$basis * be TZV # be (11s) / [5s] {62111} # SCF energy is -14.5725798674 a.u. (virial theorem = 1.999999986) # R. Ahlrichs, Sept. 93 * 6 s 4700.2365626 .23584389316E-03 704.82845622 .18243791019E-02 160.43110478 .93966148224E-02 45.425347336 .36908924159E-01 14.798334125 .10897561281 5.3512452537 .21694284551 2 s 2.1542044819 .44695408857 .93363744400 .20866985771 1 s .18791432989 1.0000000000 1 s .74648267947E-01 1.0000000000 1 s .32650484598E-01 1.0000000000 * $end