BORON 1S(2)2S(2)2P(1), 2P CHARGE = 5.000000 SYMMETRY SPECIES S P NUMBER OF BASIS FUNCTIONS 12 8 NUMBER OF CLOSED SHELLS 2 0 NUMBER OF OPEN SHELLS 0 1 OPEN SHELL OCCUPATION NUMBER 0 1 *** FINAL SCF RESULTS *** E = -24.535711382 ORBITAL ENERGIES AND EXPANSION COEFFICIENTS S 1S 2S BASIS/ORB.ENERGY -7.6969453 -.4948779 1S .3809521D+05 .0000977 -.0000197 1S .4713533D+04 .0006028 -.0001221 1S .9719215D+03 .0031308 -.0006323 1S .2612165D+03 .0133117 -.0027210 1S .8261030D+02 .0468906 -.0096579 1S .2912811D+02 .1342026 -.0291347 1S .1104641D+02 .2922376 -.0686372 1S .4400495D+01 .4102157 -.1297172 1S .1793004D+01 .2415959 -.1316558 1S .4897471D+00 .0178924 .2395955 1S .1972850D+00 -.0046007 .5866630 1S .7672040D-01 .0012957 .3123118 P 2P BASIS/ORB.ENERGY -.3096940 2P .8273725D+02 .0006308 2P .1722964D+02 .0060338 2P .5041892D+01 .0284572 2P .1717029D+01 .1020531 2P .6399337D+00 .2534664 2P .2545549D+00 .4056025 2P .1000740D+00 .3623709 2P .3933259D-01 .0774058