%chk=000070802.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070802

0 1
 Br   1.766000       2.703200       0.000000    
 O   -1.305300       2.293600      9.9999997E-05
 O    2.803300     -0.2165000       0.000000    
 O   -1.389400      -2.461700       0.000000    
 C  -0.6199000       1.115000     -9.9999997E-05
 C    1.441800     -0.1445000       0.000000    
 C  -0.6799000      -1.300200       0.000000    
 C   0.7745000       1.080400     -9.9999997E-05
 C   -1.347100     -7.5400002E-02   0.000000    
 C   0.7146000      -1.334900       0.000000    
 C   -2.728800       2.214100      9.9999997E-05
 C    3.382300      -1.519400      9.9999997E-05
 C   -2.812100      -2.353600       0.000000    
 H   -2.425700     -6.0300000E-02  9.9999997E-05
 H    1.163500      -2.322300     -9.9999997E-05
 H   -3.111500       1.745300      0.9134000    
 H   -3.111500       1.745300     -0.9132000    
 H   -3.103900       3.243200      9.9999997E-05
 H    4.469400      -1.386200      1.9999999E-04
 H    3.134300      -2.073900      0.9118000    
 H    3.134400      -2.074000     -0.9114000    
 H   -3.181400      -1.871100      0.9115000    
 H   -3.210800      -3.373500       0.000000    
 H   -3.181500      -1.871000     -0.9113000    


%chk=000070802-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070802

0 1
Br 1.784080 2.681509 0.000089
O -1.239052 2.369297 0.000126
O 2.795460 -0.190030 0.000051
O -1.414772 -2.586000 0.000046
C -0.670783 1.094000 0.000087
C 1.401698 -0.220871 0.000061
C -0.764549 -1.343574 0.000056
C 0.744699 1.040055 0.000078
C -1.439330 -0.101478 0.000081
C 0.645890 -1.415740 0.000045
C -2.696326 2.475597 0.000024
C 3.506917 -1.467787 0.000055
C -2.875616 -2.591495 0.000034
H -2.530483 -0.052537 0.000113
H 1.118625 -2.400191 0.000013
H -3.137886 2.013195 0.905433
H -3.137763 2.013135 -0.905415
H -2.901828 3.556250 -0.000024
H 4.573457 -1.198622 0.000089
H 3.270376 -2.062247 0.904590
H 3.270429 -2.062221 -0.904518
H -3.283406 -2.097298 0.904713
H -3.161146 -3.654103 0.000001
H -3.283390 -2.097246 -0.904627


