Using Gaussian98 #b3pw91/6-311g(d) scf=direct fopt Optimized Geometry 0.000000 2.856244 -0.528209 -2.856244 0.000000 -0.528209 0.000000 -2.856244 -0.528209 2.856244 0.000000 -0.528209 0.000000 0.000000 2.112835 Distance matrix (angstroms): 1 2 3 4 5 1 Ca 0.000000 2 Ca 4.039338 0.000000 3 Ca 5.712487 4.039338 0.000000 4 Ca 4.039338 5.712487 4.039338 0.000000 5 Ca 3.890146 3.890146 3.890146 3.890146 0.000000 SCF Done: E(RB+HF-PW91) = -3387.61127326 au E(5 atoms of Calcium) = -3387.548914 au Binding Energy = 1.6969 ev (0.3394 ev/atom)