$basis * k TZV # k (17s10p) / [6s3p] {842111/631} # SCF energy is -599.1530135224 a.u. (virial theorem = 2.000000029) # R. Ahlrichs, Sept. 93 * 8 s 153976.18325 .23662636107E-03 23082.497672 .18342929137E-02 5253.2344745 .95310527769E-02 1486.9550133 .38638406980E-01 484.06333726 .12480768502 173.56653980 .29278861009 67.116381464 .40633425860 26.339502054 .20077215860 4 s 172.87693567 -.24200960936E-01 53.058649063 -.11553095040 7.9212753964 .57455545175 3.2108880472 .57023185107 2 s 4.5662070895 -.22615763466 .70209907282 .75528392045 1 s .28258942635 1.0000000000 1 s .35805824617E-01 1.0000000000 1 s .15819213245E-01 1.0000000000 6 p 728.18449873 .26150689792E-02 172.13265061 .20673630835E-01 54.829847075 .93205603870E-01 20.166266494 .25436518210 7.8610728806 .39131132810 3.1105213132 .22481345943 3 p 11.757337492 -.25777289217E-01 1.5139617411 .57359428604 .58328591795 1.0798320002 1 p .21570478076 1.0000000000 * $end