$basis * ta def-SVP # ta (7s6p5d) / [6s3p2d] {211111/411/41} * 2 s 14.400000000 .99343296745 12.000000000 -1.6510077975 1 s 5.0701477302 1.0000000000 1 s .86033356487 1.0000000000 1 s .37158938894 1.0000000000 1 s .10745336254 1.0000000000 1 s .39142776556E-01 1.0000000000 4 p 7.4188720000 .26979695152 5.6984100000 -.46968874449 1.1777211960 .50905100155 .54478533555 .52298161137 1 p .22309270117 1.0000000000 1 p .43100000000E-01 1.0000000000 4 d 3.9738796278 -.52799310714E-01 1.4528884813 .18558319471 .61042908544 .42959071631 .24216276510 .43497228232 1 d .87909318337E-01 1.0000000000 * cl def-SVP # cl (7s5p) / [6s2p] {211111/41} * 5 s 10449.827566 .19708362484E-02 1571.7365221 .14754727977E-01 357.12065523 .66679112875E-01 100.25185935 .17228924084 30.812727554 .15883786100 3 s 51.923789434 -.10009298909 5.7045760975 .60841752753 2.3508376809 .54352153355 1 s .44605124672 1.0000000000 1 s .16848856190 1.0000000000 5 p 307.66790569 -.87801484118E-02 72.102015515 -.63563355471E-01 22.532680262 -.24016428276 7.8991765444 -.47798866557 2.8767268321 -.38515850005 1 p .77459363955 1.0000000000 1 p .21037699698 1.0000000000 1 d .65000000000 1.0000000000 * $ecp * ta def-ecp * ncore = 60 lmax = 3 # coefficient r^n exponent f 12.0179609 2 2.0178811 s-f 1345.8806470 2 14.5464077 36.7668062 2 7.2732038 -12.0179609 2 2.0178811 p-f 378.4253015 2 9.9355653 22.2930909 2 4.9677824 -12.0179609 2 2.0178811 d-f 104.8839557 2 6.3473769 8.7558481 2 3.1736885 -12.0179609 2 2.0178811 * $end