25 Mn J=5/2 E=-1.15717692D+03 n 1 2 2 3 3 3 3 4 4 4 4 1s c 0.972801 -0.062024 0.045828 0.079513 0.033882 -0.019707 0.010584 -0.048232 -0.005387 0.005113 -0.002376 z 25.721834 21.853820 10.752333 31.614345 7.953731 5.480189 3.682092 12.629898 2.170771 1.389108 0.921606 2s c -0.30068 -0.15147 0.98560 -0.01200 0.09349 -0.00417 0.01691 0.09222 0.00305 0.00046 -0.00015 z 25.69680 21.86170 10.75741 31.61164 7.95321 5.47925 3.68083 12.62560 2.17010 1.38840 0.92040 n 2 2 2 2 3 3 3 2p c 0.00355 0.33284 0.43577 0.01281 0.27250 -0.00666 0.01684 z 39.77308 15.49870 8.27037 3.91474 12.65394 3.22450 2.10598 n 1 2 2 3 3 3 3 4 4 4 4 3s c 0.11457 0.07602 -0.45254 0.00166 -0.10186 0.62574 0.58193 -0.10071 0.00722 0.00314 0.00296 z 25.69981 21.85688 10.75271 31.60950 7.95409 5.48455 3.69000 12.62843 2.17014 1.38844 0.92040 n 2 2 2 2 3 3 3 3p c 0.00123 0.07818 0.50133 -0.80341 0.02583 -0.41608 -0.04652 z 39.76373 15.57734 8.27419 3.90998 12.58938 3.23628 2.10327 n 1 2 2 3 3 3 3 4 4 4 4 4s c 0.02585 0.01633 -0.10220 0.00027 -0.02845 0.17914 0.13383 -0.02811 -0.28175 -0.53321 -0.31099 z 25.69980 21.85671 10.75236 31.60950 7.95344 5.47860 3.68359 12.62734 2.17537 1.39314 0.92648 n 3 3 3 3 3 3d c 0.01835 0.21244 0.41553 0.38543 0.12575 z 12.11109 6.22747 3.76544 2.27636 1.42527 ------------------------------------------------------------------------------------------ 25 Mn2+ 1s n 1 2 2 3 3 3 3 4 4 4 4 c 0.96499900 -0.10197500 0.10147900 0.09871600 0.01028000 -0.04335900 0.02039300 -0.01076500 0.00068400 0.00354900 -0.00405700 z 25.71276900 21.85023600 10.75162700 31.63124600 7.95458400 5.48072900 3.68205000 12.62875500 2.17080200 1.38915400 0.92160700 2s n 1 2 2 3 3 3 3 4 4 4 4 c -0.32691400 -0.14268100 0.96238300 -0.01719500 0.09707300 0.01230500 0.04491100 0.08749800 0.00112200 -0.00333400 -0.00176300 z 25.68717300 21.87329300 10.76570500 31.61759600 7.95265000 5.47912000 3.68043700 12.62098900 2.17015500 1.38840000 0.92040100 3s n 1 2 2 3 3 3 3 4 4 4 4 c 0.13777100 0.07469400 -0.48746600 0.00673100 -0.09823000 0.61648500 0.58845100 -0.10951300 0.00427200 -0.00150200 0.00146200 z 25.69942400 21.85757800 10.75264100 31.60979600 7.95404300 5.48644900 3.68162600 12.63041600 2.17028200 1.38847800 0.92040100 2p n 2 2 2 2 3 3 3 c 0.00362500 0.32689500 0.45344600 0.01034100 0.25226900 0.04207500 -0.01294400 z 39.78367200 15.44541200 8.27273500 3.91386300 12.68486000 3.22442900 2.10737900 3p n 2 2 2 2 3 3 3 c -0.00137200 -0.08851600 -0.50495300 0.79658800 -0.03749000 0.42677400 0.03699500 z 39.76373900 15.57706000 8.27526200 3.90726500 12.58952200 3.23103200 2.10535900 3d n 3 3 3 3 3 c 0.01869800 0.21716800 0.41271000 0.42854800 0.06544600 z 12.11297600 6.21317800 3.77532900 2.25388800 1.45616400 ------------------------------------------------------------------------------------------------------ 25 Mn3+ 1s n 1 2 2 3 3 3 3 4 4 4 4 c 0.96632200 -0.10569200 0.10580500 0.09954700 -0.01910000 -0.04524700 0.04017100 0.00545900 -0.00671700 -0.00165000 -0.00552000 z 25.68980500 21.84358800 10.75094500 31.65930000 7.95454700 5.48158900 3.68180300 12.62854600 2.17077900 1.38915300 0.92162000 2s n 1 2 2 3 3 3 3 4 4 4 4 c -0.32677600 -0.14275700 0.96202000 -0.01710000 0.09643800 0.01334900 0.04498100 0.08779600 -0.00042500 -0.00403400 -0.00199600 z 25.68772200 21.87261700 10.76526800 31.61729400 7.95263400 5.47910700 3.68048200 12.62128400 2.17016800 1.38840000 0.92040000 3s n 1 2 2 3 3 3 3 4 4 4 4 c 0.13905600 0.07547700 -0.49235500 0.00678100 -0.10527100 0.63685200 0.58016700 -0.10952800 -0.01461700 0.00829900 0.00900200 z 25.69921000 21.85793300 10.75249900 31.60987000 7.95460000 5.47887100 3.70446500 12.62936600 2.17045900 1.38839900 0.92038600 2p n 2 2 2 2 3 3 3 c 0.00359800 0.32829900 0.43887900 0.02201300 0.26109400 0.02746500 -0.00343900 z 39.77889900 15.46940500 8.27265300 3.91414000 12.67175000 3.22457600 2.10669200 3p n 2 2 2 2 3 3 3 c -0.00135300 -0.08894500 -0.52113200 0.82419000 -0.03487600 0.42667300 0.00768900 z 39.76375100 15.57736100 8.27125800 3.89566000 12.58905400 3.25329900 2.10509900 3d n 3 3 3 3 3 c 0.01975300 0.23434900 0.45490800 0.40952200 -0.00203200 z 12.11210600 6.22347100 3.74795700 2.30859400 1.46068300 ------------------------------------------------------------------------------------------------------- 25 Mn4+ 1s n 1 2 2 3 3 3 3 4 4 4 4 c 0.96600700 -0.10509400 0.10521900 0.09946900 -0.01320800 -0.04530400 0.03674100 0.00218900 -0.00409800 -0.00055600 -0.00552400 z 25.69506800 21.84513900 10.75110600 31.65279600 7.95458600 5.48138200 3.68186900 12.62844600 2.17079400 1.38915500 0.92161300 2s n 1 2 2 3 3 3 3 4 4 4 4 c -0.32661100 -0.14264400 0.96174800 -0.01717800 0.09590600 0.01519500 0.04373100 0.08769900 -0.00022300 -0.00332800 -0.00165700 z 25.69032600 21.86951100 10.76339000 31.61587500 7.95257400 5.47911500 3.68058000 12.62241800 2.17014200 1.38840000 0.92040100 3s n 1 2 2 3 3 3 3 4 4 4 4 c 0.14077100 0.07620400 -0.49870000 0.00710100 -0.11598300 0.66845700 0.56284700 -0.10944700 -0.03269600 0.01961200 0.01476000 z 25.69884600 21.85864700 10.75231200 31.60988100 7.95569700 5.47039900 3.73674500 12.62645300 2.17240600 1.38842700 0.92050400 2p n 2 2 2 2 3 3 3 c 0.00361400 0.32731400 0.44406300 0.01807000 0.25815200 0.03430000 -0.00928000 z 39.78054400 15.46389700 8.27319500 3.91398200 12.67327000 3.22453300 2.10666700 3p n 2 2 2 2 3 3 3 c 0.00129800 0.08919000 0.54442600 -0.86491000 0.03044800 -0.40927700 0.01444800 z 39.76378100 15.57669500 8.26307600 3.87947300 12.58856900 3.29804700 2.10911300 3d n 3 3 3 3 3 c 0.02122000 0.24983500 0.51641200 0.33811200 -0.03087500 z 12.10811200 6.23767000 3.72544300 2.36728900 1.44112300