Filename = //ic.ac.uk/homes/msm11/Desktop/msm11 - 3rd year lab - inorganic/New folder/msm11 gabr3 optimised.log

msm11 - TlBr3 optimisation
File Name = msm11 gabr3 optimised
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = LANL2DZ
Charge = 0
Spin = Singlet
E(RB3LYP) = -41.70082783 a.u.
RMS Gradient Norm = 0.00000016 a.u.
Imaginary Freq = 
Dipole Moment = 0.0000 Debye
Point Group = D3H
Job cpu time:       0 days  0 hours  0 minutes 23.5 seconds.