.5953000       1.238100      0.9011000    
 H   0.6137000       1.250300     -0.8526000    
 H    1.678900      -1.043600     -0.8348000    
 H    1.702900     -0.9917000      0.9302000    
 H   -2.140700      -1.338400       1.257000    
 H  -0.9479000     -0.3954000       2.156700    
 H  -0.4493000      -1.835000       1.254900    
 H  -0.9282000     -0.2867000      -2.178600    
 H   -2.130200      -1.271400      -1.338200    
 H  -0.4399000      -1.770700      -1.346200    
 H    3.879000     -0.3083000     -4.8000002E-03
 H    3.135000       1.054700      0.8487000    
 H    3.110200      0.9958000     -0.9252000    


%chk=000077968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077968

0 1
Br -2.268141 1.424871 0.012927
C -0.848465 -0.130763 -0.006760
C 0.525259 0.579810 0.003845
C 1.742416 -0.384800 -0.007478
C -1.126269 -0.954399 1.260657
C -1.124401 -0.920490 -1.296087
C 3.074954 0.396373 0.005464
H 0.587019 1.225248 0.900962
H 0.588723 1.248920 -0.875595
H 1.707010 -1.031166 -0.905760
H 1.703954 -1.055728 0.872531
H -2.160147 -1.337913 1.266097
H -0.971781 -0.352346 2.171837
H -0.438879 -1.822811 1.293769
H -0.966037 -0.295200 -2.190808
H -2.159111 -1.301318 -1.314221
H -0.438800 -1.789244 -1.349707
H 3.941503 -0.289544 -0.000894
H 3.152827 1.033021 0.906457
H 3.157169 1.055178 -0.879035


