%chk=000011745.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011745

0 1
 Br  -2.845800      0.8431000      8.1799999E-02
 O    1.084900     -0.2557000      9.9999997E-05
 O  -2.2500001E-02   1.757700     -1.5300000E-02
 C   -1.277800     -0.3508000     -5.2000000E-03
 C   -1.314300      -1.242800       1.232300    
 C   -1.388300      -1.154100      -1.298000    
 C  -3.4400001E-02  0.5336000     -8.7000001E-03
 C    2.335800      0.4400000      1.5000000E-03
 C    3.462400     -0.5710000      1.1400000E-02
 H   -1.213400     -0.6550000       2.152400    
 H   -2.252300      -1.806200       1.297600    
 H  -0.4946000      -1.970200       1.223200    
 H   -1.352700     -0.5018000      -2.178600    
 H   -2.323100      -1.724600      -1.342000    
 H  -0.5613000      -1.867000      -1.392600    
 H    2.407000       1.064600     -0.8960000    
 H    2.399700       1.074100      0.8927000    
 H    4.435700     -7.2499998E-02  1.2700000E-02
 H    3.393800      -1.215500      0.8941000    
 H    3.401000      -1.224900     -0.8648000    


%chk=000011745-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000011745

0 1
Br -2.966946 0.851439 0.079661
O 1.076635 -0.253549 0.004621
O -0.001473 1.809151 -0.001738
C -1.307341 -0.350789 0.002931
C -1.332262 -1.253696 1.252584
C -1.380867 -1.158229 -1.309707
C -0.059974 0.564694 0.005188
C 2.392106 0.458536 -0.007107
C 3.476306 -0.612907 0.003035
H -1.324307 -0.656685 2.179230
H -2.241330 -1.877943 1.246036
H -0.441754 -1.907813 1.240915
H -1.405095 -0.493612 -2.188807
H -2.290790 -1.781222 -1.316610
H -0.492571 -1.812280 -1.378698
H 2.431128 1.096271 -0.908965
H 2.435606 1.117431 0.879129
H 4.472147 -0.132964 -0.005319
H 3.402471 -1.241350 0.906734
H 3.398111 -1.263480 -0.884513


