Filename = \\icnas3.cc.ic.ac.uk\hna4117\3rdyearlab\HNA_BH3_further_opt_631g.log

BH3 optimisation
File Name = HNA_BH3_further_opt_631g
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -26.61532350 a.u.
RMS Gradient Norm = 0.00008174 a.u.
Imaginary Freq = 
Dipole Moment = 0.0003 Debye
Point Group = CS
Job cpu time:       0 days  0 hours  1 minutes 21.0 seconds.