Filename = //ic.ac.uk/homes/ak7611/3rdyearlab/NEW_3RDYEARLAB/Lewis acids and bases/Isomer 4/AlCl2Br Isomer4 OPT 3-21G.log

AlCl2Br Isomer 4 Optimisation 3-21G
File Name = AlCl2Br Isomer4 OPT 3-21G
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 3-21G
Charge = 0
Spin = Singlet
E(RB3LYP) = -7438.22539648 a.u.
RMS Gradient Norm = 0.00000917 a.u.
Imaginary Freq = 
Dipole Moment = 1.6650 Debye
Point Group = C1
Job cpu time:       0 days  0 hours  3 minutes 47.9 seconds.