BERYLLIUM 1S(2)2S(2), 1S CHARGE = 4.000000 SYMMETRY SPECIES S NUMBER OF BASIS FUNCTIONS 12 NUMBER OF CLOSED SHELLS 2 NUMBER OF OPEN SHELLS 0 OPEN SHELL OCCUPATION NUMBER 0 *** FINAL SCF RESULTS *** E = -14.575483926 ORBITAL ENERGIES AND EXPANSION COEFFICIENTS S 1S 2S BASIS/ORB.ENERGY -4.7331763 -0.3093051 S 1.4682369D+04 0.0001303 -0.0000237 S 2.1819292D+03 0.0007660 -0.0001401 S 4.9572119D+02 0.0038229 -0.0006959 S 1.4041641D+02 0.0156043 -0.0028835 S 4.5765949D+01 0.0530626 -0.0098524 S 1.6453927D+01 0.1457940 -0.0286399 S 6.3169932D+00 0.3026836 -0.0637870 S 2.5345931D+00 0.4046899 -0.1171951 S 1.0353655D+00 0.2222588 -0.1210940 S 2.5279254D-01 0.0129795 0.2535158 S 1.0516439D-01 -0.0046937 0.5818290 S 4.2606883D-02 0.0012437 0.2916449