%chk=000177796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177796

0 1
 Br   5.837200      0.1149000     -0.6716000    
 O   0.7857000      0.6708000      0.6593000    
 C    3.100300      0.2969000      8.1799999E-02
 C    1.753600     -0.3429000      0.3918000    
 C  -0.5109000      0.3831000      0.3619000    
 C   -3.168700     -0.2056000     -0.2482000    
 C    4.151600     -0.7518000     -0.2279000    
 C   -1.384200       1.405300     -9.7000003E-03
 C  -0.9666000     -0.9337000      0.4285000    
 C   -2.713100       1.111100     -0.3147000    
 C   -2.295600      -1.227900      0.1234000    
 C   -4.589200     -0.5202000     -0.5745000    
 H    3.411000      0.9195000      0.9305000    
 H    2.983600      0.9899000     -0.7614000    
 H    1.466000     -0.9499000     -0.4768000    
 H    1.841900     -0.9898000       1.272600    
 H    3.880200      -1.362200      -1.093600    
 H    4.348100      -1.400800      0.6298000    
 H   -1.034600       2.432700     -6.4000003E-02
 H  -0.3276000      -1.754900      0.7395000    
 H   -3.383200       1.916000     -0.6047000    
 H   -2.640300      -2.256900      0.1827000    
 H   -4.944100      -1.384300     -2.4999999E-03
 H   -5.247200      0.3196000     -0.3266000    
 H   -4.689600     -0.7410000      -1.641800    


%chk=000177796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177796

0 1
Br 6.159597 0.183169 0.134242
O 0.849488 0.687776 -0.104901
C 3.217912 0.306571 0.026777
C 1.843049 -0.381185 0.059433
C -0.510426 0.316663 -0.114266
C -3.315810 -0.204264 -0.162709
C 4.342674 -0.722886 0.173548
C -1.428957 1.383387 -0.274904
C -0.984606 -1.008988 0.022986
C -2.810041 1.118743 -0.297685
C -2.379408 -1.252006 -0.003199
C -4.811172 -0.472017 -0.190367
H 3.269152 1.049375 0.841979
H 3.322854 0.854866 -0.925800
H 1.744720 -1.119910 -0.764538
H 1.679238 -0.905103 1.025221
H 4.374127 -1.445181 -0.657456
H 4.317312 -1.252793 1.138901
H -1.039671 2.400966 -0.378833
H -0.296502 -1.850288 0.149468
H -3.511193 1.953171 -0.422685
H -2.739108 -2.282710 0.103530
H -5.032059 -1.544592 -0.052012
H -5.336480 0.084068 0.609074
H -5.260392 -0.158934 -1.152003


