Filename = \\ic.ac.uk\homes\ak7611\3rdyearlab\NEW_3RDYEARLAB\Lewis acids and bases\AK_ALCL2BR_OPT_GEN_no1.log

AlCl2Br optimisation gen no1
File Name = AK_ALCL2BR_OPT_GEN_no1
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = Gen
Charge = 0
Spin = Singlet
E(RB3LYP) = -2352.41626677 a.u.
RMS Gradient Norm = 0.00001459 a.u.
Imaginary Freq = 
Dipole Moment = 0.1658 Debye
Point Group = C1
Job cpu time:       0 days  0 hours  1 minutes 29.0 seconds.