%chk=000062526.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062526

0 1
 Br -5.4900002E-02  -2.865500     -0.6432000    
 Br -3.4200002E-02   2.878400     -0.6294000    
 O   -1.159900      1.0900000E-02 -0.9295000    
 O   -1.677500      9.9999998E-03   1.351500    
 N    5.365100     -1.6700000E-02  0.7836000    
 C   -4.448000     -3.7000000E-03  0.8089000    
 C   -3.435700      1.8600000E-02 -0.3334000    
 C   -5.875600     -3.1599998E-02  0.2883000    
 C   -2.010600      1.2800000E-02  0.1743000    
 C   0.1911000      5.5000000E-03 -0.5743000    
 C   0.8306000      -1.205200     -0.4064000    
 C   0.8402000       1.210700     -0.4038000    
 C    2.179700      -1.211100     -5.2099999E-02
 C    2.189300       1.204900     -4.9699999E-02
 C    2.859000     -6.0000001E-03  0.1262000    
 C    4.241300     -1.1900000E-02  0.4889000    
 H   -3.579800      0.9202000     -0.9390000    
 H   -3.574500     -0.8646000     -0.9671000    
 H   -4.310900      0.8777000       1.446700    
 H   -4.277700     -0.8822000       1.442900    
 H   -6.087700      0.8521000     -0.3220000    
 H   -6.053100     -0.9223000     -0.3227000    
 H   -6.583300     -4.5800000E-02   1.123000    
 H    2.705300      -2.154200      8.5400000E-02
 H    2.722200       2.143500      9.0700001E-02


%chk=000062526-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062526

0 1
Br -0.022538 -2.905486 -0.460575
Br -0.016340 2.907249 -0.484908
O -1.148659 0.001739 -0.742806
O -1.766648 -0.004038 1.527401
N 5.614935 -0.000730 0.476018
C -4.620378 -0.020243 0.811041
C -3.504459 0.004521 -0.252595
C -6.021205 -0.008708 0.165048
C -2.115320 -0.000037 0.340578
C 0.219728 0.000889 -0.427461
C 0.932395 -1.218164 -0.302005
C 0.935217 1.219310 -0.312641
C 2.318038 -1.232451 -0.068544
C 2.320916 1.232534 -0.079533
C 3.016081 -0.000252 0.043615
C 4.435710 -0.000835 0.280468
H -3.589844 0.899125 -0.901143
H -3.582392 -0.863989 -0.936186
H -4.504472 0.849700 1.483924
H -4.501608 -0.918258 1.445521
H -6.172609 0.897371 -0.451335
H -6.170931 -0.889282 -0.487600
H -6.810930 -0.025122 0.937041
H 2.855325 -2.178882 0.026958
H 2.860389 2.178535 0.007520


