Filename = \\icnas3.cc.ic.ac.uk\mt4618\IMM2-1styearlab\MTK_nh3_optf_pop.log Title Card Required File Name = MTK_nh3_optf_pop File Type = .log Calculation Type = FREQ Calculation Method = RB3LYP Basis Set = 6-31G(d,p) Charge = 0 Spin = Singlet E(RB3LYP) = -56.44397188 a.u. RMS Gradient Norm = 0.05399560 a.u. Imaginary Freq = Dipole Moment = 1.5008 Debye Point Group = C3V Job cpu time: 0 days 0 hours 0 minutes 28.0 seconds.