Filename = //ic.ac.uk/homes/msm11/Desktop/msm11 - 3rd year lab - inorganic/bbr3/msm11 - bbr3 optimised.log

bh3 second optimisation
File Name = msm11 - bbr3 optimised
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = Gen
Charge = 0
Spin = Singlet
E(RB3LYP) = -64.43645296 a.u.
RMS Gradient Norm = 0.00000382 a.u.
Imaginary Freq = 
Dipole Moment = 0.0000 Debye
Point Group = D3H
Job cpu time:       0 days  0 hours  0 minutes 37.0 seconds.