$basis * al TZV # al (14s9p) / [5s4p] {73211/6111} # SCF energy is -241.8701524897 a.u. (virial theorem = 2.000000009) # A. Schaefer, Aug. 93 * 7 s 37792.550772 .57047888709E-03 5668.0682165 .44093016538E-02 1289.8582841 .22630967411E-01 364.86596028 .88025644295E-01 118.57631515 .25223701612 42.024867605 .45960547169 15.499501629 .33277886014 3 s 75.208026598 .19250560190E-01 23.031408972 .87906743952E-01 3.6348797649 -.34246704535 2 s 1.6065049957 1.5106266058 .76103394581 .58071016470 1 s .16556708849 1.0000000000 1 s .60041577113E-01 1.0000000000 6 p 452.52303192 .23110812466E-02 107.08195049 .18568641823E-01 34.131021255 .87216237035E-01 12.587037428 .26902101523 4.9811919704 .52128324272 2.0070350900 .60271687494 1 p .80083714374 1.0000000000 1 p .20178927472 1.0000000000 1 p .57895550392E-01 1.0000000000 * al TZVE # al (15s9p) / [6s4p] {732111/6111} # SCF energy is -241.8704211552 a.u. (virial theorem = 2.000152563) # A. Schaefer, Aug. 93 * 7 s 37792.550772 .57047888709E-03 5668.0682165 .44093016538E-02 1289.8582841 .22630967411E-01 364.86596028 .88025644295E-01 118.57631515 .25223701612 42.024867605 .45960547169 15.499501629 .33277886014 3 s 75.208026598 .19250560190E-01 23.031408972 .87906743952E-01 3.6348797649 -.34246704535 2 s 1.6065049957 1.5106266058 .76103394581 .58071016470 1 s .93021145626 1.0000000000 1 s .17458043537 1.0000000000 1 s .62843560894E-01 1.0000000000 6 p 452.52303192 .23110812466E-02 107.08195049 .18568641823E-01 34.131021255 .87216237035E-01 12.587037428 .26902101523 4.9811919704 .52128324272 2.0070350900 .60271687494 1 p .80083714374 1.0000000000 1 p .20178927472 1.0000000000 1 p .57895550392E-01 1.0000000000 * $end