Filename = //ic.ac.uk/homes/ak7611/3rdyearlab/NEW_3RDYEARLAB/New NH3/AK_NH3_OPT_631G_DP.LOG

NH3 Optimisation
File Name = AK_NH3_OPT_631G_DP
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -56.55776863 a.u.
RMS Gradient Norm = 0.00000289 a.u.
Imaginary Freq = 
Dipole Moment = 1.8464 Debye
Point Group = C3V
Job cpu time:       0 days  0 hours  0 minutes 10.0 seconds.