1 84646848480 1 3 1000.0000 7 0 0 s 2 p 5 p 0 f 0 h 0 k 0 s 0 d 0 na iii s2p5 e= -35225.45815 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 3p e= -34803.70737 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 4p e= -34719.48403 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 5p e= -34686.59600 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 6p e= -34670.18204 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 7p e= -34660.79802 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 8p e= -34654.92911 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 9p e= -34651.01433 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 10p e= -34648.27212 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 11p e= -34646.27692 s 2 p 4 p 1 f 0 h 0 k 0 s 0 d 0 na iii s2p4 12p e= -34644.78114 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 4f e= -34699.36707 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 5f e= -34677.01021 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 6f e= -34664.85849 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 7f e= -34657.53430 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 8f e= -34652.78369 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 9f e= -34649.52845 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 10f e= -34647.20142 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 11f e= -34645.47969 s 2 p 4 p 0 f 1 h 0 k 0 s 0 d 0 na iii s2p4 12f e= -34644.17080 s 2 p 4 p 0 f 0 h 1 k 0 s 0 d 0 na iii s2p4 6h e= -34664.73069 s 2 p 4 p 0 f 0 h 1 k 0 s 0 d 0 na iii s2p4 7h e= -34657.45233 s 2 p 4 p 0 f 0 h 1 k 0 s 0 d 0 na iii s2p4 8h e= -34652.72814 s 2 p 4 p 0 f 0 h 1 k 0 s 0 d 0 na iii s2p4 9h e= -34649.48925 s 2 p 4 p 0 f 0 h 0 k 1 s 0 d 0 na iii s2p4 8k e= -34652.72700 s 2 p 4 p 0 f 0 h 0 k 1 s 0 d 0 na iii s2p4 9k e= -34649.48828 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 3s e= -34579.63849 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 4s e= -34467.48089 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 5s e= -34426.80670 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 6s e= -34407.37386 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 7s e= -34396.57902 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 8s e= -34389.96378 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 9s e= -34385.61753 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 10s e= -34382.60878 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 11s e= -34380.44099 s 1 p 5 p 0 f 0 h 0 k 0 s 1 d 0 na iii sp5 12s e= -34378.82756 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 3d e= -34486.91091 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 4d e= -34435.38381 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 5d e= -34411.88027 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 6d e= -34399.22837 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 7d e= -34391.64933 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 8d e= -34386.75513 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 9d e= -34383.41273 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 10d e= -34381.02990 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 11d e= -34379.27060 s 1 p 5 p 0 f 0 h 0 k 0 s 0 d 1 na iii sp5 12d e= -34377.93567 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 3s e= -34848.25758 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 4s e= -34734.45139 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 5s e= -34693.40142 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 6s e= -34673.83640 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 7s e= -34662.98324 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 8s e= -34656.33820 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 9s e= -34651.97517 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 10s e= -34648.95627 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 11s e= -34646.78192 s 2 p 4 s 1 d 0 g 0 i 0 p 0 f 0 na iii s2p4 12s e= -34645.16410 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 3d e= -34752.90188 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 4d e= -34701.56567 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 5d e= -34678.13116 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 6d e= -34665.51003 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 7d e= -34657.94652 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 8d e= -34653.06097 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 9d e= -34649.72382 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 10d e= -34647.34429 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 11d e= -34645.58721 s 2 p 4 s 0 d 1 g 0 i 0 p 0 f 0 na iii s2p4 12d e= -34644.25379 s 2 p 4 s 0 d 0 g 1 i 0 p 0 f 0 na iii s2p4 5g e= -34676.82459 s 2 p 4 s 0 d 0 g 1 i 0 p 0 f 0 na iii s2p4 6g e= -34664.75045 s 2 p 4 s 0 d 0 g 1 i 0 p 0 f 0 na iii s2p4 7g e= -34657.46664 s 2 p 4 s 0 d 0 g 1 i 0 p 0 f 0 na iii s2p4 8g e= -34652.73858 s 2 p 4 s 0 d 0 g 1 i 0 p 0 f 0 na iii s2p4 9g e= -34649.49699 s 2 p 4 s 0 d 0 g 0 i 1 p 0 f 0 na iii s2p4 7i e= -34657.45104 s 2 p 4 s 0 d 0 g 0 i 1 p 0 f 0 na iii s2p4 8i e= -34652.72686 s 2 p 4 s 0 d 0 g 0 i 1 p 0 f 0 na iii s2p4 9i e= -34649.48832 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 0 na iii sp6 e= -34939.81759 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 3p e= -34538.09416 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 4p e= -34453.37344 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 5p e= -34420.36468 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 6p e= -34403.90685 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 7p e= -34394.50301 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 8p e= -34388.62395 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 9p e= -34384.70330 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 10p e= -34381.95761 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 11p e= -34379.96009 s 1 p 5 s 0 d 0 g 0 i 0 p 1 f 0 na iii sp5 12p e= -34378.46272 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 4f e= -34433.06561 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 5f e= -34410.69936 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 6f e= -34398.54265 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 7f e= -34391.21575 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 8f e= -34386.46374 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 9f e= -34383.20753 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 10f e= -34380.87989 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 11f e= -34379.15772 s 1 p 5 s 0 d 0 g 0 i 0 p 0 f 1 na iii sp5 12f e= -34377.84856 na iii s2p5 2 0.00E 942.88z na iii s2p4 3p 7 421750.78E 135434.19F 1052.84z 103.15z 17356.20f 9220.94g 7799.25g na iii s2p4 4p 7 505974.13E 136038.98F 1059.74z 36.78z 5620.10f 2925.22g 2594.57g na iii s2p4 5p 7 538862.16E 136210.25F 1061.72z 17.09z 2507.74f 1299.52g 1174.74g na iii s2p4 6p 7 555276.12E 136276.54F 1062.50z 9.29z 1333.97f 690.14g 629.90g na iii s2p4 7p 7 564660.13E 136307.50F 1062.86z 5.59z 793.78f 410.33g 376.60g na iii s2p4 8p 7 570529.04E 136323.88F 1063.05z 3.63z 510.59f 263.81g 242.98g na iii s2p4 9p 7 574443.82E 136333.35F 1063.16z 2.48z 347.81f 179.65g 165.85g na iii s2p4 10p 7 577186.03E 136339.20F 1063.23z 1.77z 247.59f 127.85g 118.23g na iii s2p4 11p 7 579181.23E 136343.02F 1063.28z 1.31z 182.50f 94.22g 87.24g na iii s2p4 12p 7 580677.02E 136345.61F 1063.31z 1.00z 138.39f 71.44g 66.20g na iii s2p4 4f 7 526091.08E 136346.70F 1063.37z 0.20z 1293.09f 47.44g 30.45g na iii s2p4 5f 7 548447.94E 136348.18F 1063.38z 0.10z 669.81f 38.89g 25.01g na iii s2p4 6f 7 560599.67E 136349.90F 1063.39z 0.06z 390.93f 27.63g 17.79g na iii s2p4 7f 7 567923.85E 136351.09F 1063.39z 0.04z 247.71f 19.49g 12.55g na iii s2p4 8f 7 572674.46E 136351.87F 1063.40z 0.03z 166.73f 14.01g 9.03g na iii s2p4 9f 7 575929.70E 136352.38F 1063.40z 0.02z 117.53f 10.32g 6.65g na iii s2p4 10f 7 578256.73E 136352.73F 1063.40z 0.01z 85.94f 7.79g 5.02g na iii s2p4 11f 7 579978.47E 136352.98F 1063.40z 0.01z 64.73f 6.00g 3.87g na iii s2p4 12f 7 581287.35E 136353.15F 1063.40z 0.01z 49.96f 4.71g 3.04g na iii s2p4 6h 7 560727.46E 136353.78F 1063.41z 0.02z 96.53f 0.00g 0.00g na iii s2p4 7h 7 568005.82E 136353.78F 1063.41z 0.01z 60.79f 0.00g 0.00g na iii s2p4 8h 7 572730.02E 136353.78F 1063.41z 0.01z 40.72f 0.00g 0.00g na iii s2p4 9h 7 575968.90E 136353.78F 1063.41z 0.01z 28.60f 0.00g 0.00g na iii s2p4 8k 7 572731.16E 136353.78F 1063.41z 0.01z 16.00f 0.00g 0.00g na iii s2p4 9k 7 575969.87E 136353.78F 1063.41z 0.00z 11.24f 0.00g 0.00g na iii sp5 3s 5 645819.66E 1028.50z 167574.61g 7895.74g 8870.54g na iii sp5 4s 5 757977.27E 1035.78z 168138.62g 2213.82g 2549.94g na iii sp5 5s 5 798651.45E 1037.62z 168279.09g 925.19g 1076.97g na iii sp5 6s 5 818084.29E 1038.29z 168329.60g 474.24g 554.96g na iii sp5 7s 5 828879.13E 1038.59z 168352.14g 275.49g 323.36g na iii sp5 8s 5 835494.37E 1038.75z 168363.71g 174.22g 204.88g na iii sp5 9s 5 839840.62E 1038.83z 168370.26g 117.18g 137.97g na iii sp5 10s 5 842849.37E 1038.89z 168374.24g 82.59g 97.33g na iii sp5 11s 5 845017.16E 1038.92z 168376.80g 60.40g 71.22g na iii sp5 12s 5 846630.59E 1038.94z 168378.52g 45.50g 53.68g na iii sp5 3d 8 738547.24E 1036.84z 1.62z 10360.92f 168095.81g 4041.24g 5384.00g 3031.73g na iii sp5 4d 8 790074.35E 1037.87z 0.80z 4420.12f 168239.14g 2212.81g 2859.81g 1626.81g na iii sp5 5d 8 813577.89E 1038.40z 0.42z 2218.01f 168307.99g 1209.21g 1543.69g 882.23g na iii sp5 6d 8 826229.78E 1038.66z 0.24z 1257.49f 168340.06g 713.68g 905.42g 518.76g na iii sp5 7d 8 833808.83E 1038.79z 0.16z 778.78f 168356.46g 452.00g 571.36g 327.86g na iii sp5 8d 8 838703.03E 1038.87z 0.10z 514.93f 168365.63g 303.02g 382.16g 219.51g na iii sp5 9d 8 842045.42E 1038.91z 0.07z 357.92f 168371.13g 212.57g 267.67g 153.85g na iii sp5 10d 8 844428.26E 1038.94z 0.05z 258.76f 168374.62g 154.67g 194.54g 111.87g na iii sp5 11d 8 846187.55E 1038.96z 0.04z 193.09f 168376.93g 115.95g 145.73g 83.83g na iii sp5 12d 8 847522.49E 1038.97z 0.03z 147.89f 168378.53g 89.12g 111.93g 64.41g na iii s2p5 - s2p4 3p 2 5261.66 22521.64 na iii s2p5 - s2p4 4p 2 2864.13 12118.68 na iii s2p5 - s2p4 5p 2 1880.84 7920.23 na iii s2p5 - s2p4 6p 2 1360.03 5713.16 na iii s2p5 - s2p4 7p 2 1043.90 4378.99 na iii s2p5 - s2p4 8p 2 834.59 3497.85 na iii s2p5 - s2p4 9p 2 687.35 2879.04 na iii s2p5 - s2p4 10p 2 579.04 2424.36 na iii s2p5 - s2p4 11p 2 496.58 2078.45 na iii s2p5 - s2p4 12p 2 432.05 1807.94 na iii s2p5 - s2p4 4f 1 1365.23 na iii s2p5 - s2p4 5f 1 1259.74 na iii s2p5 - s2p4 6f 1 1072.35 na iii s2p5 - s2p4 7f 1 905.80 na iii s2p5 - s2p4 8f 1 770.94 na iii s2p5 - s2p4 9f 1 663.39 na iii s2p5 - s2p4 10f 1 577.21 na iii s2p5 - s2p4 11f 1 507.41 na iii s2p5 - s2p4 12f 1 450.17 na iii s2p5 - sp5 3s 3 9070.32 23387.43 4048.83 na iii s2p5 - sp5 4s 3 4636.25 11952.90 2074.62 na iii s2p5 - sp5 5s 3 2954.03 7620.96 1323.29 na iii s2p5 - sp5 6s 3 2099.50 5419.15 941.07 na iii s2p5 - sp5 7s 3 1593.49 4114.47 714.52 na iii s2p5 - sp5 8s 3 1263.87 3264.18 566.86 na iii s2p5 - sp5 9s 3 1034.70 2672.77 464.15 na iii s2p5 - sp5 10s 3 867.61 2241.43 389.24 na iii s2p5 - sp5 11s 3 741.27 1915.23 332.59 na iii s2p5 - sp5 12s 3 642.97 1661.38 288.50 na iii s2p5 - sp5 3d 2 -26238.55 -17918.59 na iii s2p5 - sp5 4d 2 -19493.44 -13566.66 na iii s2p5 - sp5 5d 2 -14431.81 -10125.87 na iii s2p5 - sp5 6d 2 -11094.89 -7817.71 na iii s2p5 - sp5 7d 2 -8832.88 -6239.49 na iii s2p5 - sp5 8d 2 -7233.81 -5118.15 na iii s2p5 - sp5 9d 2 -6059.55 -4292.04 na iii s2p5 - sp5 10d 2 -5169.30 -3664.33 na iii s2p5 - sp5 11d 2 -4476.16 -3174.84 na iii s2p5 - sp5 12d 2 -3924.37 -2784.70 na iii s2p4 3p - s2p4 4p 4 0.00 8514.44 5181.78 4477.79 na iii s2p4 3p - s2p4 5p 4 0.00 5461.92 3446.53 3000.56 na iii s2p4 3p - s2p4 6p 4 0.00 3910.64 2508.41 2191.61 na iii s2p4 3p - s2p4 7p 4 0.00 2985.86 1932.61 1691.90 na iii s2p4 3p - s2p4 8p 4 0.00 2379.53 1548.80 1357.57 na iii s2p4 3p - s2p4 9p 4 0.00 1955.56 1277.61 1120.78 na iii s2p4 3p - s2p4 10p 4 0.00 1644.94 1077.52 945.79 na iii s2p4 3p - s2p4 11p 4 0.00 1409.09 924.84 812.11 na iii s2p4 3p - s2p4 12p 4 0.00 1224.92 805.16 707.24 na iii s2p4 3p - s2p4 4f 2 -2393.14 -97.68 na iii s2p4 3p - s2p4 5f 2 -1931.39 -83.68 na iii s2p4 3p - s2p4 6f 2 -1535.14 -68.36 na iii s2p4 3p - s2p4 7f 2 -1245.30 -56.29 na iii s2p4 3p - s2p4 8f 2 -1032.58 -47.11 na iii s2p4 3p - s2p4 9f 2 -872.75 -40.06 na iii s2p4 3p - s2p4 10f 2 -749.64 -34.56 na iii s2p4 3p - s2p4 11f 2 -652.66 -30.19 na iii s2p4 3p - s2p4 12f 2 -574.76 -26.65 na iii s2p4 3p - sp5 3s 2 36024.25 8294.42 na iii s2p4 3p - sp5 4s 2 11186.91 4384.98 na iii s2p4 3p - sp5 5s 2 6641.58 2829.48 na iii s2p4 3p - sp5 6s 2 4587.60 2023.51 na iii s2p4 3p - sp5 7s 2 3430.89 1541.22 na iii s2p4 3p - sp5 8s 2 2697.36 1225.10 na iii s2p4 3p - sp5 9s 2 2195.57 1004.42 na iii s2p4 3p - sp5 10s 2 1833.61 843.07 na iii s2p4 3p - sp5 11s 2 1561.97 720.83 na iii s2p4 3p - sp5 12s 2 1351.80 625.59 na iii s2p4 3p - sp5 3d 2 20382.04 -799.80 na iii s2p4 3p - sp5 4d 2 8413.91 -743.06 na iii s2p4 3p - sp5 5d 2 4758.45 -600.55 na iii s2p4 3p - sp5 6d 2 3143.44 -482.45 na iii s2p4 3p - sp5 7d 2 2276.67 -393.95 na iii s2p4 3p - sp5 8d 2 1750.32 -327.84 na iii s2p4 3p - sp5 9d 2 1402.46 -277.61 na iii s2p4 3p - sp5 10d 2 1158.14 -238.64 na iii s2p4 3p - sp5 11d 2 978.50 -207.81 na iii s2p4 3p - sp5 12d 2 841.67 -182.97 na iii s2p4 4p - s2p4 5p 4 0.00 3542.58 1949.05 1744.69 na iii s2p4 4p - s2p4 6p 4 0.00 2531.70 1419.76 1276.52 na iii s2p4 4p - s2p4 7p 4 0.00 1932.31 1094.40 986.43 na iii s2p4 4p - s2p4 8p 4 0.00 1539.88 877.32 791.99 na iii s2p4 4p - s2p4 9p 4 0.00 1265.59 723.86 654.12 na iii s2p4 4p - s2p4 10p 4 0.00 1064.66 610.58 552.15 na iii s2p4 4p - s2p4 11p 4 0.00 912.10 524.11 474.21 na iii s2p4 4p - s2p4 12p 4 0.00 792.97 456.33 413.04 na iii s2p4 4p - s2p4 4f 2 -88.86 -71.21 na iii s2p4 4p - s2p4 5f 2 -425.47 -62.43 na iii s2p4 4p - s2p4 6f 2 -435.98 -51.68 na iii s2p4 4p - s2p4 7f 2 -393.00 -42.92 na iii s2p4 4p - s2p4 8f 2 -344.93 -36.12 na iii s2p4 4p - s2p4 9f 2 -301.92 -30.84 na iii s2p4 4p - s2p4 10f 2 -265.48 -26.68 na iii s2p4 4p - s2p4 11f 2 -235.00 -23.36 na iii s2p4 4p - s2p4 12f 2 -209.51 -20.65 na iii s2p4 4p - sp5 3s 2 15480.43 4652.97 na iii s2p4 4p - sp5 4s 2 12355.60 2471.79 na iii s2p4 4p - sp5 5s 2 5338.51 1597.71 na iii s2p4 4p - sp5 6s 2 3550.10 1143.53 na iii s2p4 4p - sp5 7s 2 2614.37 871.37 na iii s2p4 4p - sp5 8s 2 2038.98 692.83 na iii s2p4 4p - sp5 9s 2 1651.77 568.13 na iii s2p4 4p - sp5 10s 2 1375.22 476.93 na iii s2p4 4p - sp5 11s 2 1169.03 407.81 na iii s2p4 4p - sp5 12s 2 1010.21 353.95 na iii s2p4 4p - sp5 3d 2 4985.10 -234.12 na iii s2p4 4p - sp5 4d 2 7664.48 -254.70 na iii s2p4 4p - sp5 5d 2 4427.04 -216.23 na iii s2p4 4p - sp5 6d 2 3004.90 -177.68 na iii s2p4 4p - sp5 7d 2 2221.16 -146.90 na iii s2p4 4p - sp5 8d 2 1733.53 -123.19 na iii s2p4 4p - sp5 9d 2 1404.81 -104.85 na iii s2p4 4p - sp5 10d 2 1170.21 -90.45 na iii s2p4 4p - sp5 11d 2 995.50 -78.97 na iii s2p4 4p - sp5 12d 2 861.02 -69.67 na iii s2p4 5p - s2p4 6p 4 0.00 1777.06 946.94 860.08 na iii s2p4 5p - s2p4 7p 4 0.00 1354.99 730.07 664.87 na iii s2p4 5p - s2p4 8p 4 0.00 1079.56 585.33 533.94 na iii s2p4 5p - s2p4 9p 4 0.00 887.24 482.98 441.06 na iii s2p4 5p - s2p4 10p 4 0.00 746.39 407.42 372.35 na iii s2p4 5p - s2p4 11p 4 0.00 639.46 349.74 319.81 na iii s2p4 5p - s2p4 12p 4 0.00 555.96 304.52 278.58 na iii s2p4 5p - s2p4 4f 2 -141.23 -51.34 na iii s2p4 5p - s2p4 5f 2 -92.65 -45.29 na iii s2p4 5p - s2p4 6f 2 -151.93 -37.62 na iii s2p4 5p - s2p4 7f 2 -157.08 -31.31 na iii s2p4 5p - s2p4 8f 2 -147.11 -26.39 na iii s2p4 5p - s2p4 9f 2 -133.66 -22.55 na iii s2p4 5p - s2p4 10f 2 -120.37 -19.52 na iii s2p4 5p - s2p4 11f 2 -108.33 -17.10 na iii s2p4 5p - s2p4 12f 2 -97.73 -15.13 na iii s2p4 5p - sp5 3s 2 9527.76 3092.44 na iii s2p4 5p - sp5 4s 2 6980.46 1645.91 na iii s2p4 5p - sp5 5s 2 5590.29 1064.60 na iii s2p4 5p - sp5 6s 2 2899.54 762.21 na iii s2p4 5p - sp5 7s 2 2072.94 580.91 na iii s2p4 5p - sp5 8s 2 1596.80 461.93 na iii s2p4 5p - sp5 9s 2 1285.02 378.82 na iii s2p4 5p - sp5 10s 2 1065.55 318.02 na iii s2p4 5p - sp5 11s 2 903.38 271.95 na iii s2p4 5p - sp5 12s 2 779.19 236.04 na iii s2p4 5p - sp5 3d 2 2963.19 -100.96 na iii s2p4 5p - sp5 4d 2 2843.30 -127.79 na iii s2p4 5p - sp5 5d 2 3639.13 -112.77 na iii s2p4 5p - sp5 6d 2 2430.15 -94.22 na iii s2p4 5p - sp5 7d 2 1797.62 -78.60 na iii s2p4 5p - sp5 8d 2 1405.81 -66.27 na iii s2p4 5p - sp5 9d 2 1141.40 -56.60 na iii s2p4 5p - sp5 10d 2 952.32 -48.95 na iii s2p4 5p - sp5 11d 2 811.22 -42.81 na iii s2p4 5p - sp5 12d 2 702.40 -37.82 na iii s2p4 6p - s2p4 7p 4 0.00 1012.26 532.13 487.03 na iii s2p4 6p - s2p4 8p 4 0.00 806.00 426.66 391.16 na iii s2p4 6p - s2p4 9p 4 0.00 662.30 352.07 323.15 na iii s2p4 6p - s2p4 10p 4 0.00 557.14 297.00 272.82 na iii s2p4 6p - s2p4 11p 4 0.00 477.32 254.96 234.33 na iii s2p4 6p - s2p4 12p 4 0.00 415.00 221.99 204.13 na iii s2p4 6p - s2p4 4f 2 -103.48 -38.79 na iii s2p4 6p - s2p4 5f 2 -98.35 -34.31 na iii s2p4 6p - s2p4 6f 2 -68.87 -28.54 na iii s2p4 6p - s2p4 7f 2 -78.62 -23.77 na iii s2p4 6p - s2p4 8f 2 -77.53 -20.05 na iii s2p4 6p - s2p4 9f 2 -72.58 -17.14 na iii s2p4 6p - s2p4 10f 2 -66.62 -14.84 na iii s2p4 6p - s2p4 11f 2 -60.74 -13.00 na iii s2p4 6p - s2p4 12f 2 -55.32 -11.51 na iii s2p4 6p - sp5 3s 2 6689.68 2249.79 na iii s2p4 6p - sp5 4s 2 4811.13 1198.54 na iii s2p4 6p - sp5 5s 2 3620.87 775.50 na iii s2p4 6p - sp5 6s 2 2981.73 555.32 na iii s2p4 6p - sp5 7s 2 1737.76 423.27 na iii s2p4 6p - sp5 8s 2 1306.46 336.60 na iii s2p4 6p - sp5 9s 2 1040.53 276.04 na iii s2p4 6p - sp5 10s 2 857.96 231.75 na iii s2p4 6p - sp5 11s 2 724.84 198.17 na iii s2p4 6p - sp5 12s 2 623.73 172.01 na iii s2p4 6p - sp5 3d 2 2045.91 -53.66 na iii s2p4 6p - sp5 4d 2 1897.04 -77.93 na iii s2p4 6p - sp5 5d 2 1673.39 -70.82 na iii s2p4 6p - sp5 6d 2 1997.21 -59.89 na iii s2p4 6p - sp5 7d 2 1449.79 -50.27 na iii s2p4 6p - sp5 8d 2 1130.89 -42.55 na iii s2p4 6p - sp5 9d 2 917.77 -36.43 na iii s2p4 6p - sp5 10d 2 765.78 -31.56 na iii s2p4 6p - sp5 11d 2 652.45 -27.63 na iii s2p4 6p - sp5 12d 2 565.07 -24.43 na iii s2p4 7p - s2p4 8p 4 0.00 630.14 329.01 302.49 na iii s2p4 7p - s2p4 9p 4 0.00 517.58 271.50 249.91 na iii s2p4 7p - s2p4 10p 4 0.00 435.34 229.03 210.99 na iii s2p4 7p - s2p4 11p 4 0.00 372.96 196.61 181.23 na iii s2p4 7p - s2p4 12p 4 0.00 324.26 171.19 157.87 na iii s2p4 7p - s2p4 4f 2 -78.94 -30.51 na iii s2p4 7p - s2p4 5f 2 -76.77 -27.02 na iii s2p4 7p - s2p4 6f 2 -65.87 -22.50 na iii s2p4 7p - s2p4 7f 2 -49.04 -18.75 na iii s2p4 7p - s2p4 8f 2 -48.61 -15.81 na iii s2p4 7p - s2p4 9f 2 -46.09 -13.52 na iii s2p4 7p - s2p4 10f 2 -42.74 -11.72 na iii s2p4 7p - s2p4 11f 2 -39.26 -10.26 na iii s2p4 7p - s2p4 12f 2 -35.97 -9.08 na iii s2p4 7p - sp5 3s 2 5051.91 1732.93 na iii s2p4 7p - sp5 4s 2 3605.95 923.70 na iii s2p4 7p - sp5 5s 2 2675.98 597.78 na iii s2p4 7p - sp5 6s 2 2098.99 428.10 na iii s2p4 7p - sp5 7s 2 1772.31 326.31 na iii s2p4 7p - sp5 8s 2 1120.14 259.50 na iii s2p4 7p - sp5 9s 2 873.95 212.82 na iii s2p4 7p - sp5 10s 2 714.22 178.67 na iii s2p4 7p - sp5 11s 2 600.45 152.79 na iii s2p4 7p - sp5 12s 2 515.10 132.62 na iii s2p4 7p - sp5 3d 2 1530.73 -32.60 na iii s2p4 7p - sp5 4d 2 1398.86 -53.38 na iii s2p4 7p - sp5 5d 2 1199.45 -49.59 na iii s2p4 7p - sp5 6d 2 1051.36 -42.30 na iii s2p4 7p - sp5 7d 2 1209.49 -35.67 na iii s2p4 7p - sp5 8d 2 927.32 -30.27 na iii s2p4 7p - sp5 9d 2 750.34 -25.96 na iii s2p4 7p - sp5 10d 2 625.49 -22.52 na iii s2p4 7p - sp5 11d 2 532.73 -19.73 na iii s2p4 7p - sp5 12d 2 461.33 -17.46 na iii s2p4 8p - s2p4 9p 4 0.00 418.55 217.70 200.74 na iii s2p4 8p - s2p4 10p 4 0.00 351.94 183.65 169.49 na iii s2p4 8p - s2p4 11p 4 0.00 301.49 157.66 145.58 na iii s2p4 8p - s2p4 12p 4 0.00 262.11 137.28 126.82 na iii s2p4 8p - s2p4 4f 2 -62.63 -24.76 na iii s2p4 8p - s2p4 5f 2 -61.38 -21.95 na iii s2p4 8p - s2p4 6f 2 -53.53 -18.28 na iii s2p4 8p - s2p4 7f 2 -45.19 -15.24 na iii s2p4 8p - s2p4 8f 2 -35.24 -12.86 na iii s2p4 8p - s2p4 9f 2 -32.95 -11.00 na iii s2p4 8p - s2p4 10f 2 -30.54 -9.53 na iii s2p4 8p - s2p4 11f 2 -28.10 -8.35 na iii s2p4 8p - s2p4 12f 2 -25.79 -7.39 na iii s2p4 8p - sp5 3s 2 3998.49 1388.56 na iii s2p4 8p - sp5 4s 2 2843.07 740.38 na iii s2p4 8p - sp5 5s 2 2097.19 479.21 na iii s2p4 8p - sp5 6s 2 1626.76 343.20 na iii s2p4 8p - sp5 7s 2 1319.87 261.61 na iii s2p4 8p - sp5 8s 2 1137.26 208.05 na iii s2p4 8p - sp5 9s 2 763.03 170.63 na iii s2p4 8p - sp5 10s 2 612.54 143.25 na iii s2p4 8p - sp5 11s 2 510.97 122.50 na iii s2p4 8p - sp5 12s 2 436.44 106.33 na iii s2p4 8p - sp5 3d 2 1204.49 -21.73 na iii s2p4 8p - sp5 4d 2 1092.54 -39.43 na iii s2p4 8p - sp5 5d 2 925.01 -37.24 na iii s2p4 8p - sp5 6d 2 791.92 -31.97 na iii s2p4 8p - sp5 7d 2 699.48 -27.04 na iii s2p4 8p - sp5 8d 2 786.35 -22.99 na iii s2p4 8p - sp5 9d 2 626.68 -19.74 na iii s2p4 8p - sp5 10d 2 520.97 -17.14 na iii s2p4 8p - sp5 11d 2 443.28 -15.03 na iii s2p4 8p - sp5 12d 2 383.70 -13.30 na iii s2p4 9p - s2p4 10p 4 0.00 292.06 151.55 140.03 na iii s2p4 9p - s2p4 11p 4 0.00 250.13 130.10 120.28 na iii s2p4 9p - s2p4 12p 4 0.00 217.45 113.28 104.78 na iii s2p4 9p - s2p4 4f 2 -51.24 -20.60 na iii s2p4 9p - s2p4 5f 2 -50.39 -18.27 na iii s2p4 9p - s2p4 6f 2 -44.20 -15.22 na iii s2p4 9p - s2p4 7f 2 -37.77 -12.69 na iii s2p4 9p - s2p4 8f 2 -32.02 -10.71 na iii s2p4 9p - s2p4 9f 2 -25.85 -9.16 na iii s2p4 9p - s2p4 10f 2 -23.61 -7.94 na iii s2p4 9p - s2p4 11f 2 -21.63 -6.95 na iii s2p4 9p - s2p4 12f 2 -19.82 -6.15 na iii s2p4 9p - sp5 3s 2 3270.95 1145.31 na iii s2p4 9p - sp5 4s 2 2320.61 610.82 na iii s2p4 9p - sp5 5s 2 1706.28 395.38 na iii s2p4 9p - sp5 6s 2 1317.11 283.18 na iii s2p4 9p - sp5 7s 2 1058.88 215.86 na iii s2p4 9p - sp5 8s 2 882.09 171.67 na iii s2p4 9p - sp5 9s 2 772.52 140.79 na iii s2p4 9p - sp5 10s 2 542.66 118.20 na iii s2p4 9p - sp5 11s 2 445.60 101.08 na iii s2p4 9p - sp5 12s 2 377.98 87.74 na iii s2p4 9p - sp5 3d 2 981.38 -15.50 na iii s2p4 9p - sp5 4d 2 886.33 -30.67 na iii s2p4 9p - sp5 5d 2 745.30 -29.33 na iii s2p4 9p - sp5 6d 2 631.22 -25.30 na iii s2p4 9p - sp5 7d 2 546.50 -21.46 na iii s2p4 9p - sp5 8d 2 487.51 -18.27 na iii s2p4 9p - sp5 9d 2 539.36 -15.70 na iii s2p4 9p - sp5 10d 2 442.43 -13.64 na iii s2p4 9p - sp5 11d 2 375.54 -11.96 na iii s2p4 9p - sp5 12d 2 324.77 -10.59 na iii s2p4 10p - s2p4 11p 4 0.00 211.83 109.76 101.56 na iii s2p4 10p - s2p4 12p 4 0.00 184.12 95.57 88.47 na iii s2p4 10p - s2p4 4f 2 -42.92 -17.47 na iii s2p4 10p - s2p4 5f 2 -42.30 -15.50 na iii s2p4 10p - s2p4 6f 2 -37.21 -12.92 na iii s2p4 10p - s2p4 7f 2 -31.94 -10.77 na iii s2p4 10p - s2p4 8f 2 -27.32 -9.09 na iii s2p4 10p - s2p4 9f 2 -23.39 -7.78 na iii s2p4 10p - s2p4 10f 2 -19.40 -6.74 na iii s2p4 10p - s2p4 11f 2 -17.56 -5.90 na iii s2p4 10p - s2p4 12f 2 -16.02 -5.23 na iii s2p4 10p - sp5 3s 2 2742.40 965.86 na iii s2p4 10p - sp5 4s 2 1942.96 515.20 na iii s2p4 10p - sp5 5s 2 1425.82 333.50 na iii s2p4 10p - sp5 6s 2 1097.68 238.87 na iii s2p4 10p - sp5 7s 2 878.90 182.09 na iii s2p4 10p - sp5 8s 2 726.50 144.81 na iii s2p4 10p - sp5 9s 2 617.92 118.77 na iii s2p4 10p - sp5 10s 2 548.37 99.71 na iii s2p4 10p - sp5 11s 2 399.49 85.27 na iii s2p4 10p - sp5 12s 2 334.12 74.01 na iii s2p4 10p - sp5 3d 2 820.39 -11.63 na iii s2p4 10p - sp5 4d 2 738.93 -24.77 na iii s2p4 10p - sp5 5d 2 618.78 -23.92 na iii s2p4 10p - sp5 6d 2 520.93 -20.70 na iii s2p4 10p - sp5 7d 2 446.84 -17.59 na iii s2p4 10p - sp5 8d 2 391.78 -14.99 na iii s2p4 10p - sp5 9d 2 352.81 -12.89 na iii s2p4 10p - sp5 10d 2 385.73 -11.20 na iii s2p4 10p - sp5 11d 2 323.57 -9.83 na iii s2p4 10p - sp5 12d 2 279.23 -8.71 na iii s2p4 11p - s2p4 12p 4 0.00 158.51 82.04 75.99 na iii s2p4 11p - s2p4 4f 2 -36.64 -15.06 na iii s2p4 11p - s2p4 5f 2 -36.15 -13.37 na iii s2p4 11p - s2p4 6f 2 -31.85 -11.14 na iii s2p4 11p - s2p4 7f 2 -27.40 -9.29 na iii s2p4 11p - s2p4 8f 2 -23.53 -7.84 na iii s2p4 11p - s2p4 9f 2 -20.28 -6.71 na iii s2p4 11p - s2p4 10f 2 -17.56 -5.81 na iii s2p4 11p - s2p4 11f 2 -14.87 -5.09 na iii s2p4 11p - s2p4 12f 2 -13.44 -4.51 na iii s2p4 11p - sp5 3s 2 2343.54 828.95 na iii s2p4 11p - sp5 4s 2 1658.89 442.22 na iii s2p4 11p - sp5 5s 2 1215.82 286.28 na iii s2p4 11p - sp5 6s 2 934.46 205.04 na iii s2p4 11p - sp5 7s 2 746.53 156.31 na iii s2p4 11p - sp5 8s 2 614.95 124.31 na iii s2p4 11p - sp5 9s 2 519.54 101.95 na iii s2p4 11p - sp5 10s 2 449.33 85.59 na iii s2p4 11p - sp5 11s 2 403.14 73.20 na iii s2p4 11p - sp5 12s 2 302.50 63.53 na iii s2p4 11p - sp5 3d 2 699.49 -9.07 na iii s2p4 11p - sp5 4d 2 628.91 -20.57 na iii s2p4 11p - sp5 5d 2 525.22 -20.01 na iii s2p4 11p - sp5 6d 2 440.52 -17.37 na iii s2p4 11p - sp5 7d 2 375.89 -14.78 na iii s2p4 11p - sp5 8d 2 326.90 -12.61 na iii s2p4 11p - sp5 9d 2 289.95 -10.85 na iii s2p4 11p - sp5 10d 2 263.33 -9.43 na iii s2p4 11p - sp5 11d 2 285.25 -8.28 na iii s2p4 11p - sp5 12d 2 243.59 -7.33 na iii s2p4 12p - s2p4 4f 2 -31.75 -13.15 na iii s2p4 12p - s2p4 5f 2 -31.35 -11.68 na iii s2p4 12p - s2p4 6f 2 -27.66 -9.73 na iii s2p4 12p - s2p4 7f 2 -23.83 -8.12 na iii s2p4 12p - s2p4 8f 2 -20.50 -6.85 na iii s2p4 12p - s2p4 9f 2 -17.72 -5.86 na iii s2p4 12p - s2p4 10f 2 -15.42 -5.08 na iii s2p4 12p - s2p4 11f 2 -13.49 -4.45 na iii s2p4 12p - s2p4 12f 2 -11.62 -3.94 na iii s2p4 12p - sp5 3s 2 2033.49 721.66 na iii s2p4 12p - sp5 4s 2 1438.56 385.02 na iii s2p4 12p - sp5 5s 2 1053.42 249.25 na iii s2p4 12p - sp5 6s 2 808.75 178.53 na iii s2p4 12p - sp5 7s 2 645.19 136.09 na iii s2p4 12p - sp5 8s 2 530.44 108.24 na iii s2p4 12p - sp5 9s 2 446.80 88.77 na iii s2p4 12p - sp5 10s 2 384.14 74.53 na iii s2p4 12p - sp5 11s 2 336.80 63.73 na iii s2p4 12p - sp5 12s 2 304.95 55.32 na iii s2p4 12p - sp5 3d 2 605.86 -7.31 na iii s2p4 12p - sp5 4d 2 544.06 -17.45 na iii s2p4 12p - sp5 5d 2 453.50 -17.08 na iii s2p4 12p - sp5 6d 2 379.42 -14.86 na iii s2p4 12p - sp5 7d 2 322.68 -12.66 na iii s2p4 12p - sp5 8d 2 279.33 -10.80 na iii s2p4 12p - sp5 9d 2 245.98 -9.30 na iii s2p4 12p - sp5 10d 2 220.39 -8.09 na iii s2p4 12p - sp5 11d 2 201.64 -7.10 na iii s2p4 12p - sp5 12d 2 216.81 -6.29 na iii s2p4 4f - s2p4 5f 4 0.00 756.52 42.93 27.58 na iii s2p4 4f - s2p4 6f 4 0.00 533.98 36.17 23.25 na iii s2p4 4f - s2p4 7f 4 0.00 407.33 30.37 19.52 na iii s2p4 4f - s2p4 8f 4 0.00 325.53 25.74 16.55 na iii s2p4 4f - s2p4 9f 4 0.00 268.58 22.09 14.20 na iii s2p4 4f - s2p4 10f 4 0.00 226.85 19.18 12.33 na iii s2p4 4f - s2p4 11f 4 0.00 195.10 16.84 10.83 na iii s2p4 4f - s2p4 12f 4 0.00 170.23 14.92 9.59 na iii s2p4 4f - s2p4 6h 2 151.91 0.21 na iii s2p4 4f - s2p4 7h 2 147.63 0.25 na iii s2p4 4f - s2p4 8h 2 131.69 0.24 na iii s2p4 4f - s2p4 9h 2 115.65 0.23 na iii s2p4 4f - sp5 3d 2 -8441.85 -401.45 na iii s2p4 4f - sp5 4d 2 532.34 -287.62 na iii s2p4 4f - sp5 5d 2 -55.13 -209.35 na iii s2p4 4f - sp5 6d 2 -65.42 -159.48 na iii s2p4 4f - sp5 7d 2 -54.37 -126.28 na iii s2p4 4f - sp5 8d 2 -44.07 -103.05 na iii s2p4 4f - sp5 9d 2 -36.13 -86.12 na iii s2p4 4f - sp5 10d 2 -30.12 -73.34 na iii s2p4 4f - sp5 11d 2 -25.51 -63.42 na iii s2p4 4f - sp5 12d 2 -21.92 -55.55 na iii s2p4 5f - s2p4 6f 4 0.00 470.62 32.78 21.09 na iii s2p4 5f - s2p4 7f 4 0.00 360.30 27.52 17.71 na iii s2p4 5f - s2p4 8f 4 0.00 288.71 23.33 15.02 na iii s2p4 5f - s2p4 9f 4 0.00 238.63 20.03 12.89 na iii s2p4 5f - s2p4 10f 4 0.00 201.82 17.39 11.20 na iii s2p4 5f - s2p4 11f 4 0.00 173.74 15.27 9.83 na iii s2p4 5f - s2p4 12f 4 0.00 151.70 13.53 8.71 na iii s2p4 5f - s2p4 6h 2 -36.12 0.19 na iii s2p4 5f - s2p4 7h 2 4.92 0.22 na iii s2p4 5f - s2p4 8h 2 19.71 0.22 na iii s2p4 5f - s2p4 9h 2 24.66 0.20 na iii s2p4 5f - sp5 3d 2 -6068.65 -367.26 na iii s2p4 5f - sp5 4d 2 -2103.55 -263.59 na iii s2p4 5f - sp5 5d 2 366.01 -192.01 na iii s2p4 5f - sp5 6d 2 -6.03 -146.33 na iii s2p4 5f - sp5 7d 2 -31.23 -115.89 na iii s2p4 5f - sp5 8d 2 -31.99 -94.59 na iii s2p4 5f - sp5 9d 2 -28.78 -79.05 na iii s2p4 5f - sp5 10d 2 -25.19 -67.33 na iii s2p4 5f - sp5 11d 2 -21.98 -58.23 na iii s2p4 5f - sp5 12d 2 -19.26 -51.00 na iii s2p4 6f - s2p4 7f 4 0.00 297.97 23.21 14.94 na iii s2p4 6f - s2p4 8f 4 0.00 239.11 19.68 12.67 na iii s2p4 6f - s2p4 9f 4 0.00 197.89 16.89 10.88 na iii s2p4 6f - s2p4 10f 4 0.00 167.52 14.67 9.45 na iii s2p4 6f - s2p4 11f 4 0.00 144.31 12.87 8.29 na iii s2p4 6f - s2p4 12f 4 0.00 126.08 11.41 7.35 na iii s2p4 6f - s2p4 6h 2 -0.12 0.16 na iii s2p4 6f - s2p4 7h 2 -16.29 0.18 na iii s2p4 6f - s2p4 8h 2 -6.95 0.18 na iii s2p4 6f - s2p4 9h 2 -0.95 0.17 na iii s2p4 6f - sp5 3d 2 -4592.92 -311.21 na iii s2p4 6f - sp5 4d 2 -1987.24 -223.57 na iii s2p4 6f - sp5 5d 2 -650.24 -162.92 na iii s2p4 6f - sp5 6d 2 239.42 -124.19 na iii s2p4 6f - sp5 7d 2 14.37 -98.36 na iii s2p4 6f - sp5 8d 2 -9.72 -80.29 na iii s2p4 6f - sp5 9d 2 -14.77 -67.11 na iii s2p4 6f - sp5 10d 2 -15.24 -57.16 na iii s2p4 6f - sp5 11d 2 -14.39 -49.43 na iii s2p4 6f - sp5 12d 2 -13.19 -43.30 na iii s2p4 7f - s2p4 8f 4 0.00 198.07 16.53 10.65 na iii s2p4 7f - s2p4 9f 4 0.00 164.02 14.18 9.14 na iii s2p4 7f - s2p4 10f 4 0.00 138.94 12.32 7.94 na iii s2p4 7f - s2p4 11f 4 0.00 119.75 10.81 6.97 na iii s2p4 7f - s2p4 12f 4 0.00 104.67 9.58 6.18 na iii s2p4 7f - s2p4 6h 2 0.38 0.13 na iii s2p4 7f - s2p4 7h 2 -0.12 0.15 na iii s2p4 7f - s2p4 8h 2 -7.61 0.15 na iii s2p4 7f - s2p4 9h 2 -5.43 0.14 na iii s2p4 7f - sp5 3d 2 -3629.67 -262.16 na iii s2p4 7f - sp5 4d 2 -1705.70 -188.43 na iii s2p4 7f - sp5 5d 2 -732.33 -137.35 na iii s2p4 7f - sp5 6d 2 -226.19 -104.71 na iii s2p4 7f - sp5 7d 2 160.42 -82.94 na iii s2p4 7f - sp5 8d 2 20.45 -67.71 na iii s2p4 7f - sp5 9d 2 1.02 -56.59 na iii s2p4 7f - sp5 10d 2 -4.81 -48.20 na iii s2p4 7f - sp5 11d 2 -6.69 -41.69 na iii s2p4 7f - sp5 12d 2 -7.15 -36.52 na iii s2p4 8f - s2p4 9f 4 0.00 137.69 12.03 7.75 na iii s2p4 8f - s2p4 10f 4 0.00 116.65 10.45 6.73 na iii s2p4 8f - s2p4 11f 4 0.00 100.58 9.17 5.91 na iii s2p4 8f - s2p4 12f 4 0.00 87.94 8.13 5.24 na iii s2p4 8f - s2p4 6h 2 0.52 0.11 na iii s2p4 8f - s2p4 7h 2 0.24 0.13 na iii s2p4 8f - s2p4 8h 2 -0.11 0.13 na iii s2p4 8f - s2p4 9h 2 -3.83 0.12 na iii s2p4 8f - sp5 3d 2 -2962.41 -222.73 na iii s2p4 8f - sp5 4d 2 -1452.59 -160.15 na iii s2p4 8f - sp5 5d 2 -687.37 -116.75 na iii s2p4 8f - sp5 6d 2 -301.25 -89.01 na iii s2p4 8f - sp5 7d 2 -80.67 -70.51 na iii s2p4 8f - sp5 8d 2 111.30 -57.56 na iii s2p4 8f - sp5 9d 2 20.82 -48.11 na iii s2p4 8f - sp5 10d 2 5.89 -40.98 na iii s2p4 8f - sp5 11d 2 0.53 -35.44 na iii s2p4 8f - sp5 12d 2 -1.73 -31.05 na iii s2p4 9f - s2p4 10f 4 0.00 99.37 8.97 5.78 na iii s2p4 9f - s2p4 11f 4 0.00 85.68 7.87 5.07 na iii s2p4 9f - s2p4 12f 4 0.00 74.92 6.98 4.50 na iii s2p4 9f - s2p4 6h 2 0.52 0.09 na iii s2p4 9f - s2p4 7h 2 0.39 0.11 na iii s2p4 9f - s2p4 8h 2 0.13 0.11 na iii s2p4 9f - s2p4 9h 2 -0.09 0.10 na iii s2p4 9f - sp5 3d 2 -2477.92 -191.42 na iii s2p4 9f - sp5 4d 2 -1246.43 -137.67 na iii s2p4 9f - sp5 5d 2 -619.76 -100.38 na iii s2p4 9f - sp5 6d 2 -305.33 -76.53 na iii s2p4 9f - sp5 7d 2 -133.12 -60.63 na iii s2p4 9f - sp5 8d 2 -25.32 -49.49 na iii s2p4 9f - sp5 9d 2 79.85 -41.37 na iii s2p4 9f - sp5 10d 2 19.15 -35.24 na iii s2p4 9f - sp5 11d 2 7.81 -30.48 na iii s2p4 9f - sp5 12d 2 3.24 -26.70 na iii s2p4 10f - s2p4 11f 4 0.00 73.98 6.84 4.41 na iii s2p4 10f - s2p4 12f 4 0.00 64.69 6.06 3.91 na iii s2p4 10f - s2p4 6h 2 0.48 0.08 na iii s2p4 10f - s2p4 7h 2 0.41 0.09 na iii s2p4 10f - s2p4 8h 2 0.25 0.09 na iii s2p4 10f - s2p4 9h 2 0.06 0.09 na iii s2p4 10f - sp5 3d 2 -2112.97 -166.41 na iii s2p4 10f - sp5 4d 2 -1080.88 -119.70 na iii s2p4 10f - sp5 5d 2 -553.62 -87.28 na iii s2p4 10f - sp5 6d 2 -289.10 -66.55 na iii s2p4 10f - sp5 7d 2 -145.79 -52.72 na iii s2p4 10f - sp5 8d 2 -60.74 -43.04 na iii s2p4 10f - sp5 9d 2 -3.09 -35.98 na iii s2p4 10f - sp5 10d 2 59.01 -30.64 na iii s2p4 10f - sp5 11d 2 16.92 -26.50 na iii s2p4 10f - sp5 12d 2 8.27 -23.22 na iii s2p4 11f - s2p4 12f 4 0.00 56.52 5.32 3.43 na iii s2p4 11f - s2p4 6h 2 0.43 0.07 na iii s2p4 11f - s2p4 7h 2 0.40 0.08 na iii s2p4 11f - s2p4 8h 2 0.28 0.08 na iii s2p4 11f - s2p4 9h 2 0.15 0.08 na iii s2p4 11f - sp5 3d 2 -1829.91 -146.19 na iii s2p4 11f - sp5 4d 2 -947.18 -105.17 na iii s2p4 11f - sp5 5d 2 -494.72 -76.69 na iii s2p4 11f - sp5 6d 2 -267.42 -58.48 na iii s2p4 11f - sp5 7d 2 -144.61 -46.33 na iii s2p4 11f - sp5 8d 2 -72.87 -37.82 na iii s2p4 11f - sp5 9d 2 -27.26 -31.61 na iii s2p4 11f - sp5 10d 2 5.85 -26.93 na iii s2p4 11f - sp5 11d 2 44.74 -23.29 na iii s2p4 11f - sp5 12d 2 14.70 -20.40 na iii s2p4 12f - s2p4 6h 2 0.39 0.06 na iii s2p4 12f - s2p4 7h 2 0.38 0.07 na iii s2p4 12f - s2p4 8h 2 0.29 0.07 na iii s2p4 12f - s2p4 9h 2 0.18 0.07 na iii s2p4 12f - sp5 3d 2 -1605.06 -129.63 na iii s2p4 12f - sp5 4d 2 -838.02 -93.27 na iii s2p4 12f - sp5 5d 2 -443.76 -68.01 na iii s2p4 12f - sp5 6d 2 -245.37 -51.86 na iii s2p4 12f - sp5 7d 2 -138.21 -41.09 na iii s2p4 12f - sp5 8d 2 -75.93 -33.54 na iii s2p4 12f - sp5 9d 2 -37.14 -28.04 na iii s2p4 12f - sp5 10d 2 -11.00 -23.88 na iii s2p4 12f - sp5 11d 2 9.15 -20.66 na iii s2p4 12f - sp5 12d 2 34.67 -18.09 na iii s2p4 6h - s2p4 7h 4 0.00 55.03 0.00 0.00 na iii s2p4 6h - s2p4 8h 4 0.00 38.71 0.00 0.00 na iii s2p4 6h - s2p4 9h 4 0.00 29.63 0.00 0.00 na iii s2p4 6h - s2p4 8k 2 21.87 0.00 na iii s2p4 6h - s2p4 9k 2 21.77 0.00 na iii s2p4 7h - s2p4 8h 4 0.00 42.48 0.00 0.00 na iii s2p4 7h - s2p4 9h 4 0.00 32.70 0.00 0.00 na iii s2p4 7h - s2p4 8k 2 -4.77 0.00 na iii s2p4 7h - s2p4 9k 2 3.48 0.00 na iii s2p4 8h - s2p4 9h 4 0.00 31.14 0.00 0.00 na iii s2p4 8h - s2p4 8k 2 0.00 0.00 na iii s2p4 8h - s2p4 9k 2 -2.85 0.00 na iii s2p4 9h - s2p4 8k 2 0.06 0.00 na iii s2p4 9h - s2p4 9k 2 0.00 0.00 na iii s2p4 8k - s2p4 9k 4 0.00 8.71 0.00 0.00 na iii sp5 3s - sp5 4s 4 0.00 4170.36 0.00 4731.62 na iii sp5 3s - sp5 5s 4 0.00 2690.17 0.00 3062.97 na iii sp5 3s - sp5 6s 4 0.00 1923.60 0.00 2193.91 na iii sp5 3s - sp5 7s 4 0.00 1465.00 0.00 1672.48 na iii sp5 3s - sp5 8s 4 0.00 1164.45 0.00 1330.16 na iii sp5 3s - sp5 9s 4 0.00 954.65 0.00 1090.94 na iii sp5 3s - sp5 10s 4 0.00 801.28 0.00 915.92 na iii sp5 3s - sp5 11s 4 0.00 685.09 0.00 783.26 na iii sp5 3s - sp5 12s 4 0.00 594.56 0.00 679.86 na iii sp5 3s - sp5 3d 2 8029.93 -1227.23 na iii sp5 3s - sp5 4d 2 4106.21 -1111.88 na iii sp5 3s - sp5 5d 2 2522.84 -889.63 na iii sp5 3s - sp5 6d 2 1742.30 -710.96 na iii sp5 3s - sp5 7d 2 1296.83 -578.76 na iii sp5 3s - sp5 8d 2 1015.34 -480.69 na iii sp5 3s - sp5 9d 2 824.08 -406.49 na iii sp5 3s - sp5 10d 2 686.99 -349.10 na iii sp5 3s - sp5 11d 2 584.63 -303.78 na iii sp5 3s - sp5 12d 2 505.72 -267.33 na iii sp5 4s - sp5 5s 4 0.00 1430.68 0.00 1656.24 na iii sp5 4s - sp5 6s 4 0.00 1023.89 0.00 1188.15 na iii sp5 4s - sp5 7s 4 0.00 780.16 0.00 906.53 na iii sp5 4s - sp5 8s 4 0.00 620.29 0.00 721.36 na iii sp5 4s - sp5 9s 4 0.00 508.64 0.00 591.83 na iii sp5 4s - sp5 10s 4 0.00 426.98 0.00 497.00 na iii sp5 4s - sp5 11s 4 0.00 365.10 0.00 425.09 na iii sp5 4s - sp5 12s 4 0.00 316.88 0.00 369.02 na iii sp5 4s - sp5 3d 2 2297.23 -519.62 na iii sp5 4s - sp5 4d 2 2347.54 -483.96 na iii sp5 4s - sp5 5d 2 1612.67 -391.35 na iii sp5 4s - sp5 6d 2 1174.60 -314.41 na iii sp5 4s - sp5 7d 2 902.12 -256.72 na iii sp5 4s - sp5 8d 2 720.91 -213.63 na iii sp5 4s - sp5 9d 2 593.50 -180.88 na iii sp5 4s - sp5 10d 2 499.92 -155.49 na iii sp5 4s - sp5 11d 2 428.78 -135.39 na iii sp5 4s - sp5 12d 2 373.18 -119.20 na iii sp5 5s - sp5 6s 4 0.00 662.34 0.00 773.00 na iii sp5 5s - sp5 7s 4 0.00 504.76 0.00 589.95 na iii sp5 5s - sp5 8s 4 0.00 401.37 0.00 469.53 na iii sp5 5s - sp5 9s 4 0.00 329.15 0.00 385.26 na iii sp5 5s - sp5 10s 4 0.00 276.32 0.00 323.56 na iii sp5 5s - sp5 11s 4 0.00 236.28 0.00 276.76 na iii sp5 5s - sp5 12s 4 0.00 205.08 0.00 240.26 na iii sp5 5s - sp5 3d 2 1360.53 -306.50 na iii sp5 5s - sp5 4d 2 1125.59 -289.28 na iii sp5 5s - sp5 5d 2 994.90 -235.05 na iii sp5 5s - sp5 6d 2 757.83 -189.28 na iii sp5 5s - sp5 7d 2 594.07 -154.76 na iii sp5 5s - sp5 8d 2 480.33 -128.89 na iii sp5 5s - sp5 9d 2 398.41 -109.20 na iii sp5 5s - sp5 10d 2 337.34 -93.90 na iii sp5 5s - sp5 11d 2 290.42 -81.79 na iii sp5 5s - sp5 12d 2 253.47 -72.03 na iii sp5 6s - sp5 7s 4 0.00 361.44 0.00 423.60 na iii sp5 6s - sp5 8s 4 0.00 287.42 0.00 337.16 na iii sp5 6s - sp5 9s 4 0.00 235.71 0.00 276.67 na iii sp5 6s - sp5 10s 4 0.00 197.88 0.00 232.36 na iii sp5 6s - sp5 11s 4 0.00 169.21 0.00 198.76 na iii sp5 6s - sp5 12s 4 0.00 146.87 0.00 172.55 na iii sp5 6s - sp5 3d 2 936.88 -209.45 na iii sp5 6s - sp5 4d 2 764.24 -199.12 na iii sp5 6s - sp5 5d 2 601.90 -162.21 na iii sp5 6s - sp5 6d 2 515.93 -130.79 na iii sp5 6s - sp5 7d 2 413.96 -107.01 na iii sp5 6s - sp5 8d 2 338.41 -89.16 na iii sp5 6s - sp5 9d 2 282.51 -75.56 na iii sp5 6s - sp5 10d 2 240.21 -64.99 na iii sp5 6s - sp5 11d 2 207.40 -56.61 na iii sp5 6s - sp5 12d 2 181.40 -49.86 na iii sp5 7s - sp5 8s 4 0.00 219.08 0.00 257.39 na iii sp5 7s - sp5 9s 4 0.00 179.67 0.00 211.21 na iii sp5 7s - sp5 10s 4 0.00 150.83 0.00 177.39 na iii sp5 7s - sp5 11s 4 0.00 128.98 0.00 151.74 na iii sp5 7s - sp5 12s 4 0.00 111.95 0.00 131.74 na iii sp5 7s - sp5 3d 2 699.35 -155.42 na iii sp5 7s - sp5 4d 2 567.18 -148.39 na iii sp5 7s - sp5 5d 2 442.71 -121.06 na iii sp5 7s - sp5 6d 2 354.18 -97.68 na iii sp5 7s - sp5 7d 2 302.95 -79.96 na iii sp5 7s - sp5 8d 2 251.03 -66.64 na iii sp5 7s - sp5 9d 2 210.96 -56.48 na iii sp5 7s - sp5 10d 2 180.08 -48.58 na iii sp5 7s - sp5 11d 2 155.90 -42.33 na iii sp5 7s - sp5 12d 2 136.61 -37.28 na iii sp5 8s - sp5 9s 4 0.00 142.88 0.00 168.13 na iii sp5 8s - sp5 10s 4 0.00 119.95 0.00 141.21 na iii sp5 8s - sp5 11s 4 0.00 102.58 0.00 120.79 na iii sp5 8s - sp5 12s 4 0.00 89.03 0.00 104.87 na iii sp5 8s - sp5 3d 2 549.16 -121.54 na iii sp5 8s - sp5 4d 2 444.10 -116.36 na iii sp5 8s - sp5 5d 2 345.25 -95.02 na iii sp5 8s - sp5 6d 2 274.60 -76.71 na iii sp5 8s - sp5 7d 2 224.72 -62.80 na iii sp5 8s - sp5 8d 2 193.47 -52.35 na iii sp5 8s - sp5 9d 2 163.96 -44.38 na iii sp5 8s - sp5 10d 2 140.56 -38.17 na iii sp5 8s - sp5 11d 2 122.01 -33.26 na iii sp5 8s - sp5 12d 2 107.10 -29.30 na iii sp5 9s - sp5 10s 4 0.00 98.38 0.00 115.88 na iii sp5 9s - sp5 11s 4 0.00 84.12 0.00 99.13 na iii sp5 9s - sp5 12s 4 0.00 73.02 0.00 86.06 na iii sp5 9s - sp5 3d 2 446.63 -98.56 na iii sp5 9s - sp5 4d 2 360.60 -94.54 na iii sp5 9s - sp5 5d 2 279.74 -77.25 na iii sp5 9s - sp5 6d 2 221.88 -62.38 na iii sp5 9s - sp5 7d 2 180.86 -51.08 na iii sp5 9s - sp5 8d 2 151.11 -42.58 na iii sp5 9s - sp5 9d 2 131.25 -36.10 na iii sp5 9s - sp5 10d 2 113.15 -31.06 na iii sp5 9s - sp5 11d 2 98.50 -27.06 na iii sp5 9s - sp5 12d 2 86.62 -23.84 na iii sp5 10s - sp5 11s 4 0.00 70.63 0.00 83.26 na iii sp5 10s - sp5 12s 4 0.00 61.30 0.00 72.28 na iii sp5 10s - sp5 3d 2 372.77 -82.10 na iii sp5 10s - sp5 4d 2 300.68 -78.85 na iii sp5 10s - sp5 5d 2 232.95 -64.46 na iii sp5 10s - sp5 6d 2 184.49 -52.07 na iii sp5 10s - sp5 7d 2 150.08 -42.64 na iii sp5 10s - sp5 8d 2 125.05 -35.55 na iii sp5 10s - sp5 9d 2 106.34 -30.14 na iii sp5 10s - sp5 10d 2 93.22 -25.93 na iii sp5 10s - sp5 11d 2 81.46 -22.59 na iii sp5 10s - sp5 12d 2 71.78 -19.90 na iii sp5 11s - sp5 12s 4 0.00 52.42 0.00 61.83 na iii sp5 11s - sp5 3d 2 317.40 -69.81 na iii sp5 11s - sp5 4d 2 255.86 -67.11 na iii sp5 11s - sp5 5d 2 198.06 -54.88 na iii sp5 11s - sp5 6d 2 156.70 -44.33 na iii sp5 11s - sp5 7d 2 127.34 -36.31 na iii sp5 11s - sp5 8d 2 105.95 -30.28 na iii sp5 11s - sp5 9d 2 89.92 -25.67 na iii sp5 11s - sp5 10d 2 77.61 -22.08 na iii sp5 11s - sp5 11d 2 68.63 -19.24 na iii sp5 11s - sp5 12d 2 60.64 -16.95 na iii sp5 12s - sp5 3d 2 274.59 -60.34 na iii sp5 12s - sp5 4d 2 221.25 -58.04 na iii sp5 12s - sp5 5d 2 171.18 -47.48 na iii sp5 12s - sp5 6d 2 135.35 -38.36 na iii sp5 12s - sp5 7d 2 109.91 -31.42 na iii sp5 12s - sp5 8d 2 91.37 -26.20 na iii sp5 12s - sp5 9d 2 77.46 -22.21 na iii sp5 12s - sp5 10d 2 66.76 -19.11 na iii sp5 12s - sp5 11d 2 58.34 -16.65 na iii sp5 12s - sp5 12d 2 52.01 -14.67 na iii sp5 3d - sp5 4d 6 0.00 2985.83 0.00 5867.95 3915.83 2215.00 na iii sp5 3d - sp5 5d 6 0.00 2203.55 0.00 3941.68 2870.80 1626.59 na iii sp5 3d - sp5 6d 6 0.00 1690.97 0.00 2887.02 2195.51 1244.95 na iii sp5 3d - sp5 7d 6 0.00 1344.72 0.00 2234.93 1742.47 988.49 na iii sp5 3d - sp5 8d 6 0.00 1100.48 0.00 1798.03 1424.17 808.14 na iii sp5 3d - sp5 9d 6 0.00 921.38 0.00 1488.07 1191.37 676.15 na iii sp5 3d - sp5 10d 6 0.00 785.73 0.00 1258.56 1015.35 576.32 na iii sp5 3d - sp5 11d 6 0.00 680.19 0.00 1082.86 878.57 498.73 na iii sp5 3d - sp5 12d 6 0.00 596.22 0.00 944.75 769.85 437.04 na iii sp5 4d - sp5 5d 6 0.00 1635.28 0.00 2979.19 2100.31 1197.40 na iii sp5 4d - sp5 6d 6 0.00 1255.79 0.00 2193.33 1607.73 917.57 na iii sp5 4d - sp5 7d 6 0.00 999.07 0.00 1703.43 1276.66 729.07 na iii sp5 4d - sp5 8d 6 0.00 817.83 0.00 1373.35 1043.81 596.32 na iii sp5 4d - sp5 9d 6 0.00 684.85 0.00 1138.29 873.38 499.09 na iii sp5 4d - sp5 10d 6 0.00 584.10 0.00 963.76 744.46 425.50 na iii sp5 4d - sp5 11d 6 0.00 505.70 0.00 829.91 644.26 368.27 na iii sp5 4d - sp5 12d 6 0.00 443.30 0.00 724.52 564.58 322.76 na iii sp5 5d - sp5 6d 6 0.00 928.89 0.00 1631.04 1182.12 676.41 na iii sp5 5d - sp5 7d 6 0.00 739.14 0.00 1268.75 938.91 537.62 na iii sp5 5d - sp5 8d 6 0.00 605.12 0.00 1024.12 767.77 439.82 na iii sp5 5d - sp5 9d 6 0.00 506.78 0.00 849.54 642.48 368.16 na iii sp5 5d - sp5 10d 6 0.00 432.25 0.00 719.74 547.69 313.90 na iii sp5 5d - sp5 11d 6 0.00 374.24 0.00 620.07 473.99 271.71 na iii sp5 5d - sp5 12d 6 0.00 328.08 0.00 541.53 415.39 238.14 na iii sp5 6d - sp5 7d 6 0.00 567.94 0.00 976.60 719.23 412.39 na iii sp5 6d - sp5 8d 6 0.00 465.00 0.00 788.71 588.18 337.40 na iii sp5 6d - sp5 9d 6 0.00 389.44 0.00 654.59 492.22 282.45 na iii sp5 6d - sp5 10d 6 0.00 332.18 0.00 554.78 419.61 240.84 na iii sp5 6d - sp5 11d 6 0.00 287.61 0.00 478.09 363.16 208.47 na iii sp5 6d - sp5 12d 6 0.00 252.14 0.00 417.64 318.27 182.72 na iii sp5 7d - sp5 8d 6 0.00 370.08 0.00 628.09 467.28 268.26 na iii sp5 7d - sp5 9d 6 0.00 309.96 0.00 521.36 391.05 224.58 na iii sp5 7d - sp5 10d 6 0.00 264.39 0.00 441.97 333.38 191.50 na iii sp5 7d - sp5 11d 6 0.00 228.92 0.00 380.95 288.53 165.77 na iii sp5 7d - sp5 12d 6 0.00 200.68 0.00 332.82 252.87 145.30 na iii sp5 8d - sp5 9d 6 0.00 253.79 0.00 426.97 319.83 183.77 na iii sp5 8d - sp5 10d 6 0.00 216.48 0.00 361.96 272.66 156.70 na iii sp5 8d - sp5 11d 6 0.00 187.44 0.00 312.02 235.99 135.65 na iii sp5 8d - sp5 12d 6 0.00 164.33 0.00 272.63 206.82 118.90 na iii sp5 9d - sp5 10d 6 0.00 181.32 0.00 303.17 228.19 131.19 na iii sp5 9d - sp5 11d 6 0.00 157.00 0.00 261.33 197.50 113.57 na iii sp5 9d - sp5 12d 6 0.00 137.63 0.00 228.35 173.09 99.54 na iii sp5 10d - sp5 11d 6 0.00 133.92 0.00 222.91 168.38 96.84 na iii sp5 10d - sp5 12d 6 0.00 117.40 0.00 194.77 147.57 84.89 na iii sp5 11d - sp5 12d 6 0.00 101.65 0.00 168.63 127.72 73.48 na iii s2p4 3s 4 377200.57E 135311.45F 1052.55z 8824.79g na iii s2p4 4s 4 491006.77E 136042.74F 1060.07z 2541.16g na iii s2p4 5s 4 532056.74E 136221.19F 1061.97z 1073.80g na iii s2p4 6s 4 551621.75E 136285.14F 1062.66z 553.38g na iii s2p4 7s 4 562474.91E 136313.68F 1062.97z 322.43g na iii s2p4 8s 4 569119.95E 136328.33F 1063.13z 204.28g na iii s2p4 9s 4 573482.98E 136336.62F 1063.22z 137.56g na iii s2p4 10s 4 576501.89E 136341.67F 1063.27z 97.04g na iii s2p4 11s 4 578676.24E 136344.91F 1063.31z 71.00g na iii s2p4 12s 4 580294.05E 136347.09F 1063.33z 53.52g na iii s2p4 3d 7 472556.27E 136016.35F 1061.21z 1.61z 10227.82f 5266.65g 2964.65g na iii s2p4 4d 7 523892.49E 136185.22F 1062.25z 0.79z 4375.11f 2810.19g 1597.78g na iii s2p4 5d 7 547326.99E 136265.37F 1062.79z 0.42z 2199.53f 1521.01g 868.76g na iii s2p4 6d 7 559948.12E 136302.66F 1063.04z 0.24z 1248.47f 893.57g 511.65g na iii s2p4 7d 7 567511.63E 136321.78F 1063.18z 0.16z 773.76f 564.45g 323.68g na iii s2p4 8d 7 572397.18E 136332.48F 1063.25z 0.10z 511.86f 377.79g 216.85g na iii s2p4 9d 7 575734.33E 136338.91F 1063.30z 0.07z 355.90f 264.72g 152.05g na iii s2p4 10d 7 578113.86E 136342.99F 1063.33z 0.05z 257.37f 192.46g 110.60g na iii s2p4 11d 7 579870.94E 136345.71F 1063.35z 0.04z 192.09f 144.21g 82.90g na iii s2p4 12d 7 581204.36E 136347.59F 1063.36z 0.03z 147.14f 110.79g 63.71g na iii s2p4 5g 7 548633.57E 136353.70F 1063.41z 0.06z 305.86f 0.38g 0.27g na iii s2p4 6g 7 560707.70E 136353.69F 1063.41z 0.03z 177.09f 0.41g 0.29g na iii s2p4 7g 7 567991.51E 136353.71F 1063.41z 0.02z 111.58f 0.35g 0.24g na iii s2p4 8g 7 572719.58E 136353.72F 1063.41z 0.01z 74.79f 0.28g 0.19g na iii s2p4 9g 7 575961.16E 136353.74F 1063.41z 0.01z 52.55f 0.22g 0.15g na iii s2p4 7i 7 568007.11E 136353.78F 1063.41z 0.01z 36.74f 0.00g 0.00g na iii s2p4 8i 7 572731.29E 136353.78F 1063.41z 0.01z 24.61f 0.00g 0.00g na iii s2p4 9i 7 575969.83E 136353.78F 1063.41z 0.00z 17.29f 0.00g 0.00g na iii sp6 1 285640.56E na iii sp5 3p 8 687363.99E 1028.74z 102.68z 17411.64f 167691.78g 6737.51g 9316.51g 7860.77g na iii sp5 4p 8 772084.71E 1035.44z 36.64z 5644.37f 168143.33g 2152.63g 2955.10g 2615.08g na iii sp5 5p 8 805093.47E 1037.37z 17.03z 2519.44f 168273.80g 960.09g 1312.61g 1183.98g na iii sp5 6p 8 821551.31E 1038.13z 9.26z 1340.47f 168324.56g 511.07g 697.07g 634.87g na iii sp5 7p 8 830955.14E 1038.48z 5.58z 797.77f 168348.30g 304.31g 414.46g 379.60g na iii sp5 8p 8 836834.20E 1038.67z 3.62z 513.23f 168360.86g 195.85g 266.48g 244.93g na iii sp5 9p 8 840754.85E 1038.78z 2.48z 349.64f 168368.12g 133.46g 181.48g 167.20g na iii sp5 10p 8 843500.54E 1038.85z 1.77z 248.92f 168372.62g 95.03g 129.16g 119.19g na iii sp5 11p 8 845498.06E 1038.89z 1.31z 183.49f 168375.54g 70.06g 95.19g 87.95g na iii sp5 12p 8 846995.44E 1038.92z 0.99z 139.15f 168377.53g 53.14g 72.17g 66.75g na iii sp5 4f 8 792392.54E 1038.98z 0.20z 1313.02f 168376.80g 33.18g 49.50g 31.78g na iii sp5 5f 8 814758.79E 1038.99z 0.10z 680.44f 168378.26g 27.72g 40.57g 26.09g na iii sp5 6f 8 826915.50E 1039.00z 0.06z 397.26f 168379.94g 19.90g 28.83g 18.56g na iii sp5 7f 8 834242.40E 1039.00z 0.04z 251.79f 168381.12g 14.12g 20.34g 13.10g na iii sp5 8f 8 838994.41E 1039.01z 0.03z 169.50f 168381.89g 10.19g 14.62g 9.43g na iii sp5 9f 8 842250.62E 1039.01z 0.02z 119.50f 168382.40g 7.53g 10.77g 6.95g na iii sp5 10f 8 844578.26E 1039.01z 0.01z 87.39f 168382.75g 5.69g 8.13g 5.24g na iii sp5 11f 8 846300.43E 1039.01z 0.01z 65.82f 168382.99g 4.39g 6.26g 4.04g na iii sp5 12f 8 847609.60E 1039.01z 0.01z 50.81f 168383.17g 3.45g 4.92g 3.17g na iii s2p4 3s - s2p4 4s 2 0.00 4711.88 na iii s2p4 3s - s2p4 5s 2 0.00 3051.23 na iii s2p4 3s - s2p4 6s 2 0.00 2185.72 na iii s2p4 3s - s2p4 7s 2 0.00 1666.28 na iii s2p4 3s - s2p4 8s 2 0.00 1325.22 na iii s2p4 3s - s2p4 9s 2 0.00 1086.88 na iii s2p4 3s - s2p4 10s 2 0.00 912.50 na iii s2p4 3s - s2p4 11s 2 0.00 780.33 na iii s2p4 3s - s2p4 12s 2 0.00 677.30 na iii s2p4 3s - s2p4 3d 2 7937.33 -1268.04 na iii s2p4 3s - s2p4 4d 2 4071.68 -1138.18 na iii s2p4 3s - s2p4 5d 2 2506.66 -908.30 na iii s2p4 3s - s2p4 6d 2 1733.28 -725.13 na iii s2p4 3s - s2p4 7d 2 1291.12 -589.99 na iii s2p4 3s - s2p4 8d 2 1011.40 -489.86 na iii s2p4 3s - s2p4 9d 2 821.18 -414.17 na iii s2p4 3s - s2p4 10d 2 684.75 -355.64 na iii s2p4 3s - s2p4 11d 2 582.84 -309.45 na iii s2p4 3s - s2p4 12d 2 504.25 -272.30 na iii s2p4 3s - sp6 1 22633.92 na iii s2p4 3s - sp5 3p 2 35970.69 7667.26 na iii s2p4 3s - sp5 4p 2 15562.24 4344.14 na iii s2p4 3s - sp5 5p 2 9596.92 2893.82 na iii s2p4 3s - sp5 6p 2 6744.69 2107.14 na iii s2p4 3s - sp5 7p 2 5096.34 1623.78 na iii s2p4 3s - sp5 8p 2 4035.15 1301.44 na iii s2p4 3s - sp5 9p 2 3301.79 1073.63 na iii s2p4 3s - sp5 10p 2 2768.79 905.53 na iii s2p4 3s - sp5 11p 2 2366.44 777.24 na iii s2p4 3s - sp5 12p 2 2053.59 676.68 na iii s2p4 4s - s2p4 5s 2 0.00 1650.97 na iii s2p4 4s - s2p4 6s 2 0.00 1184.45 na iii s2p4 4s - s2p4 7s 2 0.00 903.71 na iii s2p4 4s - s2p4 8s 2 0.00 719.10 na iii s2p4 4s - s2p4 9s 2 0.00 589.97 na iii s2p4 4s - s2p4 10s 2 0.00 495.43 na iii s2p4 4s - s2p4 11s 2 0.00 423.74 na iii s2p4 4s - s2p4 12s 2 0.00 367.84 na iii s2p4 4s - s2p4 3d 2 2266.59 -542.35 na iii s2p4 4s - s2p4 4d 2 2318.84 -499.12 na iii s2p4 4s - s2p4 5d 2 1595.75 -402.22 na iii s2p4 4s - s2p4 6d 2 1163.46 -322.68 na iii s2p4 4s - s2p4 7d 2 894.13 -263.28 na iii s2p4 4s - s2p4 8d 2 714.81 -218.99 na iii s2p4 4s - s2p4 9d 2 588.65 -185.37 na iii s2p4 4s - s2p4 10d 2 495.94 -159.31 na iii s2p4 4s - s2p4 11d 2 425.43 -138.70 na iii s2p4 4s - s2p4 12d 2 370.30 -122.11 na iii s2p4 4s - sp6 1 11547.94 na iii s2p4 4s - sp5 3p 2 11080.94 4083.39 na iii s2p4 4s - sp5 4p 2 12329.28 2335.34 na iii s2p4 4s - sp5 5p 2 6994.90 1561.39 na iii s2p4 4s - sp5 6p 2 4827.93 1139.02 na iii s2p4 4s - sp5 7p 2 3621.28 878.66 na iii s2p4 4s - sp5 8p 2 2856.49 704.70 na iii s2p4 4s - sp5 9p 2 2332.31 581.61 na iii s2p4 4s - sp5 10p 2 1953.21 490.70 na iii s2p4 4s - sp5 11p 2 1667.92 421.27 na iii s2p4 4s - sp5 12p 2 1446.59 366.83 na iii s2p4 5s - s2p4 6s 2 0.00 770.76 na iii s2p4 5s - s2p4 7s 2 0.00 588.24 na iii s2p4 5s - s2p4 8s 2 0.00 468.16 na iii s2p4 5s - s2p4 9s 2 0.00 384.13 na iii s2p4 5s - s2p4 10s 2 0.00 322.60 na iii s2p4 5s - s2p4 11s 2 0.00 275.94 na iii s2p4 5s - s2p4 12s 2 0.00 239.54 na iii s2p4 5s - s2p4 3d 2 1342.57 -321.48 na iii s2p4 5s - s2p4 4d 2 1111.00 -299.37 na iii s2p4 5s - s2p4 5d 2 982.78 -242.31 na iii s2p4 5s - s2p4 6d 2 749.39 -194.81 na iii s2p4 5s - s2p4 7d 2 587.83 -159.14 na iii s2p4 5s - s2p4 8d 2 475.48 -132.47 na iii s2p4 5s - s2p4 9d 2 394.51 -112.19 na iii s2p4 5s - s2p4 10d 2 334.10 -96.46 na iii s2p4 5s - s2p4 11d 2 287.68 -84.00 na iii s2p4 5s - s2p4 12d 2 251.11 -73.97 na iii s2p4 5s - sp6 1 7358.60 na iii s2p4 5s - sp5 3p 2 6574.38 2641.82 na iii s2p4 5s - sp5 4p 2 5298.41 1515.66 na iii s2p4 5s - sp5 5p 2 5575.62 1014.61 na iii s2p4 5s - sp5 6p 2 3622.60 740.61 na iii s2p4 5s - sp5 7p 2 2680.30 571.53 na iii s2p4 5s - sp5 8p 2 2101.92 458.48 na iii s2p4 5s - sp5 9p 2 1710.83 378.45 na iii s2p4 5s - sp5 10p 2 1430.04 319.33 na iii s2p4 5s - sp5 11p 2 1219.67 274.17 na iii s2p4 5s - sp5 12p 2 1056.92 238.75 na iii s2p4 6s - s2p4 7s 2 0.00 422.39 na iii s2p4 6s - s2p4 8s 2 0.00 336.19 na iii s2p4 6s - s2p4 9s 2 0.00 275.87 na iii s2p4 6s - s2p4 10s 2 0.00 231.69 na iii s2p4 6s - s2p4 11s 2 0.00 198.18 na iii s2p4 6s - s2p4 12s 2 0.00 172.04 na iii s2p4 6s - s2p4 3d 2 924.44 -220.28 na iii s2p4 6s - s2p4 4d 2 754.33 -206.44 na iii s2p4 6s - s2p4 5d 2 594.36 -167.47 na iii s2p4 6s - s2p4 6d 2 509.71 -134.80 na iii s2p4 6s - s2p4 7d 2 409.25 -110.19 na iii s2p4 6s - s2p4 8d 2 334.70 -91.76 na iii s2p4 6s - s2p4 9d 2 279.49 -77.73 na iii s2p4 6s - s2p4 10d 2 237.69 -66.84 na iii s2p4 6s - s2p4 11d 2 205.26 -58.22 na iii s2p4 6s - s2p4 12d 2 179.55 -51.27 na iii s2p4 6s - sp6 1 5230.88 na iii s2p4 6s - sp5 3p 2 4539.28 1891.61 na iii s2p4 6s - sp5 4p 2 3521.85 1086.85 na iii s2p4 6s - sp5 5p 2 2880.06 727.98 na iii s2p4 6s - sp5 6p 2 2972.79 531.54 na iii s2p4 6s - sp5 7p 2 2097.88 410.25 na iii s2p4 6s - sp5 8p 2 1627.46 329.14 na iii s2p4 6s - sp5 9p 2 1318.40 271.71 na iii s2p4 6s - sp5 10p 2 1099.16 229.27 na iii s2p4 6s - sp5 11p 2 935.96 196.86 na iii s2p4 6s - sp5 12p 2 810.21 171.43 na iii s2p4 7s - s2p4 8s 2 0.00 256.64 na iii s2p4 7s - s2p4 9s 2 0.00 210.60 na iii s2p4 7s - s2p4 10s 2 0.00 176.87 na iii s2p4 7s - s2p4 11s 2 0.00 151.29 na iii s2p4 7s - s2p4 12s 2 0.00 131.35 na iii s2p4 7s - s2p4 3d 2 690.01 -163.71 na iii s2p4 7s - s2p4 4d 2 559.78 -154.00 na iii s2p4 7s - s2p4 5d 2 437.16 -125.10 na iii s2p4 7s - s2p4 6d 2 349.85 -100.76 na iii s2p4 7s - s2p4 7d 2 299.34 -82.40 na iii s2p4 7s - s2p4 8d 2 248.14 -68.63 na iii s2p4 7s - s2p4 9d 2 208.59 -58.15 na iii s2p4 7s - s2p4 10d 2 178.10 -50.01 na iii s2p4 7s - s2p4 11d 2 154.21 -43.56 na iii s2p4 7s - s2p4 12d 2 135.14 -38.36 na iii s2p4 7s - sp6 1 3970.70 na iii s2p4 7s - sp5 3p 2 3393.83 1441.72 na iii s2p4 7s - sp5 4p 2 2592.80 829.02 na iii s2p4 7s - sp5 5p 2 2058.39 555.46 na iii s2p4 7s - sp5 6p 2 1726.82 405.64 na iii s2p4 7s - sp5 7p 2 1766.51 313.11 na iii s2p4 7s - sp5 8p 2 1318.27 251.22 na iii s2p4 7s - sp5 9p 2 1058.46 207.39 na iii s2p4 7s - sp5 10p 2 878.98 175.01 na iii s2p4 7s - sp5 11p 2 746.84 150.27 na iii s2p4 7s - sp5 12p 2 645.61 130.86 na iii s2p4 8s - s2p4 9s 2 0.00 167.64 na iii s2p4 8s - s2p4 10s 2 0.00 140.79 na iii s2p4 8s - s2p4 11s 2 0.00 120.43 na iii s2p4 8s - s2p4 12s 2 0.00 104.55 na iii s2p4 8s - s2p4 3d 2 541.79 -128.14 na iii s2p4 8s - s2p4 4d 2 438.28 -120.84 na iii s2p4 8s - s2p4 5d 2 340.90 -98.25 na iii s2p4 8s - s2p4 6d 2 271.24 -79.16 na iii s2p4 8s - s2p4 7d 2 222.02 -64.75 na iii s2p4 8s - s2p4 8d 2 191.18 -53.94 na iii s2p4 8s - s2p4 9d 2 162.07 -45.71 na iii s2p4 8s - s2p4 10d 2 138.97 -39.31 na iii s2p4 8s - s2p4 11d 2 120.64 -34.25 na iii s2p4 8s - s2p4 12d 2 105.91 -30.16 na iii s2p4 8s - sp6 1 3149.67 na iii s2p4 8s - sp5 3p 2 2667.71 1146.46 na iii s2p4 8s - sp5 4p 2 2021.75 659.57 na iii s2p4 8s - sp5 5p 2 1585.25 442.01 na iii s2p4 8s - sp5 6p 2 1297.97 322.82 na iii s2p4 8s - sp5 7p 2 1113.39 249.20 na iii s2p4 8s - sp5 8p 2 1133.29 199.94 na iii s2p4 8s - sp5 9p 2 880.57 165.07 na iii s2p4 8s - sp5 10p 2 725.77 139.29 na iii s2p4 8s - sp5 11p 2 614.60 119.60 na iii s2p4 8s - sp5 12p 2 530.30 104.16 na iii s2p4 9s - s2p4 10s 2 0.00 115.54 na iii s2p4 9s - s2p4 11s 2 0.00 98.83 na iii s2p4 9s - s2p4 12s 2 0.00 85.80 na iii s2p4 9s - s2p4 3d 2 440.61 -103.99 na iii s2p4 9s - s2p4 4d 2 355.86 -98.22 na iii s2p4 9s - s2p4 5d 2 276.20 -79.90 na iii s2p4 9s - s2p4 6d 2 219.16 -64.40 na iii s2p4 9s - s2p4 7d 2 178.69 -52.68 na iii s2p4 9s - s2p4 8d 2 149.31 -43.89 na iii s2p4 9s - s2p4 9d 2 129.71 -37.20 na iii s2p4 9s - s2p4 10d 2 111.84 -31.99 na iii s2p4 9s - s2p4 11d 2 97.38 -27.87 na iii s2p4 9s - s2p4 12d 2 85.64 -24.55 na iii s2p4 9s - sp6 1 2578.74 na iii s2p4 9s - sp5 3p 2 2171.14 940.18 na iii s2p4 9s - sp5 4p 2 1637.59 541.07 na iii s2p4 9s - sp5 5p 2 1275.52 362.64 na iii s2p4 9s - sp5 6p 2 1033.59 264.87 na iii s2p4 9s - sp5 7p 2 868.55 204.47 na iii s2p4 9s - sp5 8p 2 758.57 164.06 na iii s2p4 9s - sp5 9p 2 769.70 135.45 na iii s2p4 9s - sp5 10p 2 616.62 114.30 na iii s2p4 9s - sp5 11p 2 518.78 98.14 na iii s2p4 9s - sp5 12p 2 446.32 85.47 na iii s2p4 10s - s2p4 11s 2 0.00 83.01 na iii s2p4 10s - s2p4 12s 2 0.00 72.06 na iii s2p4 10s - s2p4 3d 2 367.73 -86.66 na iii s2p4 10s - s2p4 4d 2 296.71 -81.95 na iii s2p4 10s - s2p4 5d 2 230.00 -66.69 na iii s2p4 10s - s2p4 6d 2 182.22 -53.76 na iii s2p4 10s - s2p4 7d 2 148.28 -43.99 na iii s2p4 10s - s2p4 8d 2 123.56 -36.65 na iii s2p4 10s - s2p4 9d 2 105.09 -31.06 na iii s2p4 10s - s2p4 10d 2 92.13 -26.72 na iii s2p4 10s - s2p4 11d 2 80.52 -23.27 na iii s2p4 10s - s2p4 12d 2 70.96 -20.50 na iii s2p4 10s - sp6 1 2162.41 na iii s2p4 10s - sp5 3p 2 1813.01 789.28 na iii s2p4 10s - sp5 4p 2 1363.26 454.33 na iii s2p4 10s - sp5 5p 2 1057.56 304.54 na iii s2p4 10s - sp5 6p 2 852.14 222.44 na iii s2p4 10s - sp5 7p 2 709.73 171.72 na iii s2p4 10s - sp5 8p 2 608.90 137.79 na iii s2p4 10s - sp5 9p 2 539.56 113.75 na iii s2p4 10s - sp5 10p 2 546.30 95.99 na iii s2p4 10s - sp5 11p 2 448.25 82.43 na iii s2p4 10s - sp5 12p 2 383.44 71.78 na iii s2p4 11s - s2p4 12s 2 0.00 61.64 na iii s2p4 11s - s2p4 3d 2 313.09 -73.71 na iii s2p4 11s - s2p4 4d 2 252.47 -69.76 na iii s2p4 11s - s2p4 5d 2 195.54 -56.79 na iii s2p4 11s - s2p4 6d 2 154.77 -45.79 na iii s2p4 11s - s2p4 7d 2 125.80 -37.46 na iii s2p4 11s - s2p4 8d 2 104.69 -31.22 na iii s2p4 11s - s2p4 9d 2 88.85 -26.46 na iii s2p4 11s - s2p4 10d 2 76.70 -22.76 na iii s2p4 11s - s2p4 11d 2 67.83 -19.83 na iii s2p4 11s - s2p4 12d 2 59.94 -17.46 na iii s2p4 11s - sp6 1 1847.59 na iii s2p4 11s - sp5 3p 2 1544.30 674.92 na iii s2p4 11s - sp5 4p 2 1158.76 388.56 na iii s2p4 11s - sp5 5p 2 896.52 260.47 na iii s2p4 11s - sp5 6p 2 719.85 190.26 na iii s2p4 11s - sp5 7p 2 596.61 146.88 na iii s2p4 11s - sp5 8p 2 507.88 117.86 na iii s2p4 11s - sp5 9p 2 443.02 97.30 na iii s2p4 11s - sp5 10p 2 397.25 82.11 na iii s2p4 11s - sp5 11p 2 401.57 70.51 na iii s2p4 11s - sp5 12p 2 335.90 61.40 na iii s2p4 12s - s2p4 3d 2 270.85 -63.72 na iii s2p4 12s - s2p4 4d 2 218.32 -60.34 na iii s2p4 12s - s2p4 5d 2 169.00 -49.14 na iii s2p4 12s - s2p4 6d 2 133.68 -39.62 na iii s2p4 12s - s2p4 7d 2 108.58 -32.42 na iii s2p4 12s - s2p4 8d 2 90.28 -27.02 na iii s2p4 12s - s2p4 9d 2 76.54 -22.90 na iii s2p4 12s - s2p4 10d 2 65.97 -19.69 na iii s2p4 12s - s2p4 11d 2 57.66 -17.16 na iii s2p4 12s - s2p4 12d 2 51.40 -15.11 na iii s2p4 12s - sp6 1 1602.63 na iii s2p4 12s - sp5 3p 2 1336.41 585.79 na iii s2p4 12s - sp5 4p 2 1001.26 337.29 na iii s2p4 12s - sp5 5p 2 773.22 226.11 na iii s2p4 12s - sp5 6p 2 619.39 165.17 na iii s2p4 12s - sp5 7p 2 511.77 127.51 na iii s2p4 12s - sp5 8p 2 433.77 102.31 na iii s2p4 12s - sp5 9p 2 375.76 84.47 na iii s2p4 12s - sp5 10p 2 332.23 71.28 na iii s2p4 12s - sp5 11p 2 300.83 61.21 na iii s2p4 12s - sp5 12p 2 303.73 53.31 na iii s2p4 3d - s2p4 4d 4 0.00 5805.17 3839.41 2170.90 na iii s2p4 3d - s2p4 5d 4 0.00 3904.80 2818.75 1596.42 na iii s2p4 3d - s2p4 6d 4 0.00 2862.33 2157.54 1222.89 na iii s2p4 3d - s2p4 7d 4 0.00 2216.92 1713.24 971.48 na iii s2p4 3d - s2p4 8d 4 0.00 1784.12 1400.77 794.51 na iii s2p4 3d - s2p4 9d 4 0.00 1476.89 1172.06 664.91 na iii s2p4 3d - s2p4 10d 4 0.00 1249.29 999.07 566.84 na iii s2p4 3d - s2p4 11d 4 0.00 1075.02 864.60 490.59 na iii s2p4 3d - s2p4 12d 4 0.00 938.00 757.68 429.95 na iii s2p4 3d - s2p4 5g 2 537.65 24.84 na iii s2p4 3d - s2p4 6g 2 508.67 26.01 na iii s2p4 3d - s2p4 7g 2 443.88 24.03 na iii s2p4 3d - s2p4 8g 2 382.90 21.49 na iii s2p4 3d - s2p4 9g 2 331.60 19.06 na iii s2p4 3d - sp6 1 -26486.03 na iii s2p4 3d - sp5 3p 2 20173.60 -1640.90 na iii s2p4 3d - sp5 4p 2 4929.92 -626.78 na iii s2p4 3d - sp5 5p 2 2927.05 -341.42 na iii s2p4 3d - sp5 6p 2 2020.14 -221.15 na iii s2p4 3d - sp5 7p 2 1511.19 -158.33 na iii s2p4 3d - sp5 8p 2 1189.01 -120.81 na iii s2p4 3d - sp5 9p 2 968.72 -96.31 na iii s2p4 3d - sp5 10p 2 809.79 -79.23 na iii s2p4 3d - sp5 11p 2 690.44 -66.76 na iii s2p4 3d - sp5 12p 2 598.01 -57.30 na iii s2p4 3d - sp5 4f 2 -8445.96 -301.54 na iii s2p4 3d - sp5 5f 2 -6071.76 -277.28 na iii s2p4 3d - sp5 6f 2 -4595.56 -235.59 na iii s2p4 3d - sp5 7f 2 -3631.94 -198.78 na iii s2p4 3d - sp5 8f 2 -2964.38 -169.06 na iii s2p4 3d - sp5 9f 2 -2479.63 -145.41 na iii s2p4 3d - sp5 10f 2 -2114.49 -126.48 na iii s2p4 3d - sp5 11f 2 -1831.26 -111.15 na iii s2p4 3d - sp5 12f 2 -1606.26 -98.59 na iii s2p4 4d - s2p4 5d 4 0.00 2952.70 2066.68 1177.59 na iii s2p4 4d - s2p4 6d 4 0.00 2175.50 1583.29 903.12 na iii s2p4 4d - s2p4 7d 4 0.00 1690.39 1257.90 717.95 na iii s2p4 4d - s2p4 8d 4 0.00 1363.26 1028.81 587.42 na iii s2p4 4d - s2p4 9d 4 0.00 1130.16 861.03 491.75 na iii s2p4 4d - s2p4 10d 4 0.00 957.03 734.06 419.31 na iii s2p4 4d - s2p4 11d 4 0.00 824.20 635.33 362.97 na iii s2p4 4d - s2p4 12d 4 0.00 719.61 556.82 318.14 na iii s2p4 4d - s2p4 5g 2 -176.60 16.99 na iii s2p4 4d - s2p4 6g 2 -63.07 17.82 na iii s2p4 4d - s2p4 7g 2 -15.45 16.48 na iii s2p4 4d - s2p4 8g 2 5.36 14.74 na iii s2p4 4d - s2p4 9g 2 14.64 13.08 na iii s2p4 4d - sp6 1 -19678.14 na iii s2p4 4d - sp5 3p 2 8253.45 -1376.44 na iii s2p4 4d - sp5 4p 2 7595.03 -553.71 na iii s2p4 4d - sp5 5p 2 2813.76 -311.92 na iii s2p4 4d - sp5 6p 2 1875.76 -206.58 na iii s2p4 4d - sp5 7p 2 1382.73 -150.13 na iii s2p4 4d - sp5 8p 2 1079.78 -115.78 na iii s2p4 4d - sp5 9p 2 875.91 -92.99 na iii s2p4 4d - sp5 10p 2 730.21 -76.94 na iii s2p4 4d - sp5 11p 2 621.47 -65.10 na iii s2p4 4d - sp5 12p 2 537.62 -56.07 na iii s2p4 4d - sp5 4f 2 520.78 -215.00 na iii s2p4 4d - sp5 5f 2 -2114.24 -198.08 na iii s2p4 4d - sp5 6f 2 -1995.35 -168.47 na iii s2p4 4d - sp5 7f 2 -1712.18 -142.23 na iii s2p4 4d - sp5 8f 2 -1457.95 -121.02 na iii s2p4 4d - sp5 9f 2 -1250.97 -104.11 na iii s2p4 4d - sp5 10f 2 -1084.80 -90.57 na iii s2p4 4d - sp5 11f 2 -950.61 -79.61 na iii s2p4 4d - sp5 12f 2 -841.06 -70.62 na iii s2p4 5d - s2p4 6d 4 0.00 1618.72 1165.70 666.62 na iii s2p4 5d - s2p4 7d 4 0.00 1259.75 926.34 530.10 na iii s2p4 5d - s2p4 8d 4 0.00 1017.16 757.74 433.81 na iii s2p4 5d - s2p4 9d 4 0.00 843.95 634.23 363.21 na iii s2p4 5d - s2p4 10d 4 0.00 715.11 540.74 309.73 na iii s2p4 5d - s2p4 11d 4 0.00 616.14 468.04 268.13 na iii s2p4 5d - s2p4 12d 4 0.00 538.15 410.21 235.03 na iii s2p4 5d - s2p4 5g 2 -10.30 12.11 na iii s2p4 5d - s2p4 6g 2 -66.95 12.71 na iii s2p4 5d - s2p4 7g 2 -50.32 11.76 na iii s2p4 5d - s2p4 8g 2 -35.97 10.52 na iii s2p4 5d - s2p4 9g 2 -26.28 9.34 na iii s2p4 5d - sp6 1 -14574.51 na iii s2p4 5d - sp5 3p 2 4643.16 -1072.06 na iii s2p4 5d - sp5 4p 2 4368.50 -439.86 na iii s2p4 5d - sp5 5p 2 3609.10 -250.78 na iii s2p4 5d - sp5 6p 2 1657.52 -167.36 na iii s2p4 5d - sp5 7p 2 1187.24 -122.25 na iii s2p4 5d - sp5 8p 2 915.33 -94.60 na iii s2p4 5d - sp5 9p 2 737.40 -76.18 na iii s2p4 5d - sp5 10p 2 612.16 -63.14 na iii s2p4 5d - sp5 11p 2 519.57 -53.50 na iii s2p4 5d - sp5 12p 2 448.62 -46.12 na iii s2p4 5d - sp5 4f 2 -60.83 -156.16 na iii s2p4 5d - sp5 5f 2 357.69 -143.99 na iii s2p4 5d - sp5 6f 2 -658.27 -122.53 na iii s2p4 5d - sp5 7f 2 -738.87 -103.47 na iii s2p4 5d - sp5 8f 2 -692.81 -88.05 na iii s2p4 5d - sp5 9f 2 -624.38 -75.76 na iii s2p4 5d - sp5 10f 2 -557.61 -65.91 na iii s2p4 5d - sp5 11f 2 -498.21 -57.94 na iii s2p4 5d - sp5 12f 2 -446.85 -51.40 na iii s2p4 6d - s2p4 7d 4 0.00 970.07 710.17 406.93 na iii s2p4 6d - s2p4 8d 4 0.00 783.67 580.96 333.05 na iii s2p4 6d - s2p4 9d 4 0.00 650.54 486.29 278.87 na iii s2p4 6d - s2p4 10d 4 0.00 551.43 414.62 237.82 na iii s2p4 6d - s2p4 11d 4 0.00 475.26 358.89 205.89 na iii s2p4 6d - s2p4 12d 4 0.00 415.20 314.55 180.47 na iii s2p4 6d - s2p4 5g 2 -7.29 9.13 na iii s2p4 6d - s2p4 6g 2 -8.60 9.58 na iii s2p4 6d - s2p4 7g 2 -29.29 8.86 na iii s2p4 6d - s2p4 8g 2 -27.19 7.93 na iii s2p4 6d - s2p4 9g 2 -22.97 7.04 na iii s2p4 6d - sp6 1 -11208.19 na iii s2p4 6d - sp5 3p 2 3056.25 -845.91 na iii s2p4 6d - sp5 4p 2 2958.92 -350.46 na iii s2p4 6d - sp5 5p 2 2403.55 -200.98 na iii s2p4 6d - sp5 6p 2 1981.89 -134.61 na iii s2p4 6d - sp5 7p 2 1042.16 -98.56 na iii s2p4 6d - sp5 8p 2 784.50 -76.40 na iii s2p4 6d - sp5 9p 2 625.13 -61.59 na iii s2p4 6d - sp5 10p 2 515.83 -51.09 na iii s2p4 6d - sp5 11p 2 436.17 -43.32 na iii s2p4 6d - sp5 12p 2 375.65 -37.36 na iii s2p4 6d - sp5 4f 2 -69.46 -118.83 na iii s2p4 6d - sp5 5f 2 -10.67 -109.62 na iii s2p4 6d - sp5 6f 2 233.90 -93.30 na iii s2p4 6d - sp5 7f 2 -231.60 -78.80 na iii s2p4 6d - sp5 8f 2 -305.84 -67.06 na iii s2p4 6d - sp5 9f 2 -309.26 -57.71 na iii s2p4 6d - sp5 10f 2 -292.51 -50.21 na iii s2p4 6d - sp5 11f 2 -270.41 -44.14 na iii s2p4 6d - sp5 12f 2 -248.03 -39.16 na iii s2p4 7d - s2p4 8d 4 0.00 624.25 461.77 264.93 na iii s2p4 7d - s2p4 9d 4 0.00 518.28 386.54 221.84 na iii s2p4 7d - s2p4 10d 4 0.00 439.42 329.58 189.19 na iii s2p4 7d - s2p4 11d 4 0.00 378.79 285.28 163.79 na iii s2p4 7d - s2p4 12d 4 0.00 330.97 250.04 143.58 na iii s2p4 7d - s2p4 5g 2 -5.09 7.18 na iii s2p4 7d - s2p4 6g 2 -6.55 7.54 na iii s2p4 7d - s2p4 7g 2 -6.51 6.97 na iii s2p4 7d - s2p4 8g 2 -14.92 6.24 na iii s2p4 7d - s2p4 9g 2 -15.05 5.54 na iii s2p4 7d - sp6 1 -8924.99 na iii s2p4 7d - sp5 3p 2 2207.82 -683.73 na iii s2p4 7d - sp5 4p 2 2184.26 -284.85 na iii s2p4 7d - sp5 5p 2 1775.59 -163.89 na iii s2p4 7d - sp5 6p 2 1435.76 -109.99 na iii s2p4 7d - sp5 7p 2 1200.73 -80.64 na iii s2p4 7d - sp5 8p 2 693.74 -62.56 na iii s2p4 7d - sp5 9p 2 541.71 -50.47 na iii s2p4 7d - sp5 10p 2 442.81 -41.89 na iii s2p4 7d - sp5 11p 2 372.44 -35.53 na iii s2p4 7d - sp5 12p 2 319.69 -30.65 na iii s2p4 7d - sp5 4f 2 -57.46 -94.02 na iii s2p4 7d - sp5 5f 2 -34.66 -86.76 na iii s2p4 7d - sp5 6f 2 10.99 -73.85 na iii s2p4 7d - sp5 7f 2 156.70 -62.38 na iii s2p4 7d - sp5 8f 2 -84.34 -53.09 na iii s2p4 7d - sp5 9f 2 -136.32 -45.69 na iii s2p4 7d - sp5 10f 2 -148.58 -39.75 na iii s2p4 7d - sp5 11f 2 -147.08 -34.94 na iii s2p4 7d - sp5 12f 2 -140.40 -31.00 na iii s2p4 8d - s2p4 9d 4 0.00 424.52 316.24 181.58 na iii s2p4 8d - s2p4 10d 4 0.00 359.94 269.64 154.87 na iii s2p4 8d - s2p4 11d 4 0.00 310.31 233.40 134.07 na iii s2p4 8d - s2p4 12d 4 0.00 271.16 204.57 117.53 na iii s2p4 8d - s2p4 5g 2 -3.87 5.83 na iii s2p4 8d - s2p4 6g 2 -4.87 6.12 na iii s2p4 8d - s2p4 7g 2 -5.20 5.67 na iii s2p4 8d - s2p4 8g 2 -4.87 5.07 na iii s2p4 8d - s2p4 9g 2 -8.60 4.50 na iii s2p4 8d - sp6 1 -7310.29 na iii s2p4 8d - sp5 3p 2 1694.17 -565.37 na iii s2p4 8d - sp5 4p 2 1703.17 -236.36 na iii s2p4 8d - sp5 5p 2 1387.42 -136.27 na iii s2p4 8d - sp5 6p 2 1118.85 -91.57 na iii s2p4 8d - sp5 7p 2 919.11 -67.19 na iii s2p4 8d - sp5 8p 2 780.91 -52.16 na iii s2p4 8d - sp5 9p 2 483.72 -42.09 na iii s2p4 8d - sp5 10p 2 388.53 -34.94 na iii s2p4 8d - sp5 11p 2 324.11 -29.64 na iii s2p4 8d - sp5 12p 2 276.90 -25.58 na iii s2p4 8d - sp5 4f 2 -46.52 -76.70 na iii s2p4 8d - sp5 5f 2 -34.68 -70.78 na iii s2p4 8d - sp5 6f 2 -12.32 -60.26 na iii s2p4 8d - sp5 7f 2 18.00 -50.90 na iii s2p4 8d - sp5 8f 2 108.71 -43.32 na iii s2p4 8d - sp5 9f 2 -27.88 -37.28 na iii s2p4 8d - sp5 10f 2 -63.02 -32.44 na iii s2p4 8d - sp5 11f 2 -74.89 -28.52 na iii s2p4 8d - sp5 12f 2 -77.74 -25.30 na iii s2p4 9d - s2p4 10d 4 0.00 301.51 225.72 129.68 na iii s2p4 9d - s2p4 11d 4 0.00 259.93 195.38 112.27 na iii s2p4 9d - s2p4 12d 4 0.00 227.15 171.25 98.42 na iii s2p4 9d - s2p4 5g 2 -3.11 4.86 na iii s2p4 9d - s2p4 6g 2 -3.84 5.10 na iii s2p4 9d - s2p4 7g 2 -4.06 4.72 na iii s2p4 9d - s2p4 8g 2 -4.03 4.23 na iii s2p4 9d - s2p4 9g 2 -3.67 3.75 na iii s2p4 9d - sp6 1 -6124.23 na iii s2p4 9d - sp5 3p 2 1355.54 -476.69 na iii s2p4 9d - sp5 4p 2 1379.30 -199.75 na iii s2p4 9d - sp5 5p 2 1125.82 -115.32 na iii s2p4 9d - sp5 6p 2 907.44 -77.56 na iii s2p4 9d - sp5 7p 2 743.12 -56.94 na iii s2p4 9d - sp5 8p 2 621.51 -44.22 na iii s2p4 9d - sp5 9p 2 535.76 -35.69 na iii s2p4 9d - sp5 10p 2 350.19 -29.64 na iii s2p4 9d - sp5 11p 2 287.65 -25.15 na iii s2p4 9d - sp5 12p 2 243.97 -21.70 na iii s2p4 9d - sp5 4f 2 -38.14 -64.07 na iii s2p4 9d - sp5 5f 2 -30.97 -59.14 na iii s2p4 9d - sp5 6f 2 -16.87 -50.35 na iii s2p4 9d - sp5 7f 2 -0.92 -42.53 na iii s2p4 9d - sp5 8f 2 19.02 -36.20 na iii s2p4 9d - sp5 9f 2 77.98 -31.15 na iii s2p4 9d - sp5 10f 2 -4.94 -27.11 na iii s2p4 9d - sp5 11f 2 -28.93 -23.83 na iii s2p4 9d - sp5 12f 2 -38.64 -21.14 na iii s2p4 10d - s2p4 11d 4 0.00 221.73 166.60 95.76 na iii s2p4 10d - s2p4 12d 4 0.00 193.76 146.02 83.94 na iii s2p4 10d - s2p4 5g 2 -2.58 4.13 na iii s2p4 10d - s2p4 6g 2 -3.15 4.34 na iii s2p4 10d - s2p4 7g 2 -3.29 4.01 na iii s2p4 10d - s2p4 8g 2 -3.25 3.59 na iii s2p4 10d - s2p4 9g 2 -3.12 3.19 na iii s2p4 10d - sp6 1 -5224.85 na iii s2p4 10d - sp5 3p 2 1118.17 -408.54 na iii s2p4 10d - sp5 4p 2 1148.41 -171.48 na iii s2p4 10d - sp5 5p 2 938.93 -99.09 na iii s2p4 10d - sp5 6p 2 756.83 -66.69 na iii s2p4 10d - sp5 7p 2 619.17 -48.98 na iii s2p4 10d - sp5 8p 2 516.33 -38.04 na iii s2p4 10d - sp5 9p 2 438.97 -30.71 na iii s2p4 10d - sp5 10p 2 383.24 -25.51 na iii s2p4 10d - sp5 11p 2 261.44 -21.64 na iii s2p4 10d - sp5 12p 2 218.71 -18.68 na iii s2p4 10d - sp5 4f 2 -31.81 -54.55 na iii s2p4 10d - sp5 5f 2 -27.02 -50.36 na iii s2p4 10d - sp5 6f 2 -16.98 -42.87 na iii s2p4 10d - sp5 7f 2 -6.41 -36.22 na iii s2p4 10d - sp5 8f 2 4.42 -30.83 na iii s2p4 10d - sp5 9f 2 17.80 -26.53 na iii s2p4 10d - sp5 10f 2 57.62 -23.08 na iii s2p4 10d - sp5 11f 2 4.48 -20.29 na iii s2p4 10d - sp5 12f 2 -12.25 -18.00 na iii s2p4 11d - s2p4 12d 4 0.00 167.77 126.40 72.67 na iii s2p4 11d - s2p4 5g 2 -2.20 3.57 na iii s2p4 11d - s2p4 6g 2 -2.66 3.75 na iii s2p4 11d - s2p4 7g 2 -2.76 3.47 na iii s2p4 11d - s2p4 8g 2 -2.71 3.10 na iii s2p4 11d - s2p4 9g 2 -2.59 2.75 na iii s2p4 11d - sp6 1 -4524.52 na iii s2p4 11d - sp5 3p 2 943.92 -354.97 na iii s2p4 11d - sp5 4p 2 976.58 -149.18 na iii s2p4 11d - sp5 5p 2 799.56 -86.26 na iii s2p4 11d - sp5 6p 2 644.62 -58.08 na iii s2p4 11d - sp5 7p 2 527.16 -42.67 na iii s2p4 11d - sp5 8p 2 439.15 -33.15 na iii s2p4 11d - sp5 9p 2 372.39 -26.77 na iii s2p4 11d - sp5 10p 2 321.15 -22.23 na iii s2p4 11d - sp5 11p 2 283.45 -18.86 na iii s2p4 11d - sp5 12p 2 200.24 -16.28 na iii s2p4 11d - sp5 4f 2 -26.96 -47.17 na iii s2p4 11d - sp5 5f 2 -23.54 -43.55 na iii s2p4 11d - sp5 6f 2 -15.87 -37.08 na iii s2p4 11d - sp5 7f 2 -8.05 -31.32 na iii s2p4 11d - sp5 8f 2 -0.70 -26.66 na iii s2p4 11d - sp5 9f 2 6.68 -22.94 na iii s2p4 11d - sp5 10f 2 15.88 -19.96 na iii s2p4 11d - sp5 11f 2 43.68 -17.55 na iii s2p4 11d - sp5 12f 2 8.10 -15.57 na iii s2p4 12d - s2p4 5g 2 -1.91 3.12 na iii s2p4 12d - s2p4 6g 2 -2.29 3.28 na iii s2p4 12d - s2p4 7g 2 -2.36 3.03 na iii s2p4 12d - s2p4 8g 2 -2.31 2.71 na iii s2p4 12d - s2p4 9g 2 -2.20 2.41 na iii s2p4 12d - sp6 1 -3966.95 na iii s2p4 12d - sp5 3p 2 811.37 -312.02 na iii s2p4 12d - sp5 4p 2 844.41 -131.25 na iii s2p4 12d - sp5 5p 2 692.15 -75.94 na iii s2p4 12d - sp5 6p 2 558.16 -51.14 na iii s2p4 12d - sp5 7p 2 456.39 -37.58 na iii s2p4 12d - sp5 8p 2 380.01 -29.20 na iii s2p4 12d - sp5 9p 2 321.93 -23.58 na iii s2p4 12d - sp5 10p 2 277.00 -19.59 na iii s2p4 12d - sp5 11p 2 241.83 -16.62 na iii s2p4 12d - sp5 12p 2 215.47 -14.35 na iii s2p4 12d - sp5 4f 2 -23.17 -41.31 na iii s2p4 12d - sp5 5f 2 -20.61 -38.14 na iii s2p4 12d - sp5 6f 2 -14.47 -32.47 na iii s2p4 12d - sp5 7f 2 -8.32 -27.43 na iii s2p4 12d - sp5 8f 2 -2.79 -23.35 na iii s2p4 12d - sp5 9f 2 2.27 -20.09 na iii s2p4 12d - sp5 10f 2 7.39 -17.48 na iii s2p4 12d - sp5 11f 2 13.89 -15.37 na iii s2p4 12d - sp5 12f 2 33.85 -13.64 na iii s2p4 5g - s2p4 6g 4 0.00 177.25 0.40 0.28 na iii s2p4 5g - s2p4 7g 4 0.00 125.39 0.37 0.25 na iii s2p4 5g - s2p4 8g 4 0.00 96.15 0.33 0.23 na iii s2p4 5g - s2p4 9g 4 0.00 77.30 0.29 0.20 na iii s2p4 5g - s2p4 7i 2 53.20 0.00 na iii s2p4 5g - s2p4 8i 2 52.62 0.00 na iii s2p4 5g - s2p4 9i 2 47.62 0.00 na iii s2p4 5g - sp5 4f 2 -3086.67 -3.35 na iii s2p4 5g - sp5 5f 2 7.96 -3.03 na iii s2p4 5g - sp5 6f 2 -99.72 -2.55 na iii s2p4 5g - sp5 7f 2 -80.77 -2.14 na iii s2p4 5g - sp5 8f 2 -64.38 -1.81 na iii s2p4 5g - sp5 9f 2 -52.53 -1.55 na iii s2p4 5g - sp5 10f 2 -43.86 -1.35 na iii s2p4 5g - sp5 11f 2 -37.35 -1.18 na iii s2p4 5g - sp5 12f 2 -32.31 -1.05 na iii s2p4 6g - s2p4 7g 4 0.00 124.48 0.38 0.26 na iii s2p4 6g - s2p4 8g 4 0.00 95.86 0.34 0.24 na iii s2p4 6g - s2p4 9g 4 0.00 77.30 0.30 0.21 na iii s2p4 6g - s2p4 7i 2 -12.06 0.00 na iii s2p4 6g - s2p4 8i 2 5.32 0.00 na iii s2p4 6g - s2p4 9i 2 11.55 0.00 na iii s2p4 6g - sp5 4f 2 -2182.21 -3.50 na iii s2p4 6g - sp5 5f 2 -1154.47 -3.16 na iii s2p4 6g - sp5 6f 2 7.87 -2.66 na iii s2p4 6g - sp5 7f 2 -75.43 -2.23 na iii s2p4 6g - sp5 8f 2 -66.87 -1.89 na iii s2p4 6g - sp5 9f 2 -56.25 -1.62 na iii s2p4 6g - sp5 10f 2 -47.59 -1.41 na iii s2p4 6g - sp5 11f 2 -40.80 -1.23 na iii s2p4 6g - sp5 12f 2 -35.44 -1.09 na iii s2p4 7g - s2p4 8g 4 0.00 85.40 0.31 0.22 na iii s2p4 7g - s2p4 9g 4 0.00 69.01 0.27 0.19 na iii s2p4 7g - s2p4 7i 2 0.00 0.00 na iii s2p4 7g - s2p4 8i 2 -6.37 0.00 na iii s2p4 7g - s2p4 9i 2 -1.46 0.00 na iii s2p4 7g - sp5 4f 2 -1649.77 -3.23 na iii s2p4 7g - sp5 5f 2 -1032.92 -2.91 na iii s2p4 7g - sp5 6f 2 -518.70 -2.45 na iii s2p4 7g - sp5 7f 2 6.62 -2.06 na iii s2p4 7g - sp5 8f 2 -52.29 -1.74 na iii s2p4 7g - sp5 9f 2 -49.49 -1.49 na iii s2p4 7g - sp5 10f 2 -43.39 -1.30 na iii s2p4 7g - sp5 11f 2 -37.79 -1.14 na iii s2p4 7g - sp5 12f 2 -33.11 -1.01 na iii s2p4 8g - s2p4 9g 4 0.00 60.12 0.24 0.17 na iii s2p4 8g - s2p4 7i 2 0.16 0.00 na iii s2p4 8g - s2p4 8i 2 0.00 0.00 na iii s2p4 8g - s2p4 9i 2 -3.33 0.00 na iii s2p4 8g - sp5 4f 2 -1308.51 -2.88 na iii s2p4 8g - sp5 5f 2 -872.87 -2.60 na iii s2p4 8g - sp5 6f 2 -519.49 -2.19 na iii s2p4 8g - sp5 7f 2 -264.19 -1.84 na iii s2p4 8g - sp5 8f 2 5.33 -1.56 na iii s2p4 8g - sp5 9f 2 -36.06 -1.33 na iii s2p4 8g - sp5 10f 2 -35.91 -1.16 na iii s2p4 8g - sp5 11f 2 -32.54 -1.02 na iii s2p4 8g - sp5 12f 2 -29.02 -0.90 na iii s2p4 9g - s2p4 7i 2 0.20 0.00 na iii s2p4 9g - s2p4 8i 2 0.14 0.00 na iii s2p4 9g - s2p4 9i 2 0.00 0.00 na iii s2p4 9g - sp5 4f 2 -1073.43 -2.55 na iii s2p4 9g - sp5 5f 2 -739.91 -2.30 na iii s2p4 9g - sp5 6f 2 -469.54 -1.94 na iii s2p4 9g - sp5 7f 2 -283.34 -1.63 na iii s2p4 9g - sp5 8f 2 -147.40 -1.38 na iii s2p4 9g - sp5 9f 2 4.26 -1.18 na iii s2p4 9g - sp5 10f 2 -25.23 -1.03 na iii s2p4 9g - sp5 11f 2 -26.16 -0.90 na iii s2p4 9g - sp5 12f 2 -24.36 -0.80 na iii s2p4 7i - s2p4 8i 4 0.00 20.49 0.00 0.00 na iii s2p4 7i - s2p4 9i 4 0.00 14.24 0.00 0.00 na iii s2p4 8i - s2p4 9i 4 0.00 17.00 0.00 0.00 na iii sp6 - sp5 3p 4 3974.49 23257.56 5277.10 22589.82 na iii sp6 - sp5 4p 4 2038.77 11862.85 2872.34 12154.46 na iii sp6 - sp5 5p 4 1304.25 7572.39 1886.04 7942.65 na iii sp6 - sp5 6p 4 930.19 5394.91 1363.74 5729.02 na iii sp6 - sp5 7p 4 708.20 4104.98 1046.74 4391.09 na iii sp6 - sp5 8p 4 563.28 3263.76 836.87 3507.54 na iii sp6 - sp5 9p 4 462.28 2677.93 689.24 2887.05 na iii sp6 - sp5 10p 4 388.48 2250.00 580.65 2431.15 na iii sp6 - sp5 11p 4 332.55 1925.82 497.97 2084.30 na iii sp6 - sp5 12p 4 288.93 1673.12 433.27 1813.06 na iii sp6 - sp5 4f 1 1388.48 na iii sp6 - sp5 5f 1 1281.49 na iii sp6 - sp5 6f 1 1091.04 na iii sp6 - sp5 7f 1 921.70 na iii sp6 - sp5 8f 1 784.54 na iii sp6 - sp5 9f 1 675.14 na iii sp6 - sp5 10f 1 587.47 na iii sp6 - sp5 11f 1 516.45 na iii sp6 - sp5 12f 1 458.20 na iii sp5 3p - sp5 4p 6 0.00 3785.33 0.00 8543.26 5235.03 4512.87 na iii sp5 3p - sp5 5p 6 0.00 2513.75 0.00 5480.13 3481.64 3023.82 na iii sp5 3p - sp5 6p 6 0.00 1827.60 0.00 3923.59 2533.89 2208.54 na iii sp5 3p - sp5 7p 6 0.00 1407.14 0.00 2995.77 1952.26 1704.98 na iii sp5 3p - sp5 8p 6 0.00 1127.19 0.00 2387.47 1564.57 1368.09 na iii sp5 3p - sp5 9p 6 0.00 929.54 0.00 1962.13 1290.65 1129.49 na iii sp5 3p - sp5 10p 6 0.00 783.80 0.00 1650.49 1088.54 953.16 na iii sp5 3p - sp5 11p 6 0.00 672.63 0.00 1413.88 934.31 818.45 na iii sp5 3p - sp5 12p 6 0.00 585.52 0.00 1229.11 813.43 712.78 na iii sp5 3p - sp5 4f 2 -2420.67 -99.09 na iii sp5 3p - sp5 5f 2 -1951.83 -84.74 na iii sp5 3p - sp5 6f 2 -1550.70 -69.16 na iii sp5 3p - sp5 7f 2 -1257.60 -56.91 na iii sp5 3p - sp5 8f 2 -1042.62 -47.61 na iii sp5 3p - sp5 9f 2 -881.14 -40.48 na iii sp5 3p - sp5 10f 2 -756.79 -34.91 na iii sp5 3p - sp5 11f 2 -658.86 -30.49 na iii sp5 3p - sp5 12f 2 -580.20 -26.91 na iii sp5 4p - sp5 5p 6 0.00 1436.29 0.00 3557.56 1968.81 1758.42 na iii sp5 4p - sp5 6p 6 0.00 1046.71 0.00 2542.36 1434.13 1286.57 na iii sp5 4p - sp5 7p 6 0.00 807.00 0.00 1940.46 1105.49 994.22 na iii sp5 4p - sp5 8p 6 0.00 647.00 0.00 1546.40 886.23 798.26 na iii sp5 4p - sp5 9p 6 0.00 533.86 0.00 1270.99 731.22 659.32 na iii sp5 4p - sp5 10p 6 0.00 450.34 0.00 1069.22 616.81 556.56 na iii sp5 4p - sp5 11p 6 0.00 386.58 0.00 916.03 529.47 478.00 na iii sp5 4p - sp5 12p 6 0.00 336.59 0.00 796.40 461.01 416.35 na iii sp5 4p - sp5 4f 2 -93.87 -72.53 na iii sp5 4p - sp5 5f 2 -434.68 -63.54 na iii sp5 4p - sp5 6f 2 -444.42 -52.57 na iii sp5 4p - sp5 7f 2 -400.25 -43.65 na iii sp5 4p - sp5 8f 2 -351.13 -36.73 na iii sp5 4p - sp5 9f 2 -307.27 -31.35 na iii sp5 4p - sp5 10f 2 -270.13 -27.12 na iii sp5 4p - sp5 11f 2 -239.10 -23.74 na iii sp5 4p - sp5 12f 2 -213.14 -20.99 na iii sp5 5p - sp5 6p 6 0.00 700.32 0.00 1785.25 956.46 866.85 na iii sp5 5p - sp5 7p 6 0.00 540.22 0.00 1361.24 737.43 670.13 na iii sp5 5p - sp5 8p 6 0.00 433.26 0.00 1084.56 591.24 538.18 na iii sp5 5p - sp5 9p 6 0.00 357.57 0.00 891.37 487.87 444.58 na iii sp5 5p - sp5 10p 6 0.00 301.68 0.00 749.88 411.56 375.33 na iii sp5 5p - sp5 11p 6 0.00 259.00 0.00 642.47 353.30 322.38 na iii sp5 5p - sp5 12p 6 0.00 225.53 0.00 558.59 307.62 280.82 na iii sp5 5p - sp5 4f 2 -144.05 -52.36 na iii sp5 5p - sp5 5f 2 -95.65 -46.15 na iii sp5 5p - sp5 6f 2 -155.85 -38.32 na iii sp5 5p - sp5 7f 2 -160.82 -31.89 na iii sp5 5p - sp5 8f 2 -150.48 -26.87 na iii sp5 5p - sp5 9f 2 -136.66 -22.96 na iii sp5 5p - sp5 10f 2 -123.03 -19.88 na iii sp5 5p - sp5 11f 2 -110.69 -17.41 na iii sp5 5p - sp5 12f 2 -99.85 -15.40 na iii sp5 6p - sp5 7p 6 0.00 394.34 0.00 1017.17 537.49 490.89 na iii sp5 6p - sp5 8p 6 0.00 316.31 0.00 809.92 430.96 394.28 na iii sp5 6p - sp5 9p 6 0.00 261.09 0.00 665.54 355.63 325.73 na iii sp5 6p - sp5 10p 6 0.00 220.29 0.00 559.88 300.01 275.01 na iii sp5 6p - sp5 11p 6 0.00 189.13 0.00 479.68 257.55 236.22 na iii sp5 6p - sp5 12p 6 0.00 164.70 0.00 417.05 224.25 205.77 na iii sp5 6p - sp5 4f 2 -105.42 -39.57 na iii sp5 6p - sp5 5f 2 -100.42 -34.98 na iii sp5 6p - sp5 6f 2 -70.77 -29.09 na iii sp5 6p - sp5 7f 2 -80.70 -24.23 na iii sp5 6p - sp5 8f 2 -79.51 -20.43 na iii sp5 6p - sp5 9f 2 -74.39 -17.46 na iii sp5 6p - sp5 10f 2 -68.26 -15.13 na iii sp5 6p - sp5 11f 2 -62.22 -13.25 na iii sp5 6p - sp5 12f 2 -56.65 -11.72 na iii sp5 7p - sp5 8p 6 0.00 244.12 0.00 633.31 332.33 304.91 na iii sp5 7p - sp5 9p 6 0.00 201.51 0.00 520.19 274.24 251.91 na iii sp5 7p - sp5 10p 6 0.00 170.03 0.00 437.55 231.36 212.69 na iii sp5 7p - sp5 11p 6 0.00 145.99 0.00 374.86 198.61 182.70 na iii sp5 7p - sp5 12p 6 0.00 127.13 0.00 325.92 172.94 159.15 na iii sp5 7p - sp5 4f 2 -80.38 -31.13 na iii sp5 7p - sp5 5f 2 -78.32 -27.56 na iii sp5 7p - sp5 6f 2 -67.30 -22.94 na iii sp5 7p - sp5 7f 2 -50.31 -19.11 na iii sp5 7p - sp5 8f 2 -49.88 -16.12 na iii sp5 7p - sp5 9f 2 -47.29 -13.79 na iii sp5 7p - sp5 10f 2 -43.84 -11.94 na iii sp5 7p - sp5 11f 2 -40.27 -10.46 na iii sp5 7p - sp5 12f 2 -36.88 -9.26 na iii sp5 8p - sp5 9p 6 0.00 161.67 0.00 420.71 219.91 202.36 na iii sp5 8p - sp5 10p 6 0.00 136.42 0.00 353.77 185.52 170.86 na iii sp5 8p - sp5 11p 6 0.00 117.13 0.00 303.05 159.26 146.77 na iii sp5 8p - sp5 12p 6 0.00 102.00 0.00 263.48 138.68 127.85 na iii sp5 8p - sp5 4f 2 -63.76 -25.27 na iii sp5 8p - sp5 5f 2 -62.59 -22.39 na iii sp5 8p - sp5 6f 2 -54.66 -18.65 na iii sp5 8p - sp5 7f 2 -46.20 -15.54 na iii sp5 8p - sp5 8f 2 -36.12 -13.11 na iii sp5 8p - sp5 9f 2 -33.80 -11.21 na iii sp5 8p - sp5 10f 2 -31.32 -9.71 na iii sp5 8p - sp5 11f 2 -28.83 -8.51 na iii sp5 8p - sp5 12f 2 -26.46 -7.53 na iii sp5 9p - sp5 10p 6 0.00 112.62 0.00 293.60 153.10 141.17 na iii sp5 9p - sp5 11p 6 0.00 96.70 0.00 251.45 131.43 121.26 na iii sp5 9p - sp5 12p 6 0.00 84.21 0.00 218.60 114.44 105.64 na iii sp5 9p - sp5 4f 2 -52.16 -21.02 na iii sp5 9p - sp5 5f 2 -51.38 -18.64 na iii sp5 9p - sp5 6f 2 -45.12 -15.53 na iii sp5 9p - sp5 7f 2 -38.59 -12.94 na iii sp5 9p - sp5 8f 2 -32.75 -10.92 na iii sp5 9p - sp5 9f 2 -26.49 -9.34 na iii sp5 9p - sp5 10f 2 -24.20 -8.09 na iii sp5 9p - sp5 11f 2 -22.18 -7.09 na iii sp5 9p - sp5 12f 2 -20.33 -6.28 na iii sp5 10p - sp5 11p 6 0.00 81.60 0.00 212.97 110.88 102.39 na iii sp5 10p - sp5 12p 6 0.00 71.06 0.00 185.12 96.55 89.20 na iii sp5 10p - sp5 4f 2 -43.69 -17.84 na iii sp5 10p - sp5 5f 2 -43.12 -15.82 na iii sp5 10p - sp5 6f 2 -37.98 -13.18 na iii sp5 10p - sp5 7f 2 -32.63 -10.99 na iii sp5 10p - sp5 8f 2 -27.93 -9.27 na iii sp5 10p - sp5 9f 2 -23.93 -7.93 na iii sp5 10p - sp5 10f 2 -19.87 -6.87 na iii sp5 10p - sp5 11f 2 -18.00 -6.02 na iii sp5 10p - sp5 12f 2 -16.42 -5.33 na iii sp5 11p - sp5 12p 6 0.00 61.01 0.00 159.37 82.89 76.62 na iii sp5 11p - sp5 4f 2 -37.29 -15.37 na iii sp5 11p - sp5 5f 2 -36.85 -13.64 na iii sp5 11p - sp5 6f 2 -32.51 -11.37 na iii sp5 11p - sp5 7f 2 -27.99 -9.48 na iii sp5 11p - sp5 8f 2 -24.05 -8.00 na iii sp5 11p - sp5 9f 2 -20.74 -6.84 na iii sp5 11p - sp5 10f 2 -17.97 -5.93 na iii sp5 11p - sp5 11f 2 -15.23 -5.19 na iii sp5 11p - sp5 12f 2 -13.77 -4.60 na iii sp5 12p - sp5 4f 2 -32.31 -13.43 na iii sp5 12p - sp5 5f 2 -31.96 -11.92 na iii sp5 12p - sp5 6f 2 -28.22 -9.93 na iii sp5 12p - sp5 7f 2 -24.33 -8.28 na iii sp5 12p - sp5 8f 2 -20.95 -6.99 na iii sp5 12p - sp5 9f 2 -18.12 -5.98 na iii sp5 12p - sp5 10f 2 -15.78 -5.18 na iii sp5 12p - sp5 11f 2 -13.81 -4.54 na iii sp5 12p - sp5 12f 2 -11.90 -4.02 na iii sp5 4f - sp5 5f 6 0.00 30.32 0.00 768.35 44.80 28.78 na iii sp5 4f - sp5 6f 6 0.00 25.68 0.00 542.39 37.74 24.26 na iii sp5 4f - sp5 7f 6 0.00 21.62 0.00 413.77 31.68 20.37 na iii sp5 4f - sp5 8f 6 0.00 18.37 0.00 330.69 26.86 17.27 na iii sp5 4f - sp5 9f 6 0.00 15.78 0.00 272.84 23.05 14.82 na iii sp5 4f - sp5 10f 6 0.00 13.72 0.00 230.45 20.01 12.87 na iii sp5 4f - sp5 11f 6 0.00 12.05 0.00 198.19 17.57 11.30 na iii sp5 4f - sp5 12f 6 0.00 10.68 0.00 172.93 15.57 10.01 na iii sp5 5f - sp5 6f 6 0.00 23.49 0.00 478.18 34.20 22.00 na iii sp5 5f - sp5 7f 6 0.00 19.78 0.00 366.13 28.72 18.48 na iii sp5 5f - sp5 8f 6 0.00 16.80 0.00 293.39 24.35 15.67 na iii sp5 5f - sp5 9f 6 0.00 14.44 0.00 242.51 20.89 13.45 na iii sp5 5f - sp5 10f 6 0.00 12.55 0.00 205.10 18.15 11.68 na iii sp5 5f - sp5 11f 6 0.00 11.03 0.00 176.57 15.93 10.26 na iii sp5 5f - sp5 12f 6 0.00 9.78 0.00 154.18 14.12 9.09 na iii sp5 6f - sp5 7f 6 0.00 16.76 0.00 302.85 24.21 15.59 na iii sp5 6f - sp5 8f 6 0.00 14.24 0.00 243.04 20.53 13.22 na iii sp5 6f - sp5 9f 6 0.00 12.24 0.00 201.15 17.62 11.35 na iii sp5 6f - sp5 10f 6 0.00 10.64 0.00 170.28 15.30 9.86 na iii sp5 6f - sp5 11f 6 0.00 9.35 0.00 146.70 13.43 8.66 na iii sp5 6f - sp5 12f 6 0.00 8.29 0.00 128.17 11.91 7.67 na iii sp5 7f - sp5 8f 6 0.00 12.00 0.00 201.35 17.24 11.11 na iii sp5 7f - sp5 9f 6 0.00 10.31 0.00 166.75 14.80 9.54 na iii sp5 7f - sp5 10f 6 0.00 8.96 0.00 141.25 12.85 8.29 na iii sp5 7f - sp5 11f 6 0.00 7.87 0.00 121.75 11.28 7.27 na iii sp5 7f - sp5 12f 6 0.00 6.98 0.00 106.42 10.00 6.45 na iii sp5 8f - sp5 9f 6 0.00 8.76 0.00 139.99 12.55 8.09 na iii sp5 8f - sp5 10f 6 0.00 7.61 0.00 118.61 10.90 7.03 na iii sp5 8f - sp5 11f 6 0.00 6.69 0.00 102.27 9.57 6.17 na iii sp5 8f - sp5 12f 6 0.00 5.93 0.00 89.42 8.48 5.47 na iii sp5 9f - sp5 10f 6 0.00 6.54 0.00 101.04 9.36 6.03 na iii sp5 9f - sp5 11f 6 0.00 5.75 0.00 87.12 8.21 5.30 na iii sp5 9f - sp5 12f 6 0.00 5.10 0.00 76.19 7.28 4.69 na iii sp5 10f - sp5 11f 6 0.00 5.00 0.00 75.23 7.13 4.60 na iii sp5 10f - sp5 12f 6 0.00 4.43 0.00 65.78 6.32 4.08 na iii sp5 11f - sp5 12f 6 0.00 3.89 0.00 57.48 5.55 3.58