Selenium (II, 3p frozen) BASIS 1S 20.00 2S 13.90 3S 6.85 2P 14.75 3P 6.85 3D 3.75 3D 8.05 4S 1.80 4S 3.00 4P 1.30 4P 2.50 END CORE 3 2 0 0 1S 31.5500 1S 38.9000 2S 13.6000 2S 7.5000 3S 8.5000 3S 5.4000 4S 1.5000 4S 2.2000 4S 3.4000 2P 18.7000 2P 12.6000 3P 7.5500 3P 4.7500 4P 1.8000 4P 1.1000 4P 3.0000 END DESCRIPTION .47621839545565691765E+00 .51390733569556334981E+00 .14102592381224429707E+00 -.36373612394090493183E+00 .29086188665408013732E+00 -.32440472560848823691E-01 .41111121215606817592E-02 -.10947001967567711322E-01 .15348067332375493407E-01 -.49711759519625003945E+00 .93628958163318079522E-01 .10755615463537115950E+01 .11759555620259402875E+00 -.12675673744316465208E+00 .34971235012339403625E-01 -.53307200386087357294E-02 .13843056878828549280E-01 -.18484157654147778671E-01 .22456792983553050536E+00 -.57412050011810995820E-01 -.25907075531704853999E+00 -.11045068501117989435E+01 .14635459326533388769E+01 .55901738211713802862E+00 .51486059601485523532E-02 -.11746435376783211785E-01 .12942937786432406888E-01 .40655956262393450062E+00 .61115917352927318085E+00 .15674754457493278448E-01 -.12260240647804798025E-01 -.42890634496405783196E-02 .16087444294545017506E-02 .66431333805485170280E-02 -.14294140960023393738E+00 -.30633827662472984388E+00 .67649441190379877575E+00 .47262634973882949874E+00 .42559272865090166590E-02 -.14913261547999205614E-02 -.61843485601132596949E-02 0/ END FIT 1S 41.45 2S 44.86 3S 43.49 3S 30.61 4S 28.51 4S 20.92 5S 19.13 5S 14.46 5S 10.93 6S 9.90 6S 7.65 6S 5.92 7S 5.34 7S 4.20 7S 3.30 7S 2.60 2P 37.05 3P 25.58 4P 17.80 5P 12.55 6P 8.98 6P 5.53 7P 4.00 7P 2.55 3D 31.20 4D 21.41 5D 14.91 6D 10.54 6D 6.42 7D 4.60 7D 2.90 4F 22.80 5F 11.86 6F 6.42 7F 3.60 5G 18.45 6G 7.94 7G 3.60 END FITCOEFFICIENTS .351949994055438E+02 -.783145829155942E+03 .119330238113821E+04 .941611609581497E+05 .658097366888374E+02 -.741316355288361E+05 .117586316363008E+06 .142552208769077E+05 .218850651737757E+02 .318979130679092E+03 .102382525491370E+02 .120481831139503E+02 .416583377297368E+00 .235179137922573E-01 .349579393658197E-03 / END