%chk=000055449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055449

0 1
 Br   6.461400      -1.373200     -1.6300000E-02
 O   0.6756000       2.235100     -3.4899998E-02
 O   -6.148600     -0.1969000      0.7298000    
 O   -5.333600      -1.213300      -1.131700    
 N   -2.842400     -0.1048000     -5.6699999E-02
 C   -1.711600      0.8225000     -3.9999999E-02
 C  -0.3819000      6.8700001E-02 -1.8400000E-02
 C   -4.102200      0.6274000     -0.1801000    
 C   0.8108000       1.013600     -2.5699999E-02
 C   -2.845900     -0.9283000       1.151900    
 C    2.185900      0.4328000     -2.2399999E-02
 C    2.322900     -0.9365000     -1.2700000E-02
 C    3.263200       1.288900     -3.0200001E-02
 C   -5.229800     -0.3646000     -0.2552000    
 C    3.607900      -1.479400     -1.0700000E-02
 C    4.548200      0.7460000     -2.8200001E-02
 C    4.720400     -0.6381000     -1.8400000E-02
 H   -1.739400       1.446700     -0.9428000    
 H   -1.771400       1.506500      0.8176000    
 H  -0.2887000     -0.5211000      0.8983000    
 H  -0.3238000     -0.5833000     -0.8975000    
 H   -4.134300       1.225800      -1.098100    
 H   -4.260400       1.308600      0.6653000    
 H   -1.994600      -1.615100       1.178000    
 H   -3.712100      -1.596800       1.204100    
 H   -2.838200     -0.3232000       2.066300    
 H    1.488900      -1.628500     -6.3999998E-03
 H    3.151200       2.368600     -3.7999999E-02
 H    3.725500      -2.560100     -3.1000001E-03
 H    5.404700       1.415400     -3.4499999E-02
 H   -6.885400     -0.8403000      0.6562000    


%chk=000055449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055449

0 1
Br 6.638956 -1.288061 -0.487876
O 0.641806 2.253157 -0.025480
O -6.344753 0.294070 -0.827153
O -5.190901 -1.692084 -0.482677
N -2.858604 -0.148597 0.367797
C -1.713121 0.796020 0.377712
C -0.370427 0.053378 0.261956
C -4.118973 0.515709 0.013862
C 0.811608 0.999306 0.048974
C -2.967119 -0.955382 1.603825
C 2.191002 0.411887 -0.074378
C 2.433515 -0.987532 -0.056291
C 3.292892 1.297855 -0.218683
C -5.213052 -0.446382 -0.439445
C 3.743906 -1.495682 -0.178996
C 4.607207 0.807887 -0.339994
C 4.816315 -0.589367 -0.318575
H -1.806173 1.475400 -0.488232
H -1.703217 1.446032 1.286854
H -0.172052 -0.560373 1.162986
H -0.435368 -0.659615 -0.584847
H -3.945733 1.215505 -0.824484
H -4.556547 1.133259 0.841316
H -2.039191 -1.529392 1.763846
H -3.786816 -1.682912 1.496551
H -3.149579 -0.327496 2.512509
H 1.605214 -1.695375 0.047611
H 3.092428 2.374212 -0.233818
H 3.926900 -2.573637 -0.167524
H 5.451736 1.493992 -0.449413
H -7.059558 -0.332684 -1.122433


