Filename = D:/Module 2/Mo - trans/nm607_trans_post1opt.out

trans 1st optimization
File Name = nm607_trans_post1opt
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = Gen
Charge = 0
Spin = Singlet
E(RB3LYP) = -617.60295631 a.u.
RMS Gradient Norm = 0.00024159 a.u.
Imaginary Freq = 
Dipole Moment = 0.0131 Debye
Point Group = C1
Job cpu time:  0 days  0 hours 10 minutes 53.0 seconds.