Using Gaussian98 #b3pw91/6-311g(d) scf=direct fopt Optimized Structure 0.000000 0.000000 4.201680 0.000000 0.000000 0.000000 0.000000 0.000000 -4.201680 Distance matrix (angstroms): 1 2 3 1 Ca 0.000000 2 Ca 4.201680 0.000000 3 Ca 8.403361 4.201680 0.000000 SCF Done: E(RB+HF-PW91) = -2032.54195128 E(3 atoms of Calcium) = -2032.529348 Binding Energy = 0.3429 ev (0.1143 ev/atom)