Cesium [Xe]6s(1) Nuclear Charge = 55.0000000000 Atomic Mass = 133.0000000000 Nuclear Radius = 1.180129D-04 Speed of Light = 137.0359895000 S+ P- P+ D- D+ Number of Closed Shells 5 4 4 2 2 Open Shells 1 0 0 0 0 Conf Weight Open Shell Occupation Numbers 1 1.00000000 1.0 0.0 0.0 0.0 0.0 * Energies Total Energy = -7.78676798800357D+03 Mass Energy = -7.78622028582568D+03 Kinetic Energy = 1.60781714049167D+04 Potential Energy = -1.60787191070946D+04 NORMALIZED BASIS SPINORS SYMMETRY EXPONENT PARAM COEFFICIENTS SPECIES LARGE-COMPONENT SMALL-COMPONENT S+ 1 4.7523280754D+07 1.0000000000D+00 1.0000000000D+00 2 1.0147340752D+07 1.0000000000D+00 1.0000000000D+00 3 2.8196140089D+06 1.0000000000D+00 1.0000000000D+00 4 8.7122662601D+05 1.0000000000D+00 1.0000000000D+00 5 2.9413692328D+05 1.0000000000D+00 1.0000000000D+00 6 1.0643401546D+05 1.0000000000D+00 1.0000000000D+00 7 4.0952443316D+04 1.0000000000D+00 1.0000000000D+00 8 1.6624445383D+04 1.0000000000D+00 1.0000000000D+00 9 7.0740487133D+03 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------------ ------------ ------------ *** Large Component *** 1 4.1253124D-05 -1.9761996D-05 -8.8875841D-06 2.9545046D-06 2 3.0435303D-04 -1.4605743D-04 -6.5803532D-05 2.1963607D-05 3 1.6445214D-03 -7.9185856D-04 -3.5644009D-04 1.1846131D-04 4 7.1870908D-03 -3.4805272D-03 -1.5711330D-03 5.2469534D-04 5 2.6132980D-02 -1.2823628D-02 -5.7943565D-03 1.9267442D-03 6 7.8692072D-02 -3.9615124D-02 -1.8029461D-02 6.0322162D-03 7 1.8753617D-01 -9.8561766D-02 -4.5162608D-02 1.5044952D-02 8 3.2473506D-01 -1.8087007D-01 -8.4298872D-02 2.8387990D-02 9 3.4619462D-01 -1.9021085D-01 -8.7381273D-02 2.8878473D-02 10 1.7701195D-01 4.8688221D-02 4.3648383D-02 -1.5274360D-02 11 2.8996227D-02 4.4883356D-01 3.0375353D-01 -1.1096575D-01 12 7.4358185D-04 4.7657900D-01 3.5448417D-01 -1.2512632D-01 13 -2.6453406D-06 1.4227543D-01 -1.8841432D-01 9.1657645D-02 14 -1.0588087D-04 7.2820250D-03 -6.3670207D-01 3.2803837D-01 15 -2.1051403D-05 1.4597386D-03 -3.6092255D-01 1.7502506D-01 16 6.2241426D-07 -3.7664394D-04 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-8.5000634D-03 4.3788423D-03 33 -1.8441756D-07 1.3710792D-05 -3.3987683D-03 1.6480900D-03 34 -1.9596121D-09 -2.2938582D-06 -2.3004820D-04 -2.4872397D-03 35 1.2389683D-10 5.7012803D-07 6.5361279D-06 -2.4349726D-03 36 -1.9625685D-10 -1.0485477D-07 -1.3161997D-06 -5.1833431D-04 3D- 4D- -2.8125612D+01 -3.3022108D+00 ------------ ------------ *** Large Component *** 1 2.3714850D-04 -1.0300109D-04 2 1.9027860D-03 -8.2441897D-04 3 1.0979443D-02 -4.8078373D-03 4 4.5380557D-02 -1.9952884D-02 5 1.3531621D-01 -6.0851671D-02 6 2.8007244D-01 -1.2521431D-01 7 3.8017053D-01 -1.6248115D-01 8 2.8350049D-01 -4.5377434D-02 9 8.6622804D-02 2.7268134D-01 10 6.2594285D-03 4.8094977D-01 11 2.5648583D-04 3.3124153D-01 12 -1.1240748D-04 7.4078997D-02 *** Small Component *** 13 8.7448972D-05 -3.8063294D-05 14 5.2423690D-04 -2.2704284D-04 15 2.0385994D-03 -8.9287608D-04 16 5.7173185D-03 -2.5136712D-03 17 1.1779797D-02 -5.2978979D-03 18 1.7165434D-02 -7.6763020D-03 19 1.6560714D-02 -7.0809346D-03 20 8.8430861D-03 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4.1970996D-04 * Radial Moments Sym Orb S+ 1 7.74869D+03 5.93971D+01 2.61035D-02 9.24773D-04 4.14369D-05 2.25203D-06 2 9.23862D+02 1.39397D+01 1.11553D-01 1.47419D-02 2.21902D-03 3.76418D-04 3 1.89686D+02 5.01412D+00 2.97302D-01 1.01135D-01 3.79257D-02 1.55471D-02 4 4.10693D+01 2.01862D+00 6.94742D-01 5.44032D-01 4.65257D-01 4.31812D-01 5 6.01771D+00 7.35194D-01 1.77012D+00 3.52984D+00 7.77017D+00 1.88209D+01 6 3.48984D-01 2.00645D-01 6.08549D+00 4.20061D+01 3.24076D+02 2.77342D+03 P- 1 2.94678D+02 1.38824D+01 9.41294D-02 1.09109D-02 1.50425D-03 2.40884D-04 2 6.05866D+01 4.91494D+00 2.87793D-01 9.62337D-02 3.58591D-02 1.47528D-02 3 1.27325D+01 1.91058D+00 7.21611D-01 5.91678D-01 5.33747D-01 5.26289D-01 4 1.63957D+00 6.37149D-01 2.02773D+00 4.67526D+00 1.20252D+01 3.43094D+01 P+ 1 2.20521D+02 1.27235D+01 9.99757D-02 1.21794D-02 1.75545D-03 2.92995D-04 2 4.59342D+01 4.63141D+00 2.99253D-01 1.03856D-01 4.01326D-02 1.71077D-02 3 9.78791D+00 1.82437D+00 7.47144D-01 6.34147D-01 5.92235D-01 6.04629D-01 4 1.25191D+00 6.06337D-01 2.11908D+00 5.11370D+00 1.38071D+01 4.15407D+01 D- 1 2.51547D+01 4.47688D+00 2.70527D-01 8.64326D-02 3.20012D-02 1.35283D-02 2 4.60320D+00 1.58771D+00 8.30586D-01 8.01422D-01 8.72767D-01 1.06655D+00 D+ 1 2.41733D+01 4.40395D+00 2.74161D-01 8.86290D-02 3.31715D-02 1.41674D-02 2 4.41960D+00 1.56457D+00 8.40835D-01 8.21173D-01 9.05279D-01 1.12019D+00 ========================================================================================= Barium [Xe]6s(2) Nuclear Charge = 56.0000000000 Atomic Mass = 138.0000000000 Nuclear Radius = 1.193015d-04 Speed of Light = 137.0359895000 S+ P- P+ D- D+ Number of Closed Shells 6 4 4 2 2 Open Shells 0 0 0 0 0 * Energies Total Energy = -8.13564109143514d+03 Mass Energy = -8.13502127531026d+03 Kinetic Energy = 1.68193776573360d+04 Potential Energy = -1.68199974734609d+04 NORMALIZED BASIS SPINORS SYMMETRY EXPONENT PARAM COEFFICIENTS SPECIES LARGE-COMPONENT SMALL-COMPONENT S+ 1 4.7098312035d+07 1.0000000000d+00 1.0000000000d+00 2 1.0165870064d+07 1.0000000000d+00 1.0000000000d+00 3 2.8559073268d+06 1.0000000000d+00 1.0000000000d+00 4 8.9118218117d+05 1.0000000000d+00 1.0000000000d+00 5 3.0359865955d+05 1.0000000000d+00 1.0000000000d+00 6 1.1065969720d+05 1.0000000000d+00 1.0000000000d+00 7 4.2821515911d+04 1.0000000000d+00 1.0000000000d+00 8 1.7465372353d+04 1.0000000000d+00 1.0000000000d+00 9 7.4624970793d+03 1.0000000000d+00 1.0000000000d+00 10 3.3220080510d+03 1.0000000000d+00 1.0000000000d+00 11 1.5330282681d+03 1.0000000000d+00 1.0000000000d+00 12 7.2953787673d+02 1.0000000000d+00 1.0000000000d+00 13 3.5472619933d+02 1.0000000000d+00 1.0000000000d+00 14 1.7083607591d+02 1.0000000000d+00 1.0000000000d+00 15 8.7177329630d+01 1.0000000000d+00 1.0000000000d+00 16 4.4527034284d+01 1.0000000000d+00 1.0000000000d+00 17 2.1541462790d+01 1.0000000000d+00 1.0000000000d+00 18 1.1754840154d+01 1.0000000000d+00 1.0000000000d+00 19 6.1962330184d+00 1.0000000000d+00 1.0000000000d+00 20 3.0402150001d+00 1.0000000000d+00 1.0000000000d+00 21 1.5267508511d+00 1.0000000000d+00 1.0000000000d+00 22 5.1588077595d-01 1.0000000000d+00 1.0000000000d+00 23 2.3465227668d-01 1.0000000000d+00 1.0000000000d+00 24 4.5381312950d-02 1.0000000000d+00 1.0000000000d+00 25 1.9397776817d-02 1.0000000000d+00 1.0000000000d+00 P- 1 3.2531102693d+06 1.0000000000d+00 1.0000000000d+00 2 4.7830930991d+05 1.0000000000d+00 1.0000000000d+00 3 1.0017380262d+05 1.0000000000d+00 1.0000000000d+00 4 2.5882450019d+04 1.0000000000d+00 1.0000000000d+00 5 7.8647365794d+03 1.0000000000d+00 1.0000000000d+00 6 2.7338028902d+03 1.0000000000d+00 1.0000000000d+00 7 1.0601506152d+03 1.0000000000d+00 1.0000000000d+00 8 4.4780251051d+02 1.0000000000d+00 1.0000000000d+00 9 2.0140940127d+02 1.0000000000d+00 1.0000000000d+00 10 9.4830115666d+01 1.0000000000d+00 1.0000000000d+00 11 4.5895070130d+01 1.0000000000d+00 1.0000000000d+00 12 2.1901169204d+01 1.0000000000d+00 1.0000000000d+00 13 1.0769404180d+01 1.0000000000d+00 1.0000000000d+00 14 4.9031359989d+00 1.0000000000d+00 1.0000000000d+00 15 2.3198841160d+00 1.0000000000d+00 1.0000000000d+00 16 1.0122620437d+00 1.0000000000d+00 1.0000000000d+00 17 4.3761498803d-01 1.0000000000d+00 1.0000000000d+00 18 1.7316298283d-01 1.0000000000d+00 1.0000000000d+00 P+ 1 1.4969388405d+05 1.0000000000d+00 1.0000000000d+00 2 3.2326466785d+04 1.0000000000d+00 1.0000000000d+00 3 9.8516434891d+03 1.0000000000d+00 1.0000000000d+00 4 3.5943349923d+03 1.0000000000d+00 1.0000000000d+00 5 1.4716818053d+03 1.0000000000d+00 1.0000000000d+00 6 6.5371632401d+02 1.0000000000d+00 1.0000000000d+00 7 3.0858938426d+02 1.0000000000d+00 1.0000000000d+00 8 1.5224349238d+02 1.0000000000d+00 1.0000000000d+00 9 7.7647635534d+01 1.0000000000d+00 1.0000000000d+00 10 4.0247129068d+01 1.0000000000d+00 1.0000000000d+00 11 2.0718392600d+01 1.0000000000d+00 1.0000000000d+00 12 1.0926332542d+01 1.0000000000d+00 1.0000000000d+00 13 5.6526703960d+00 1.0000000000d+00 1.0000000000d+00 14 2.8815095344d+00 1.0000000000d+00 1.0000000000d+00 15 1.4480266910d+00 1.0000000000d+00 1.0000000000d+00 16 6.3221984840d-01 1.0000000000d+00 1.0000000000d+00 17 2.8585696309d-01 1.0000000000d+00 1.0000000000d+00 18 1.1790996527d-01 1.0000000000d+00 1.0000000000d+00 D- 1 4.9888615452d+03 1.0000000000d+00 1.0000000000d+00 2 1.3000880287d+03 1.0000000000d+00 1.0000000000d+00 3 4.6641544857d+02 1.0000000000d+00 1.0000000000d+00 4 1.9635380747d+02 1.0000000000d+00 1.0000000000d+00 5 9.0509397909d+01 1.0000000000d+00 1.0000000000d+00 6 4.4247559935d+01 1.0000000000d+00 1.0000000000d+00 7 2.2261948027d+01 1.0000000000d+00 1.0000000000d+00 8 1.1437986440d+01 1.0000000000d+00 1.0000000000d+00 9 5.8253686054d+00 1.0000000000d+00 1.0000000000d+00 10 2.8939935399d+00 1.0000000000d+00 1.0000000000d+00 11 1.3955338012d+00 1.0000000000d+00 1.0000000000d+00 12 6.1190842995d-01 1.0000000000d+00 1.0000000000d+00 D+ 1 3.1405026589d+03 1.0000000000d+00 1.0000000000d+00 2 9.3259703721d+02 1.0000000000d+00 1.0000000000d+00 3 3.5996303843d+02 1.0000000000d+00 1.0000000000d+00 4 1.5862606658d+02 1.0000000000d+00 1.0000000000d+00 5 7.5527869701d+01 1.0000000000d+00 1.0000000000d+00 6 3.7752395168d+01 1.0000000000d+00 1.0000000000d+00 7 1.9349695913d+01 1.0000000000d+00 1.0000000000d+00 8 1.0093220177d+01 1.0000000000d+00 1.0000000000d+00 9 5.2115511838d+00 1.0000000000d+00 1.0000000000d+00 10 2.6208728057d+00 1.0000000000d+00 1.0000000000d+00 11 1.2773531653d+00 1.0000000000d+00 1.0000000000d+00 12 5.6560048734d-01 1.0000000000d+00 1.0000000000d+00 SPINOR ENERGIES AND VECTORS 1S+ 2S+ 3S+ 4S+ 5S+ 6S+ -1.3838335d+03 -2.2257706d+02 -4.8651364d+01 -1.0257044d+01 -1.6033689d+00 -1.6307105d-01 ------------ ------------ ------------ ------------ ------------ ------------ *** Large Component *** 1 6.1567627d-05 -2.1656329d-05 9.8039485d-06 4.5628903d-06 -1.7970683d-06 5.0093809d-07 2 1.6355552d-04 -5.7711526d-05 2.6140714d-05 1.2169395d-05 -4.7916954d-06 1.3354634d-06 3 4.0895535d-04 -1.4485521d-04 6.5640981d-05 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1.3676289d-02 -3.9036397d-03 15 -3.4874132d-04 5.0988932d-01 -4.2032336d-01 -2.2520466d-01 9.0276533d-02 -2.5079268d-02 16 1.7490268d-03 4.6191095d-01 -5.1360597d-01 -2.9239766d-01 1.2297135d-01 -3.4918831d-02 17 -1.1581121d-03 1.0037093d-01 2.1455048d-01 1.4786043d-01 -6.9316755d-02 2.0598675d-02 18 7.6417479d-04 -5.7523279d-03 8.0626824d-01 8.9200414d-01 -4.1538268d-01 1.1699250d-01 19 -4.3627428d-04 3.5672983d-03 3.1990344d-01 3.3264801d-01 -1.7308530d-01 5.3275466d-02 20 2.1675057d-04 -1.6354310d-03 2.0995933d-02 -8.7696854d-01 6.2949629d-01 -1.9694882d-01 21 -8.5467085d-05 5.1014101d-04 9.7957399d-04 -6.0737078d-01 6.3106765d-01 -2.0054071d-01 22 2.6996923d-05 -1.5558216d-04 -9.4659144d-05 -3.3233704d-02 -7.6992514d-01 3.0939999d-01 23 -1.1731989d-05 7.1065022d-05 -4.4237050d-05 5.0436945d-03 -6.2618681d-01 4.4919776d-01 24 3.0159648d-06 -1.7682687d-05 2.4543027d-07 -1.1171658d-03 -1.8174540d-02 -7.2341031d-01 25 -1.3925873d-06 8.1687372d-06 -2.8347626d-07 4.9706738d-04 5.5166620d-03 -4.8451453d-01 *** Small Component *** 26 1.1040829d-04 -3.8748162d-05 1.7533622d-05 8.1580422d-06 -3.2140852d-06 8.9615118d-07 27 3.7284118d-04 -1.3087515d-04 5.9241685d-05 2.7580254d-05 -1.0855548d-05 3.0247431d-06 28 8.3977599d-04 -2.9486491d-04 1.3342801d-04 6.2074916d-05 -2.4461034d-05 6.8211523d-06 29 1.7994691d-03 -6.3229004d-04 2.8627743d-04 1.3330177d-04 -5.2455091d-05 1.4613450d-05 30 3.5805721d-03 -1.2596774d-03 5.7013658d-04 2.6522511d-04 -1.0453955d-04 2.9156393d-05 31 6.8209848d-03 -2.4066497d-03 1.0904257d-03 5.0789549d-04 -1.9981316d-04 5.5656016d-05 32 1.2350721d-02 -4.3833248d-03 1.9863916d-03 9.2415743d-04 -3.6439755d-04 1.0165429d-04 33 2.1246363d-02 -7.6389758d-03 3.4716977d-03 1.6184506d-03 -6.3655993d-04 1.7726352d-04 34 3.4176055d-02 -1.2622172d-02 5.7546108d-03 2.6800985d-03 -1.0576185d-03 2.9515451d-04 35 4.9722584d-02 -1.9419542d-02 8.9432168d-03 4.1828469d-03 -1.6450097d-03 4.5790372d-04 36 6.1142959d-02 -2.6652153d-02 1.2472885d-02 5.8388440d-03 -2.3096600d-03 6.4518758d-04 37 5.5665961d-02 -2.9735937d-02 1.4442267d-02 6.8423816d-03 -2.6916332d-03 7.4836256d-04 38 2.9322728d-02 -1.9653033d-02 9.9976587d-03 4.7503226d-03 -1.9017749d-03 5.3435470d-04 39 5.4620885d-03 8.0120430d-03 -5.3127499d-03 -2.6307986d-03 1.0902045d-03 -3.1137218d-04 40 -2.2329994d-05 3.0087739d-02 -2.4682957d-02 -1.3213484d-02 5.2956950d-03 -1.4710960d-03 41 7.6597364d-05 1.9552992d-02 -2.1669248d-02 -1.2331925d-02 5.1856986d-03 -1.4724788d-03 42 -3.5372403d-05 2.9599020d-03 6.2624581d-03 4.3068368d-03 -2.0190307d-03 6.0012528d-04 43 1.7328984d-05 -1.2613732d-04 1.7481262d-02 1.9321026d-02 -8.9959963d-03 2.5336821d-03 44 -7.1964746d-06 5.6818481d-05 5.0368449d-03 5.2375110d-03 -2.7255574d-03 8.3886581d-04 45 2.5141374d-06 -1.8308059d-05 2.3206475d-04 -9.6630636d-03 6.9348915d-03 -2.1696354d-03 46 -7.0794223d-07 4.0863324d-06 7.4614705d-06 -4.7439423d-03 4.9281827d-03 -1.5660828d-03 47 1.3205913d-07 -7.3570154d-07 -3.6918652d-07 -1.5084506d-04 -3.4947161d-03 1.4043313d-03 48 -3.9377627d-08 2.2979422d-07 -1.6187415d-07 1.5426520d-05 -1.9170268d-03 1.3751493d-03 49 4.7579579d-09 -2.6784392d-08 7.1423518d-09 -1.4997622d-06 -2.4466200d-05 -9.7390956d-04 50 -1.5391002d-09 8.6236745d-09 -3.5876281d-09 4.3534915d-07 4.8545719d-06 -4.2646182d-04 2P- 3P- 4P- 5P- -2.0908731d+02 -4.2956190d+01 -8.0988076d+00 -9.5620317d-01 ------------ ------------ ------------ ------------ *** Large Component *** 1 8.7543337d-05 -4.1455410d-05 -1.8841716d-05 -6.8041810d-06 2 2.7585818d-04 -1.3068111d-04 -5.9390568d-05 -2.1443501d-05 3 7.7865314d-04 -3.6907503d-04 -1.6782448d-04 -6.0627278d-05 4 2.1509785d-03 -1.0226246d-03 -4.6484111d-04 -1.6774877d-04 5 6.3182248d-03 -3.0156357d-03 -1.3743854d-03 -4.9714801d-04 6 1.9768323d-02 -9.5491097d-03 -4.3506363d-03 -1.5691800d-03 7 6.0515325d-02 -2.9748809d-02 -1.3654412d-02 -4.9505398d-03 8 1.5992614d-01 -8.1920883d-02 -3.7745201d-02 -1.3629855d-02 9 3.1713115d-01 -1.7106032d-01 -8.0298755d-02 -2.9296134d-02 10 3.8642832d-01 -2.1477871d-01 -1.0006601d-01 -3.5978520d-02 11 2.1091896d-01 2.5011258d-02 3.0962586d-02 1.1901708d-02 12 3.1375315d-02 4.9296311d-01 3.4336024d-01 1.3683817d-01 13 1.7379190d-04 4.9218804d-01 3.4128290d-01 1.2801543d-01 14 3.4846644d-05 9.9505889d-02 -4.0729434d-01 -2.1334135d-01 15 -1.0546614d-04 -3.9203615d-03 -6.7520233d-01 -4.0859050d-01 16 5.3964793d-06 2.6647339d-03 -1.5661677d-01 1.1269832d-01 17 -3.3417983d-06 -1.0384210d-03 2.8829264d-03 7.1847331d-01 18 8.0838423d-07 2.7339407d-04 -1.5859892d-03 3.4531599d-01 *** Small Component *** 19 2.3046258d-05 -1.0916849d-05 -4.9669197d-06 -1.7958115d-06 20 8.6239531d-05 -4.0976639d-05 -1.8607679d-05 -6.7076805d-06 21 2.7662840d-04 -1.3138576d-04 -5.9862636d-05 -2.1668895d-05 22 8.4306350d-04 -4.0262192d-04 -1.8293259d-04 -6.5917190d-05 23 2.4082233d-03 -1.1518986d-03 -5.2569820d-04 -1.9038864d-04 24 6.2207255d-03 -3.0109734d-03 -1.3716640d-03 -4.9445318d-04 25 1.4015369d-02 -6.8946085d-03 -3.1657956d-03 -1.1481903d-03 26 2.5958862d-02 -1.3310825d-02 -6.1333284d-03 -2.2144572d-03 27 3.5675183d-02 -1.9274065d-02 -9.0508163d-03 -3.3026010d-03 28 3.0193271d-02 -1.6848282d-02 -7.8560318d-03 -2.8248577d-03 29 1.1375922d-02 1.4128500d-03 1.7100615d-03 6.5628350d-04 30 1.0159243d-03 1.8827863d-02 1.3097298d-02 5.2185961d-03 31 -1.0454914d-04 1.3192741d-02 9.1461436d-03 3.4312491d-03 32 -6.8015827d-05 1.8029868d-03 -7.3470193d-03 -3.8489192d-03 33 -3.4404252d-05 -4.7019140d-05 -8.3868006d-03 -5.0757730d-03 34 -2.5575221d-05 2.3234221d-05 -1.2821861d-03 9.2572665d-04 35 -7.4540856d-06 -5.2144900d-06 1.6605963d-05 3.8779049d-03 36 -1.1313352d-05 1.5229403d-06 -3.7840094d-06 1.1726949d-03 2P+ 3P+ 4P+ 5P+ -1.9500987d+02 -4.0166995d+01 -7.5129658d+00 -8.7249375d-01 ------------ ------------ ------------ ------------ *** Large Component *** 1 4.1600595d-05 -2.0033436d-05 -9.1258211d-06 3.2437646d-06 2 3.0462348d-04 -1.4696713d-04 -6.7058851d-05 2.3926735d-05 3 1.6385527d-03 -7.9321691d-04 -3.6167050d-04 1.2852588d-04 4 7.1433649d-03 -3.4779172d-03 -1.5900444d-03 5.6765660d-04 5 2.5956700d-02 -1.2804859d-02 -5.8609714d-03 2.0839739d-03 6 7.8112268d-02 -3.9527512d-02 -1.8220854d-02 6.5174325d-03 7 1.8596444d-01 -9.8225446d-02 -4.5598806d-02 1.6245512d-02 8 3.2250103d-01 -1.8047430d-01 -8.5204095d-02 3.0679585d-02 9 3.4621953d-01 -1.9157161d-01 -8.9254698d-02 3.1566525d-02 10 1.7986230d-01 4.3258606d-02 4.1479238d-02 -1.5646062d-02 11 3.0420187d-02 4.4340476d-01 3.0499445d-01 -1.1953316d-01 12 7.4929302d-04 4.7915871d-01 3.6280556d-01 -1.3771089d-01 13 2.9654790d-05 1.4781015d-01 -1.7873450d-01 9.5330977d-02 14 -1.2734425d-04 8.2140373d-03 -6.3983859d-01 3.5866329d-01 15 -1.2587512d-05 1.4343872d-03 -3.6524750d-01 1.9236531d-01 16 -2.5377681d-06 -3.9170296d-04 -3.9250803d-02 -4.3726459d-01 17 8.1160232d-07 1.4392941d-04 1.4952325d-03 -6.1112131d-01 18 -2.2538817d-07 -3.7267633d-05 -3.3366245d-04 -1.6550214d-01 *** Small Component *** 19 6.7039189d-05 -3.2177940d-05 -1.4642691d-05 5.1983864d-06 20 3.1690514d-04 -1.5219495d-04 -6.9393281d-05 2.4770318d-05 21 1.0999606d-03 -5.2982306d-04 -2.4129845d-04 8.5702686d-05 22 3.1540970d-03 -1.5277531d-03 -6.9777083d-04 2.4910688d-04 23 7.6930476d-03 -3.7762760d-03 -1.7266473d-03 6.1375322d-04 24 1.5860074d-02 -7.9885498d-03 -3.6790838d-03 1.3158206d-03 25 2.6344065d-02 -1.3857972d-02 -6.4280142d-03 2.2896819d-03 26 3.2361391d-02 -1.8047559d-02 -8.5150701d-03 3.0657238d-03 27 2.4927985d-02 -1.3762283d-02 -6.4111513d-03 2.2674300d-03 28 9.3426727d-03 2.2074642d-03 2.1245491d-03 -8.0124775d-04 29 1.1347179d-03 1.6453253d-02 1.1309279d-02 -4.4318091d-03 30 2.0155148d-05 1.2929417d-02 9.7848317d-03 -3.7140192d-03 31 6.4022162d-07 2.8694760d-03 -3.4638184d-03 1.8473185d-03 32 -1.8008173d-06 1.1395277d-04 -8.8614444d-03 4.9666627d-03 33 -1.0718486d-07 1.4041050d-05 -3.5864316d-03 1.8887488d-03 34 -2.3488964d-08 -2.5212961d-06 -2.5466050d-04 -2.8365123d-03 35 6.6568816d-09 6.1858284d-07 6.5205546d-06 -2.6657971d-03 36 -1.5323725d-09 -1.0164218d-07 -9.3400339d-07 -4.6366725d-04 3D- 4D- -3.0297578d+01 -3.9133125d+00 ------------ ------------ *** Large Component *** 1 2.2638974d-04 -1.0056998d-04 2 1.7938942d-03 -7.9514898d-04 3 1.0335363d-02 -4.6290277d-03 4 4.3006341d-02 -1.9341962d-02 5 1.2963352d-01 -5.9617032d-02 6 2.7267761d-01 -1.2495473d-01 7 3.7795844d-01 -1.6615431d-01 8 2.9171023d-01 -5.6722678d-02 9 9.4250284d-02 2.6144007d-01 10 7.5956809d-03 4.8270671d-01 11 2.5098413d-04 3.3810367d-01 12 -1.1328220d-04 7.5823454d-02 *** Small Component *** 13 8.4392401d-05 -3.7572436d-05 14 5.0788103d-04 -2.2502896d-04 15 1.9856336d-03 -8.8952266d-04 16 5.6219667d-03 -2.5283537d-03 17 1.1726116d-02 -5.3932256d-03 18 1.7386660d-02 -7.9696092d-03 19 1.7156165d-02 -7.5453578d-03 20 9.5016996d-03 -1.8508578d-03 21 2.1859130d-03 6.0869731d-03 22 1.1961048d-04 7.9248673d-03 23 1.0461327d-06 3.8551201d-03 24 -2.1174003d-06 5.7205141d-04 3D+ 4D+ -2.9711628d+01 -3.8123624d+00 ------------ ------------ *** Large Component *** 1 2.6296806d-04 -1.1680030d-04 2 2.4666114d-03 -1.0938229d-03 3 1.4036875d-02 -6.2870500d-03 4 5.4818066d-02 -2.4722551d-02 5 1.5308219d-01 -7.0560609d-02 6 2.9494445d-01 -1.3455178d-01 7 3.7357383d-01 -1.6038506d-01 8 2.5566764d-01 -1.7382235d-02 9 7.2602830d-02 2.9671042d-01 10 5.0388708d-03 4.7532979d-01 11 1.5980784d-04 3.0662395d-01 12 -8.6854778d-05 6.3889768d-02 *** Small Component *** 13 1.2768630d-04 -5.6676559d-05 14 6.9317638d-04 -3.0709523d-04 15 2.5122951d-03 -1.1244070d-03 16 6.5919126d-03 -2.9707804d-03 17 1.2781907d-02 -5.8881221d-03 18 1.7463181d-02 -7.9627606d-03 19 1.5857125d-02 -6.8059507d-03 20 7.8443513d-03 -5.3611422d-04 21 1.6008161d-03 6.5366462d-03 22 7.8893542d-05 7.4281745d-03 23 1.7051940d-06 3.3456090d-03 24 -6.1967642d-07 4.6387133d-04 * Radial Moments Sym Orb S+ 1 8.12144d+03 6.06976d+01 2.55747d-02 8.88170d-04 3.90236d-05 2.07827d-06 2 9.74527d+02 1.42727d+01 1.09165d-01 1.41213d-02 2.08066d-03 3.45406d-04 3 2.01456d+02 5.14608d+00 2.90290d-01 9.64232d-02 3.52986d-02 1.41215d-02 4 4.44529d+01 2.08819d+00 6.73519d-01 5.11152d-01 4.23306d-01 3.79904d-01 5 7.11888d+00 7.88790d-01 1.65670d+00 3.07990d+00 6.28368d+00 1.40084d+01 6 5.88216d-01 2.43352d-01 5.08307d+00 2.92908d+01 1.88457d+02 1.34519d+03 P- 1 3.10575d+02 1.42151d+01 9.20303d-02 1.04336d-02 1.40704d-03 2.20398d-04 2 6.43357d+01 5.04715d+00 2.80675d-01 9.15354d-02 3.32562d-02 1.33350d-02 3 1.38083d+01 1.98113d+00 6.97556d-01 5.52612d-01 4.81060d-01 4.57012d-01 4 1.99079d+00 6.93901d-01 1.86950d+00 3.95477d+00 9.27280d+00 2.39715d+01 P+ 1 2.29580d+02 1.29820d+01 9.79810d-02 1.16972d-02 1.65197d-03 2.70127d-04 2 4.81986d+01 4.74458d+00 2.92268d-01 9.90580d-02 3.73700d-02 1.55454d-02 3 1.04979d+01 1.88883d+00 7.22872d-01 5.93290d-01 5.35108d-01 5.26764d-01 4 1.51039d+00 6.61090d-01 1.95043d+00 4.30976d+00 1.05830d+01 2.87744d+01 D- 1 2.64517d+01 4.59204d+00 2.63571d-01 8.19902d-02 2.95366d-02 1.21413d-02 2 5.00918d+00 1.65840d+00 7.95002d-01 7.32673d-01 7.59553d-01 8.80142d-01 D+ 1 2.53805d+01 4.51445d+00 2.67239d-01 8.41468d-02 3.06540d-02 1.27344d-02 2 4.80453d+00 1.63387d+00 8.04851d-01 7.50750d-01 7.87788d-01 9.24141d-01