Filename = //ic.ac.uk/homes/kk2311/Desktop/3rdyearinorganiccomp/NH3BH3/BH3 REAL/opt/KK_BH3_OPT631G_KEY.LOG

KK_BH3_keywords
File Name = KK_BH3_OPT631G_KEY
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -26.61532360 a.u.
RMS Gradient Norm = 0.00000590 a.u.
Imaginary Freq = 
Dipole Moment = 0.0001 Debye
Point Group = CS
Job cpu time:       0 days  0 hours  0 minutes 15.0 seconds.