%chk=000051825.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051825

0 1
 Br  -2.988700      -2.366200     -4.4000000E-03
 O    2.300100      -1.729000      6.2000002E-03
 O    4.373600     -2.0500001E-02 -8.9999996E-03
 C   0.5944000     -6.2100001E-02  1.7000000E-03
 C   -1.806400     -0.8124000     -1.8000000E-03
 C   -1.147100       1.261100      -1.261500    
 C   -1.150300       1.259500       1.262200    
 C  -0.3435000      -1.286700     -3.0000001E-04
 C   0.3175000      0.7884000      -1.254400    
 C   0.3142000      0.7867000       1.258300    
 C   -2.074800      3.2099999E-02  -1.258400    
 C   -2.078000      3.0700000E-02   1.255100    
 C   -1.413900       2.100200      6.0000003E-04
 C    2.021200     -0.5310000      3.5000001E-03
 C    3.081800      0.5493000      2.0999999E-03
 H   -1.337300       1.865600      -2.155300    
 H   -1.342700       1.862900       2.156300    
 H  -0.1487000      -1.917600     -0.8791000    
 H  -0.1510000      -1.918800      0.8782000    
 H   0.5314000      0.2108000      -2.163000    
 H   0.9610000       1.674700      -1.291300    
 H   0.9592000       1.672200       1.297600    
 H   0.5255000      0.2077000       2.166700    
 H   -3.122000      0.3604000      -1.289800    
 H   -1.906400     -0.5596000      -2.167800    
 H   -1.912200     -0.5621000       2.164200    
 H   -3.125200      0.3589000       1.284200    
 H  -0.7711000       2.989000      1.9000000E-03
 H   -2.451000       2.457600     -5.0000002E-04
 H    3.008500       1.152900      0.9078000    
 H    2.995600       1.187100     -0.8787000    
 H    4.479600     -0.4900000     -0.8541000    


%chk=000051825-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051825

0 1
Br -2.972360 -2.487405 -0.162533
O 2.438857 -1.509106 0.633254
O 4.496675 -0.027615 -0.183563
C 0.614996 0.003528 0.000027
C -1.774779 -0.795679 -0.056322
C -1.177693 1.354494 -1.197448
C -1.200705 1.210928 1.329618
C -0.307705 -1.259999 -0.069431
C 0.315798 0.930511 -1.216247
C 0.291441 0.785444 1.326787
C -2.083780 0.087778 -1.280480
C -2.105920 -0.057683 1.253551
C -1.487010 2.128154 0.111297
C 2.080580 -0.429831 0.079214
C 3.179026 0.486152 -0.476082
H -1.384586 1.997880 -2.073823
H -1.419032 1.751550 2.270597
H -0.095123 -1.831154 -0.991650
H -0.093716 -1.923111 0.785610
H 0.543967 0.399104 -2.161377
H 0.951579 1.836587 -1.183581
H 0.939193 1.680809 1.407917
H 0.509534 0.134911 2.194994
H -3.150595 0.377071 -1.282983
H -1.884950 -0.471525 -2.213293
H -1.920342 -0.717327 2.120826
H -3.172697 0.230789 1.270858
H -0.865747 3.043891 0.167991
H -2.546291 2.450770 0.119545
H 3.066613 1.501508 -0.041520
H 3.042085 0.580251 -1.574548
H 4.365987 -0.909875 0.269997


