%nprocshared=4
%mem=7000MB
%NoSave
%chk=E:\3rd_Year_Comp_Labs\Main Group Halides\AlCl2Br\chk.chk
%rwf=\tmp\pbs.3909762.cx1b\rwf
# opt b3lyp/gen nosymm geom=connectivity pseudo=read gfinput

RSG_Optimisation_631G_Isomer5

0 1
 Al                -0.00575300    1.38881000   -0.93597200
 Al                 2.45421800   -1.07091100   -0.93528100
 Cl                -0.65231900    2.03535200    1.03007200
 Cl                 3.10023700   -1.71698300    1.03109400
 Br                -0.84586300    2.22896400   -2.89557400
 Cl                 2.38307100    1.31783800   -0.95021900
 Cl                 0.06538500   -0.99994100   -0.95026400
 Br                 3.29484700   -1.91151400   -2.89445000

 1 3 1.0 5 1.0
 2 4 1.0 8 1.0
 3
 4
 5
 6
 7
 8

Al 0
6-31G(d,p)
****
Cl 0
6-31G(d,p)
****
Br 0
LanL2DZ
****

Br 0
LanL2DZ
