1 84040841410 1 3 1000.0000 7 0 0 s 2 p 6 p 0 f 0 h 0 k 0 s 0 d 0 al iv s2p6 e= -52843.72524 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 3p e= -52166.64433 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 4p e= -52023.14574 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 5p e= -51966.31533 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 6p e= -51937.76884 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 7p e= -51921.38487 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 8p e= -51911.10925 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 9p e= -51904.24153 s 2 p 5 p 1 f 0 h 0 k 0 s 0 d 0 al iv s2p5 10p e= -51899.42517 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 4f e= -51990.39589 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 5f e= -51950.63754 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 6f e= -51929.03800 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 7f e= -51916.02263 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 8f e= -51907.58013 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 9f e= -51901.79506 s 2 p 5 p 0 f 1 h 0 k 0 s 0 d 0 al iv s2p5 10f e= -51897.65900 s 2 p 5 p 0 f 0 h 1 k 0 s 0 d 0 al iv s2p5 6h e= -51928.82901 s 2 p 5 p 0 f 0 h 1 k 0 s 0 d 0 al iv s2p5 7h e= -51915.88981 s 2 p 5 p 0 f 0 h 1 k 0 s 0 d 0 al iv s2p5 8h e= -51907.49076 s 2 p 5 p 0 f 0 h 1 k 0 s 0 d 0 al iv s2p5 9h e= -51901.73271 s 2 p 5 p 0 f 0 h 1 k 0 s 0 d 0 al iv s2p5 10h e= -51897.61401 s 2 p 5 p 0 f 0 h 0 k 1 s 0 d 0 al iv s2p5 8k e= -51907.48823 s 2 p 5 p 0 f 0 h 0 k 1 s 0 d 0 al iv s2p5 9k e= -51901.73019 s 2 p 5 p 0 f 0 h 0 k 1 s 0 d 0 al iv s2p5 10k e= -51897.61179 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 3s e= -51850.58215 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 4s e= -51666.61617 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 5s e= -51598.11456 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 6s e= -51564.98182 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 7s e= -51546.43660 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 8s e= -51535.01167 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 9s e= -51527.47745 s 1 p 6 p 0 f 0 h 0 k 0 s 1 d 0 al iv sp6 10s e= -51522.24785 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 3d e= -51708.05972 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 4d e= -51616.50052 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 5d e= -51574.67745 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 6d e= -51552.14851 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 7d e= -51538.65207 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 8d e= -51529.93634 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 9d e= -51523.98460 s 1 p 6 p 0 f 0 h 0 k 0 s 0 d 1 al iv sp6 10d e= -51519.74146 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 3s e= -52231.91294 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 4s e= -52045.70776 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 5s e= -51976.69685 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 6s e= -51943.38378 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 7s e= -51924.75827 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 8s e= -51913.29206 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 9s e= -51905.73453 s 2 p 5 s 1 d 0 g 0 i 0 p 0 f 0 al iv s2p5 10s e= -51900.49067 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 3d e= -52085.80274 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 4d e= -51994.51791 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 5d e= -51952.79139 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 6d e= -51930.30378 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 7d e= -51916.82776 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 8d e= -51908.12320 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 9d e= -51902.17815 s 2 p 5 s 0 d 1 g 0 i 0 p 0 f 0 al iv s2p5 10d e= -51897.93923 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 5g e= -51950.33505 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 6g e= -51928.86761 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 7g e= -51915.91749 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 8g e= -51907.51048 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 9g e= -51901.74683 s 2 p 5 s 0 d 0 g 1 i 0 p 0 f 0 al iv s2p5 10g e= -51897.62448 s 2 p 5 s 0 d 0 g 0 i 1 p 0 f 0 al iv s2p5 7i e= -51915.88662 s 2 p 5 s 0 d 0 g 0 i 1 p 0 f 0 al iv s2p5 8i e= -51907.48853 s 2 p 5 s 0 d 0 g 0 i 1 p 0 f 0 al iv s2p5 9i e= -51901.73073 s 2 p 5 s 0 d 0 g 0 i 1 p 0 f 0 al iv s2p5 10i e= -51897.61220 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 3p e= -51789.21322 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 4p e= -51645.16032 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 5p e= -51588.19992 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 6p e= -51559.60803 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 7p e= -51543.20416 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 8p e= -51532.91824 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 9p e= -51526.04479 s 1 p 6 s 0 d 0 g 0 i 0 p 1 f 0 al iv sp6 10p e= -51521.22495 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 4f e= -51612.21870 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 5f e= -51572.44618 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 6f e= -51550.83964 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 7f e= -51537.82070 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 8f e= -51529.37599 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 9f e= -51523.58969 s 1 p 6 s 0 d 0 g 0 i 0 p 0 f 1 al iv sp6 10f e= -51519.45279 al iv s2p6 1 0.00E al iv s2p5 3p 6 677080.91E 2338.38z 264.40z 23749.85f 12093.18g 10656.11g al iv s2p5 4p 6 820579.50E 2352.63z 94.16z 7709.75f 3793.57g 3519.37g al iv s2p5 5p 6 877409.91E 2356.72z 43.78z 3442.38f 1679.26g 1590.09g al iv s2p5 6p 6 905956.39E 2358.31z 23.82z 1833.62f 891.49g 852.91g al iv s2p5 7p 6 922340.37E 2359.05z 14.37z 1092.78f 530.43g 510.50g al iv s2p5 8p 6 932615.99E 2359.45z 9.33z 703.96f 341.37g 329.79g al iv s2p5 9p 6 939483.70E 2359.68z 6.40z 480.16f 232.71g 225.38g al iv s2p5 10p 6 944300.07E 2359.82z 4.58z 342.20f 165.78g 160.84g al iv s2p5 4f 6 853329.35E 2360.06z 0.75z 2059.04f 101.51g 65.21g al iv s2p5 5f 6 893087.70E 2360.09z 0.37z 1068.49f 82.04g 52.82g al iv s2p5 6f 6 914687.24E 2360.12z 0.21z 623.87f 57.80g 37.26g al iv s2p5 7f 6 927702.60E 2360.14z 0.13z 395.27f 40.53g 26.15g al iv s2p5 8f 6 936145.11E 2360.15z 0.09z 265.96f 29.01g 18.73g al iv s2p5 9f 6 941930.18E 2360.16z 0.06z 187.40f 21.30g 13.76g al iv s2p5 10f 6 946066.24E 2360.16z 0.04z 136.96f 16.03g 10.35g al iv s2p5 6h 6 914896.23E 2360.18z 0.06z 153.12f 0.01g 0.00g al iv s2p5 7h 6 927835.42E 2360.18z 0.04z 96.43f 0.01g 0.01g al iv s2p5 8h 6 936234.47E 2360.18z 0.03z 64.60f 0.01g 0.01g al iv s2p5 9h 6 941992.53E 2360.18z 0.02z 45.37f 0.01g 0.01g al iv s2p5 10h 6 946111.22E 2360.18z 0.01z 33.08f 0.01g 0.00g al iv s2p5 8k 6 936237.01E 2360.18z 0.01z 25.38f 0.00g 0.00g al iv s2p5 9k 6 941995.05E 2360.18z 0.01z 17.82f 0.00g 0.00g al iv s2p5 10k 6 946113.44E 2360.18z 0.01z 12.99f 0.00g 0.00g al iv sp6 3s 2 993143.08E 10139.36g al iv sp6 4s 2 1177109.06E 2861.93g al iv sp6 5s 2 1245610.68E 1204.79g al iv sp6 6s 2 1278743.42E 621.36g al iv sp6 7s 2 1297288.64E 362.69g al iv sp6 8s 2 1308713.57E 230.24g al iv sp6 9s 2 1316247.78E 155.33g al iv sp6 10s 2 1321477.39E 109.75g al iv sp6 3d 3 1135665.52E 5.58z 7434.89g al iv sp6 4d 3 1227224.71E 2.60z 3790.72g al iv sp6 5d 3 1269047.78E 1.36z 2003.07g al iv sp6 6d 3 1291576.73E 0.79z 1162.91g al iv sp6 7d 3 1305073.17E 0.50z 730.15g al iv sp6 8d 3 1313788.90E 0.33z 487.08g al iv sp6 9d 3 1319740.64E 0.23z 340.66g al iv sp6 10d 3 1323983.77E 0.17z 247.39g al iv s2p6 - s2p5 3p 2 6571.26 28674.67 al iv s2p6 - s2p5 4p 2 3534.99 15226.43 al iv s2p6 - s2p5 5p 2 2310.85 9898.18 al iv s2p6 - s2p5 6p 2 1668.25 7125.10 al iv s2p6 - s2p5 7p 2 1279.85 5457.08 al iv s2p6 - s2p5 8p 2 1023.19 4358.12 al iv s2p6 - s2p5 9p 2 842.81 3587.27 al iv s2p6 - s2p5 10p 2 710.18 3021.22 al iv s2p6 - s2p5 4f 1 2211.57 al iv s2p6 - s2p5 5f 1 2031.10 al iv s2p6 - s2p5 6f 1 1723.62 al iv s2p6 - s2p5 7f 1 1452.65 al iv s2p6 - s2p5 8f 1 1234.22 al iv s2p6 - s2p5 9f 1 1060.56 al iv s2p6 - s2p5 10f 1 921.72 al iv s2p6 - sp6 3s 1 11031.91 al iv s2p6 - sp6 4s 1 5618.13 al iv s2p6 - sp6 5s 1 3582.32 al iv s2p6 - sp6 6s 1 2550.13 al iv s2p6 - sp6 7s 1 1938.53 al iv s2p6 - sp6 8s 1 1539.64 al iv s2p6 - sp6 9s 1 1261.93 al iv s2p6 - sp6 10s 1 1059.21 al iv s2p5 3p - s2p5 4p 4 0.00 11540.35 6754.51 6089.90 al iv s2p5 3p - s2p5 5p 4 0.00 7379.33 4482.52 4072.88 al iv s2p5 3p - s2p5 6p 4 0.00 5279.25 3260.91 2973.74 al iv s2p5 3p - s2p5 7p 4 0.00 4031.12 2512.84 2296.21 al iv s2p5 3p - s2p5 8p 4 0.00 3213.73 2014.58 1843.22 al iv s2p5 3p - s2p5 9p 4 0.00 2642.36 1662.58 1522.42 al iv s2p5 3p - s2p5 10p 4 0.00 2223.70 1402.80 1285.29 al iv s2p5 3p - s2p5 4f 2 -3683.15 -190.56 al iv s2p5 3p - s2p5 5f 2 -2943.57 -162.54 al iv s2p5 3p - s2p5 6f 2 -2326.74 -132.37 al iv s2p5 3p - s2p5 7f 2 -1880.74 -108.76 al iv s2p5 3p - s2p5 8f 2 -1555.62 -90.87 al iv s2p5 3p - s2p5 9f 2 -1312.44 -77.18 al iv s2p5 3p - s2p5 10f 2 -1125.72 -66.51 al iv s2p5 3p - sp6 3s 2 47283.81 10771.17 al iv s2p5 3p - sp6 4s 2 15126.58 5719.01 al iv s2p5 3p - sp6 5s 2 9021.02 3704.15 al iv s2p5 3p - sp6 6s 2 6253.91 2657.17 al iv s2p5 3p - sp6 7s 2 4690.23 2028.68 al iv s2p5 3p - sp6 8s 2 3695.64 1615.59 al iv s2p5 3p - sp6 9s 2 3013.57 1326.57 al iv s2p5 3p - sp6 10s 2 2520.53 1114.85 al iv s2p5 3p - sp6 3d 2 28021.35 -969.60 al iv s2p5 3p - sp6 4d 2 10478.96 -960.11 al iv s2p5 3p - sp6 5d 2 5626.89 -786.91 al iv s2p5 3p - sp6 6d 2 3606.18 -635.71 al iv s2p5 3p - sp6 7d 2 2562.95 -520.73 al iv s2p5 3p - sp6 8d 2 1946.10 -434.24 al iv s2p5 3p - sp6 9d 2 1546.11 -368.23 al iv s2p5 3p - sp6 10d 2 1269.08 -316.88 al iv s2p5 4p - s2p5 5p 4 0.00 4835.90 2522.92 2363.71 al iv s2p5 4p - s2p5 6p 4 0.00 3451.98 1837.29 1729.43 al iv s2p5 4p - s2p5 7p 4 0.00 2634.43 1416.66 1336.99 al iv s2p5 4p - s2p5 8p 4 0.00 2099.93 1136.18 1074.03 al iv s2p5 4p - s2p5 9p 4 0.00 1726.54 937.89 887.54 al iv s2p5 4p - s2p5 10p 4 0.00 1453.01 791.49 749.56 al iv s2p5 4p - s2p5 4f 2 -191.28 -136.16 al iv s2p5 4p - s2p5 5f 2 -710.17 -118.84 al iv s2p5 4p - s2p5 6f 2 -712.13 -98.07 al iv s2p5 4p - s2p5 7f 2 -635.72 -81.25 al iv s2p5 4p - s2p5 8f 2 -554.79 -68.26 al iv s2p5 4p - s2p5 9f 2 -483.77 -58.20 al iv s2p5 4p - s2p5 10f 2 -424.22 -50.30 al iv s2p5 4p - sp6 3s 2 19673.64 5991.63 al iv s2p5 4p - sp6 4s 2 16603.76 3200.45 al iv s2p5 4p - sp6 5s 2 7298.85 2077.37 al iv s2p5 4p - sp6 6s 2 4865.44 1491.73 al iv s2p5 4p - sp6 7s 2 3591.10 1139.54 al iv s2p5 4p - sp6 8s 2 2806.00 907.82 al iv s2p5 4p - sp6 9s 2 2276.70 745.58 al iv s2p5 4p - sp6 10s 2 1898.02 626.69 al iv s2p5 4p - sp6 3d 2 7275.39 -173.28 al iv s2p5 4p - sp6 4d 2 10695.35 -265.32 al iv s2p5 4p - sp6 5d 2 5857.14 -240.70 al iv s2p5 4p - sp6 6d 2 3885.33 -202.96 al iv s2p5 4p - sp6 7d 2 2836.41 -170.07 al iv s2p5 4p - sp6 8d 2 2197.26 -143.76 al iv s2p5 4p - sp6 9d 2 1772.13 -123.00 al iv s2p5 4p - sp6 10d 2 1471.46 -106.50 al iv s2p5 5p - s2p5 6p 4 0.00 2433.95 1223.41 1164.33 al iv s2p5 5p - s2p5 7p 4 0.00 1855.22 943.54 900.53 al iv s2p5 5p - s2p5 8p 4 0.00 1478.32 756.85 723.62 al iv s2p5 5p - s2p5 9p 4 0.00 1215.32 624.82 598.09 al iv s2p5 5p - s2p5 10p 4 0.00 1022.76 527.32 505.18 al iv s2p5 5p - s2p5 4f 2 -235.75 -97.52 al iv s2p5 5p - s2p5 5f 2 -169.52 -85.64 al iv s2p5 5p - s2p5 6f 2 -262.35 -70.91 al iv s2p5 5p - s2p5 7f 2 -266.07 -58.87 al iv s2p5 5p - s2p5 8f 2 -246.68 -49.53 al iv s2p5 5p - s2p5 9f 2 -222.71 -42.27 al iv s2p5 5p - s2p5 10f 2 -199.69 -36.56 al iv s2p5 5p - sp6 3s 2 11993.51 3969.29 al iv s2p5 5p - sp6 4s 2 9166.88 2125.20 al iv s2p5 5p - sp6 5s 2 7609.40 1380.61 al iv s2p5 5p - sp6 6s 2 3991.62 991.79 al iv s2p5 5p - sp6 7s 2 2856.89 757.81 al iv s2p5 5p - sp6 8s 2 2203.75 603.80 al iv s2p5 5p - sp6 9s 2 1775.73 495.94 al iv s2p5 5p - sp6 10s 2 1474.13 416.88 al iv s2p5 5p - sp6 3d 2 4323.84 -21.77 al iv s2p5 5p - sp6 4d 2 4098.04 -107.06 al iv s2p5 5p - sp6 5d 2 5110.86 -108.95 al iv s2p5 5p - sp6 6d 2 3291.62 -95.78 al iv s2p5 5p - sp6 7d 2 2397.49 -81.94 al iv s2p5 5p - sp6 8d 2 1858.74 -70.10 al iv s2p5 5p - sp6 9d 2 1501.02 -60.44 al iv s2p5 5p - sp6 10d 2 1247.88 -52.61 al iv s2p5 6p - s2p5 7p 4 0.00 1390.04 687.63 659.82 al iv s2p5 6p - s2p5 8p 4 0.00 1106.79 551.61 530.27 al iv s2p5 6p - s2p5 9p 4 0.00 909.68 455.41 438.32 al iv s2p5 6p - s2p5 10p 4 0.00 765.48 384.36 370.25 al iv s2p5 6p - s2p5 4f 2 -171.79 -73.47 al iv s2p5 6p - s2p5 5f 2 -165.21 -64.70 al iv s2p5 6p - s2p5 6f 2 -121.25 -53.65 al iv s2p5 6p - s2p5 7f 2 -136.61 -44.59 al iv s2p5 6p - s2p5 8f 2 -133.26 -37.54 al iv s2p5 6p - s2p5 9f 2 -123.84 -32.05 al iv s2p5 6p - s2p5 10f 2 -113.08 -27.73 al iv s2p5 6p - sp6 3s 2 8390.06 2884.91 al iv s2p5 6p - sp6 4s 2 6276.10 1546.42 al iv s2p5 6p - sp6 5s 2 4842.52 1005.04 al iv s2p5 6p - sp6 6s 2 4093.04 722.14 al iv s2p5 6p - sp6 7s 2 2404.45 551.83 al iv s2p5 6p - sp6 8s 2 1808.40 439.71 al iv s2p5 6p - sp6 9s 2 1441.55 361.18 al iv s2p5 6p - sp6 10s 2 1189.68 303.61 al iv s2p5 6p - sp6 3d 2 2993.77 17.82 al iv s2p5 6p - sp6 4d 2 2729.80 -52.93 al iv s2p5 6p - sp6 5d 2 2399.05 -60.88 al iv s2p5 6p - sp6 6d 2 2817.48 -55.58 al iv s2p5 6p - sp6 7d 2 1990.37 -48.40 al iv s2p5 6p - sp6 8d 2 1534.27 -41.83 al iv s2p5 6p - sp6 9d 2 1236.57 -36.29 al iv s2p5 6p - sp6 10d 2 1027.19 -31.72 al iv s2p5 7p - s2p5 8p 4 0.00 867.15 425.52 410.30 al iv s2p5 7p - s2p5 9p 4 0.00 712.35 351.32 339.18 al iv s2p5 7p - s2p5 10p 4 0.00 599.33 296.52 286.51 al iv s2p5 7p - s2p5 4f 2 -131.05 -57.73 al iv s2p5 7p - s2p5 5f 2 -128.46 -50.90 al iv s2p5 7p - s2p5 6f 2 -111.04 -42.25 al iv s2p5 7p - s2p5 7f 2 -85.03 -35.13 al iv s2p5 7p - s2p5 8f 2 -84.25 -29.58 al iv s2p5 7p - s2p5 9f 2 -79.50 -25.26 al iv s2p5 7p - s2p5 10f 2 -73.40 -21.86 al iv s2p5 7p - sp6 3s 2 6326.72 2221.91 al iv s2p5 7p - sp6 4s 2 4690.56 1191.82 al iv s2p5 7p - sp6 5s 2 3559.57 774.77 al iv s2p5 7p - sp6 6s 2 2840.54 556.75 al iv s2p5 7p - sp6 7s 2 2447.42 425.48 al iv s2p5 7p - sp6 8s 2 1555.98 339.04 al iv s2p5 7p - sp6 9s 2 1213.98 278.50 al iv s2p5 7p - sp6 10s 2 992.64 234.11 al iv s2p5 7p - sp6 3d 2 2246.05 28.55 al iv s2p5 7p - sp6 4d 2 2015.30 -29.78 al iv s2p5 7p - sp6 5d 2 1715.32 -38.80 al iv s2p5 7p - sp6 6d 2 1504.76 -36.61 al iv s2p5 7p - sp6 7d 2 1712.17 -32.35 al iv s2p5 7p - sp6 8d 2 1284.55 -28.18 al iv s2p5 7p - sp6 9d 2 1029.39 -24.58 al iv s2p5 7p - sp6 10d 2 853.14 -21.55 al iv s2p5 8p - s2p5 9p 4 0.00 576.99 281.85 272.63 al iv s2p5 8p - s2p5 10p 4 0.00 485.27 237.89 230.30 al iv s2p5 8p - s2p5 4f 2 -104.12 -46.83 al iv s2p5 8p - s2p5 5f 2 -102.68 -41.33 al iv s2p5 8p - s2p5 6f 2 -89.98 -34.32 al iv s2p5 8p - s2p5 7f 2 -76.35 -28.55 al iv s2p5 8p - s2p5 8f 2 -60.63 -24.04 al iv s2p5 8p - s2p5 9f 2 -56.88 -20.54 al iv s2p5 8p - s2p5 10f 2 -52.62 -17.77 al iv s2p5 8p - sp6 3s 2 5004.79 1780.73 al iv s2p5 8p - sp6 4s 2 3693.22 955.57 al iv s2p5 8p - sp6 5s 2 2782.60 621.29 al iv s2p5 8p - sp6 6s 2 2191.36 446.49 al iv s2p5 8p - sp6 7s 2 1800.97 341.23 al iv s2p5 8p - sp6 8s 2 1577.44 271.91 al iv s2p5 8p - sp6 9s 2 1063.22 223.36 al iv s2p5 8p - sp6 10s 2 853.30 187.77 al iv s2p5 8p - sp6 3d 2 1771.49 30.34 al iv s2p5 8p - sp6 4d 2 1576.27 -18.35 al iv s2p5 8p - sp6 5d 2 1323.10 -27.03 al iv s2p5 8p - sp6 6d 2 1130.15 -26.23 al iv s2p5 8p - sp6 7d 2 1000.97 -23.45 al iv s2p5 8p - sp6 8d 2 1116.27 -20.56 al iv s2p5 8p - sp6 9d 2 873.71 -18.00 al iv s2p5 8p - sp6 10d 2 720.40 -15.83 al iv s2p5 9p - s2p5 10p 4 0.00 403.20 196.41 190.39 al iv s2p5 9p - s2p5 4f 2 -85.32 -38.96 al iv s2p5 9p - s2p5 5f 2 -84.36 -34.40 al iv s2p5 9p - s2p5 6f 2 -74.28 -28.58 al iv s2p5 9p - s2p5 7f 2 -63.67 -23.77 al iv s2p5 9p - s2p5 8f 2 -54.18 -20.02 al iv s2p5 9p - s2p5 9f 2 -44.30 -17.11 al iv s2p5 9p - s2p5 10f 2 -40.59 -14.80 al iv s2p5 9p - sp6 3s 2 4093.71 1469.24 al iv s2p5 9p - sp6 4s 2 3012.57 788.65 al iv s2p5 9p - sp6 5s 2 2260.91 512.81 al iv s2p5 9p - sp6 6s 2 1770.14 368.55 al iv s2p5 9p - sp6 7s 2 1439.02 281.67 al iv s2p5 9p - sp6 8s 2 1210.96 224.46 al iv s2p5 9p - sp6 9s 2 1075.20 184.38 al iv s2p5 9p - sp6 10s 2 758.07 155.00 al iv s2p5 9p - sp6 3d 2 1446.21 29.15 al iv s2p5 9p - sp6 4d 2 1280.51 -12.09 al iv s2p5 9p - sp6 5d 2 1066.80 -20.06 al iv s2p5 9p - sp6 6d 2 900.49 -19.92 al iv s2p5 9p - sp6 7d 2 779.68 -17.98 al iv s2p5 9p - sp6 8d 2 697.97 -15.84 al iv s2p5 9p - sp6 9d 2 767.39 -13.91 al iv s2p5 9p - sp6 10d 2 619.84 -12.26 al iv s2p5 10p - s2p5 4f 2 -71.59 -33.05 al iv s2p5 10p - s2p5 5f 2 -70.89 -29.20 al iv s2p5 10p - s2p5 6f 2 -62.56 -24.26 al iv s2p5 10p - s2p5 7f 2 -53.83 -20.18 al iv s2p5 10p - s2p5 8f 2 -46.16 -17.00 al iv s2p5 10p - s2p5 9f 2 -39.63 -14.52 al iv s2p5 10p - s2p5 10f 2 -33.15 -12.57 al iv s2p5 10p - sp6 3s 2 3432.56 1239.48 al iv s2p5 10p - sp6 4s 2 2521.57 665.45 al iv s2p5 10p - sp6 5s 2 1887.89 432.73 al iv s2p5 10p - sp6 6s 2 1473.30 311.01 al iv s2p5 10p - sp6 7s 2 1191.89 237.70 al iv s2p5 10p - sp6 8s 2 993.76 189.42 al iv s2p5 10p - sp6 9s 2 852.26 155.60 al iv s2p5 10p - sp6 10s 2 765.31 130.80 al iv s2p5 10p - sp6 3d 2 1210.99 27.03 al iv s2p5 10p - sp6 4d 2 1068.86 -8.39 al iv s2p5 10p - sp6 5d 2 886.40 -15.59 al iv s2p5 10p - sp6 6d 2 743.33 -15.78 al iv s2p5 10p - sp6 7d 2 637.06 -14.36 al iv s2p5 10p - sp6 8d 2 559.19 -12.70 al iv s2p5 10p - sp6 9d 2 505.47 -11.18 al iv s2p5 10p - sp6 10d 2 549.83 -9.87 al iv s2p5 4f - s2p5 5f 4 0.00 1205.78 91.21 58.65 al iv s2p5 4f - s2p5 6f 4 0.00 850.99 76.51 49.22 al iv s2p5 4f - s2p5 7f 4 0.00 648.93 64.03 41.21 al iv s2p5 4f - s2p5 8f 4 0.00 518.41 54.16 34.86 al iv s2p5 4f - s2p5 9f 4 0.00 427.56 46.39 29.86 al iv s2p5 4f - s2p5 10f 4 0.00 361.00 40.23 25.90 al iv s2p5 4f - s2p5 6h 2 240.91 0.53 al iv s2p5 4f - s2p5 7h 2 234.18 0.61 al iv s2p5 4f - s2p5 8h 2 208.93 0.61 al iv s2p5 4f - s2p5 9h 2 183.52 0.57 al iv s2p5 4f - s2p5 10h 2 161.31 0.53 al iv s2p5 4f - sp6 3d 2 -12372.75 -798.73 al iv s2p5 4f - sp6 4d 2 879.68 -550.13 al iv s2p5 4f - sp6 5d 2 -42.70 -393.04 al iv s2p5 4f - sp6 6d 2 -73.30 -296.67 al iv s2p5 4f - sp6 7d 2 -65.02 -233.74 al iv s2p5 4f - sp6 8d 2 -54.48 -190.22 al iv s2p5 4f - sp6 9d 2 -45.68 -158.68 al iv s2p5 4f - sp6 10d 2 -38.74 -134.98 al iv s2p5 5f - s2p5 6f 4 0.00 750.97 68.85 44.36 al iv s2p5 5f - s2p5 7f 4 0.00 574.84 57.64 37.15 al iv s2p5 5f - s2p5 8f 4 0.00 460.48 48.76 31.43 al iv s2p5 5f - s2p5 9f 4 0.00 380.50 41.78 26.93 al iv s2p5 5f - s2p5 10f 4 0.00 321.70 36.23 23.36 al iv s2p5 5f - s2p5 6h 2 -57.67 0.46 al iv s2p5 5f - s2p5 7h 2 7.39 0.54 al iv s2p5 5f - s2p5 8h 2 30.91 0.53 al iv s2p5 5f - s2p5 9h 2 38.82 0.50 al iv s2p5 5f - s2p5 10h 2 40.48 0.46 al iv s2p5 5f - sp6 3d 2 -8932.89 -726.04 al iv s2p5 5f - sp6 4d 2 -3011.71 -501.19 al iv s2p5 5f - sp6 5d 2 580.67 -358.41 al iv s2p5 5f - sp6 6d 2 11.84 -270.66 al iv s2p5 5f - sp6 7d 2 -32.86 -213.32 al iv s2p5 5f - sp6 8d 2 -38.22 -173.63 al iv s2p5 5f - sp6 9d 2 -36.09 -144.86 al iv s2p5 5f - sp6 10d 2 -32.51 -123.23 al iv s2p5 6f - s2p5 7f 4 0.00 475.53 48.40 31.21 al iv s2p5 6f - s2p5 8f 4 0.00 381.51 40.95 26.41 al iv s2p5 6f - s2p5 9f 4 0.00 315.66 35.08 22.63 al iv s2p5 6f - s2p5 10f 4 0.00 267.14 30.43 19.63 al iv s2p5 6f - s2p5 6h 2 -0.27 0.38 al iv s2p5 6f - s2p5 7h 2 -26.07 0.45 al iv s2p5 6f - s2p5 8h 2 -11.31 0.44 al iv s2p5 6f - s2p5 9h 2 -1.79 0.42 al iv s2p5 6f - s2p5 10h 2 3.46 0.38 al iv s2p5 6f - sp6 3d 2 -6770.37 -612.76 al iv s2p5 6f - sp6 4d 2 -2868.12 -423.49 al iv s2p5 6f - sp6 5d 2 -916.27 -303.00 al iv s2p5 6f - sp6 6d 2 370.25 -228.88 al iv s2p5 6f - sp6 7d 2 31.81 -180.41 al iv s2p5 6f - sp6 8d 2 -7.21 -146.86 al iv s2p5 6f - sp6 9d 2 -16.80 -122.53 al iv s2p5 6f - sp6 10d 2 -18.88 -104.25 al iv s2p5 7f - s2p5 8f 4 0.00 316.02 34.29 22.13 al iv s2p5 7f - s2p5 9f 4 0.00 261.63 29.38 18.96 al iv s2p5 7f - s2p5 10f 4 0.00 221.56 25.48 16.45 al iv s2p5 7f - s2p5 6h 2 0.52 0.32 al iv s2p5 7f - s2p5 7h 2 -0.28 0.37 al iv s2p5 7f - s2p5 8h 2 -12.22 0.37 al iv s2p5 7f - s2p5 9h 2 -8.79 0.35 al iv s2p5 7f - s2p5 10h 2 -5.32 0.32 al iv s2p5 7f - sp6 3d 2 -5353.15 -514.73 al iv s2p5 7f - sp6 4d 2 -2468.29 -355.99 al iv s2p5 7f - sp6 5d 2 -1045.59 -254.78 al iv s2p5 7f - sp6 6d 2 -315.03 -192.48 al iv s2p5 7f - sp6 7d 2 243.89 -151.74 al iv s2p5 7f - sp6 8d 2 35.65 -123.52 al iv s2p5 7f - sp6 9d 2 5.36 -103.07 al iv s2p5 7f - sp6 10d 2 -4.33 -87.69 al iv s2p5 8f - s2p5 9f 4 0.00 219.59 24.86 16.05 al iv s2p5 8f - s2p5 10f 4 0.00 186.00 21.56 13.92 al iv s2p5 8f - s2p5 6h 2 0.75 0.27 al iv s2p5 8f - s2p5 7h 2 0.30 0.31 al iv s2p5 8f - s2p5 8h 2 -0.25 0.31 al iv s2p5 8f - s2p5 9h 2 -6.17 0.29 al iv s2p5 8f - s2p5 10h 2 -5.54 0.27 al iv s2p5 8f - sp6 3d 2 -4369.65 -436.39 al iv s2p5 8f - sp6 4d 2 -2104.45 -301.95 al iv s2p5 8f - sp6 5d 2 -985.32 -216.15 al iv s2p5 8f - sp6 6d 2 -428.08 -163.31 al iv s2p5 8f - sp6 7d 2 -110.93 -128.75 al iv s2p5 8f - sp6 8d 2 167.22 -104.81 al iv s2p5 8f - sp6 9d 2 33.58 -87.46 al iv s2p5 8f - sp6 10d 2 10.78 -74.41 al iv s2p5 9f - s2p5 10f 4 0.00 158.41 18.48 11.93 al iv s2p5 9f - s2p5 6h 2 0.76 0.23 al iv s2p5 9f - s2p5 7h 2 0.54 0.27 al iv s2p5 9f - s2p5 8h 2 0.13 0.26 al iv s2p5 9f - s2p5 9h 2 -0.21 0.25 al iv s2p5 9f - s2p5 10h 2 -3.34 0.23 al iv s2p5 9f - sp6 3d 2 -3654.88 -374.44 al iv s2p5 9f - sp6 4d 2 -1806.76 -259.16 al iv s2p5 9f - sp6 5d 2 -890.00 -185.54 al iv s2p5 9f - sp6 6d 2 -436.18 -140.20 al iv s2p5 9f - sp6 7d 2 -188.88 -110.53 al iv s2p5 9f - sp6 8d 2 -33.90 -89.98 al iv s2p5 9f - sp6 9d 2 118.94 -75.09 al iv s2p5 9f - sp6 10d 2 29.74 -63.88 al iv s2p5 10f - s2p5 6h 2 0.70 0.20 al iv s2p5 10f - s2p5 7h 2 0.59 0.23 al iv s2p5 10f - s2p5 8h 2 0.33 0.23 al iv s2p5 10f - s2p5 9h 2 0.03 0.21 al iv s2p5 10f - s2p5 10h 2 -0.18 0.20 al iv s2p5 10f - sp6 3d 2 -3116.22 -325.08 al iv s2p5 10f - sp6 4d 2 -1567.16 -225.05 al iv s2p5 10f - sp6 5d 2 -795.74 -161.13 al iv s2p5 10f - sp6 6d 2 -413.95 -121.76 al iv s2p5 10f - sp6 7d 2 -208.23 -96.00 al iv s2p5 10f - sp6 8d 2 -86.22 -78.15 al iv s2p5 10f - sp6 9d 2 -3.21 -65.21 al iv s2p5 10f - sp6 10d 2 87.33 -55.49 al iv s2p5 6h - s2p5 7h 4 0.00 87.30 0.01 0.01 al iv s2p5 6h - s2p5 8h 4 0.00 61.40 0.01 0.01 al iv s2p5 6h - s2p5 9h 4 0.00 47.00 0.01 0.01 al iv s2p5 6h - s2p5 10h 4 0.00 37.80 0.01 0.00 al iv s2p5 6h - s2p5 8k 2 34.69 0.00 al iv s2p5 6h - s2p5 9k 2 34.53 0.00 al iv s2p5 6h - s2p5 10k 2 31.45 0.00 al iv s2p5 7h - s2p5 8h 4 0.00 67.39 0.01 0.01 al iv s2p5 7h - s2p5 9h 4 0.00 51.87 0.01 0.01 al iv s2p5 7h - s2p5 10h 4 0.00 41.88 0.01 0.01 al iv s2p5 7h - s2p5 8k 2 -7.57 0.00 al iv s2p5 7h - s2p5 9k 2 5.53 0.00 al iv s2p5 7h - s2p5 10k 2 10.20 0.00 al iv s2p5 8h - s2p5 9h 4 0.00 49.40 0.01 0.01 al iv s2p5 8h - s2p5 10h 4 0.00 40.00 0.01 0.01 al iv s2p5 8h - s2p5 8k 2 0.00 0.00 al iv s2p5 8h - s2p5 9k 2 -4.51 0.00 al iv s2p5 8h - s2p5 10k 2 -0.19 0.00 al iv s2p5 9h - s2p5 10h 4 0.00 36.53 0.01 0.01 al iv s2p5 9h - s2p5 8k 2 0.10 0.00 al iv s2p5 9h - s2p5 9k 2 0.00 0.00 al iv s2p5 9h - s2p5 10k 2 -2.59 0.00 al iv s2p5 10h - s2p5 8k 2 0.12 0.00 al iv s2p5 10h - s2p5 9k 2 0.09 0.00 al iv s2p5 10h - s2p5 10k 2 0.00 0.00 al iv s2p5 8k - s2p5 9k 4 0.00 13.81 0.00 0.00 al iv s2p5 8k - s2p5 10k 4 0.00 9.46 0.00 0.00 al iv s2p5 9k - s2p5 10k 4 0.00 12.13 0.00 0.00 al iv sp6 3s - sp6 4s 2 0.00 5369.73 al iv sp6 3s - sp6 5s 2 0.00 3474.46 al iv sp6 3s - sp6 6s 2 0.00 2491.17 al iv sp6 3s - sp6 7s 2 0.00 1901.41 al iv sp6 3s - sp6 8s 2 0.00 1513.97 al iv sp6 3s - sp6 9s 2 0.00 1242.98 al iv sp6 3s - sp6 10s 2 0.00 1044.51 al iv sp6 4s - sp6 5s 2 0.00 1856.10 al iv sp6 4s - sp6 6s 2 0.00 1332.28 al iv sp6 4s - sp6 7s 2 0.00 1017.51 al iv sp6 4s - sp6 8s 2 0.00 810.48 al iv sp6 4s - sp6 9s 2 0.00 665.58 al iv sp6 4s - sp6 10s 2 0.00 559.40 al iv sp6 5s - sp6 6s 2 0.00 865.14 al iv sp6 5s - sp6 7s 2 0.00 660.88 al iv sp6 5s - sp6 8s 2 0.00 526.49 al iv sp6 5s - sp6 9s 2 0.00 432.40 al iv sp6 5s - sp6 10s 2 0.00 363.45 al iv sp6 6s - sp6 7s 2 0.00 474.71 al iv sp6 6s - sp6 8s 2 0.00 378.20 al iv sp6 6s - sp6 9s 2 0.00 310.63 al iv sp6 6s - sp6 10s 2 0.00 261.10 al iv sp6 7s - sp6 8s 2 0.00 288.97 al iv sp6 7s - sp6 9s 2 0.00 237.34 al iv sp6 7s - sp6 10s 2 0.00 199.50 al iv sp6 8s - sp6 9s 2 0.00 189.11 al iv sp6 8s - sp6 10s 2 0.00 158.96 al iv sp6 9s - sp6 10s 2 0.00 130.56 al iv sp6 3d - sp6 4d 2 0.00 5297.80 al iv sp6 3d - sp6 5d 2 0.00 3842.56 al iv sp6 3d - sp6 6d 2 0.00 2923.51 al iv sp6 3d - sp6 7d 2 0.00 2314.28 al iv sp6 3d - sp6 8d 2 0.00 1888.97 al iv sp6 3d - sp6 9d 2 0.00 1579.00 al iv sp6 3d - sp6 10d 2 0.00 1345.13 al iv sp6 4d - sp6 5d 2 0.00 2754.45 al iv sp6 4d - sp6 6d 2 0.00 2097.64 al iv sp6 4d - sp6 7d 2 0.00 1661.44 al iv sp6 4d - sp6 8d 2 0.00 1356.59 al iv sp6 4d - sp6 9d 2 0.00 1134.25 al iv sp6 4d - sp6 10d 2 0.00 966.42 al iv sp6 5d - sp6 6d 2 0.00 1526.07 al iv sp6 5d - sp6 7d 2 0.00 1209.02 al iv sp6 5d - sp6 8d 2 0.00 987.34 al iv sp6 5d - sp6 9d 2 0.00 825.61 al iv sp6 5d - sp6 10d 2 0.00 703.50 al iv sp6 6d - sp6 7d 2 0.00 921.43 al iv sp6 6d - sp6 8d 2 0.00 752.54 al iv sp6 6d - sp6 9d 2 0.00 629.31 al iv sp6 6d - sp6 10d 2 0.00 536.25 al iv sp6 7d - sp6 8d 2 0.00 596.35 al iv sp6 7d - sp6 9d 2 0.00 498.71 al iv sp6 7d - sp6 10d 2 0.00 424.98 al iv sp6 8d - sp6 9d 2 0.00 407.34 al iv sp6 8d - sp6 10d 2 0.00 347.12 al iv sp6 9d - sp6 10d 2 0.00 290.30 al iv s2p5 3s 3 611812.30E 2338.99z 11630.74g al iv s2p5 4s 3 798017.48E 2353.54z 3385.82g al iv s2p5 5s 3 867028.38E 2357.28z 1442.80g al iv s2p5 6s 3 900341.46E 2358.66z 748.50g al iv s2p5 7s 3 918966.96E 2359.29z 438.34g al iv s2p5 8s 3 930433.17E 2359.61z 278.82g al iv s2p5 9s 3 937990.71E 2359.79z 188.34g al iv s2p5 10s 3 943234.57E 2359.91z 133.20g al iv s2p5 3d 6 757922.49E 2354.75z 5.58z 16026.09f 9259.96g 5223.72g al iv s2p5 4d 6 849207.33E 2357.50z 2.61z 6586.69f 4613.30g 2633.66g al iv s2p5 5d 6 890933.84E 2358.78z 1.37z 3242.12f 2417.18g 1387.31g al iv s2p5 6d 6 913421.46E 2359.37z 0.79z 1821.03f 1397.48g 804.34g al iv s2p5 7d 6 926897.48E 2359.68z 0.50z 1122.52f 875.30g 504.64g al iv s2p5 8d 6 935602.03E 2359.84z 0.34z 740.37f 583.01g 336.49g al iv s2p5 9d 6 941547.08E 2359.95z 0.23z 513.92f 407.32g 235.27g al iv s2p5 10d 6 945786.01E 2360.01z 0.17z 371.25f 295.58g 170.82g al iv s2p5 5g 6 893390.19E 2360.18z 0.20z 485.30f 0.96g 0.67g al iv s2p5 6g 6 914857.62E 2360.18z 0.11z 281.08f 1.03g 0.72g al iv s2p5 7g 6 927807.74E 2360.18z 0.07z 177.15f 0.86g 0.60g al iv s2p5 8g 6 936214.76E 2360.18z 0.05z 118.77f 0.68g 0.48g al iv s2p5 9g 6 941978.41E 2360.18z 0.03z 83.47f 0.53g 0.37g al iv s2p5 10g 6 946100.76E 2360.18z 0.02z 60.88f 0.42g 0.29g al iv s2p5 7i 6 927838.61E 2360.18z 0.02z 58.28f 0.00g 0.00g al iv s2p5 8i 6 936236.71E 2360.18z 0.02z 39.04f 0.00g 0.00g al iv s2p5 9i 6 941994.51E 2360.18z 0.01z 27.42f 0.00g 0.00g al iv s2p5 10i 6 946113.03E 2360.18z 0.01z 19.99f 0.00g 0.00g al iv sp6 3p 3 1054512.02E 263.20z 8743.64g al iv sp6 4p 3 1198564.91E 93.83z 2776.00g al iv sp6 5p 3 1255525.31E 43.65z 1236.56g al iv sp6 6p 3 1284117.20E 23.76z 658.85g al iv sp6 7p 3 1300521.07E 14.34z 392.90g al iv sp6 8p 3 1310806.99E 9.31z 253.24g al iv sp6 9p 3 1317680.44E 6.39z 172.82g al iv sp6 10p 3 1322500.29E 4.57z 123.20g al iv sp6 4f 3 1231506.54E 0.75z 77.94g al iv sp6 5f 3 1271279.05E 0.37z 64.11g al iv sp6 6f 3 1292885.60E 0.21z 45.58g al iv sp6 7f 3 1305904.54E 0.13z 32.13g al iv sp6 8f 3 1314349.24E 0.09z 23.08g al iv sp6 9f 3 1320135.55E 0.06z 16.98g al iv sp6 10f 3 1324272.44E 0.04z 12.80g al iv s2p5 3s - s2p5 4s 2 0.00 6240.32 al iv s2p5 3s - s2p5 5s 2 0.00 4055.69 al iv s2p5 3s - s2p5 6s 2 0.00 2913.88 al iv s2p5 3s - s2p5 7s 2 0.00 2226.55 al iv s2p5 3s - s2p5 8s 2 0.00 1774.06 al iv s2p5 3s - s2p5 9s 2 0.00 1457.15 al iv s2p5 3s - s2p5 10s 2 0.00 1224.85 al iv s2p5 3s - s2p5 3d 2 10647.61 -2199.30 al iv s2p5 3s - s2p5 4d 2 4852.90 -1909.78 al iv s2p5 3s - s2p5 5d 2 2788.44 -1498.58 al iv s2p5 3s - s2p5 6d 2 1848.00 -1186.04 al iv s2p5 3s - s2p5 7d 2 1339.26 -960.42 al iv s2p5 3s - s2p5 8d 2 1029.73 -795.19 al iv s2p5 3s - s2p5 9d 2 825.15 -671.12 al iv s2p5 3s - s2p5 10d 2 681.50 -575.60 al iv s2p5 3s - sp6 3p 2 47249.82 10088.49 al iv s2p5 3s - sp6 4p 2 19802.35 5639.62 al iv s2p5 3s - sp6 5p 2 12097.95 3735.93 al iv s2p5 3s - sp6 6p 2 8472.23 2714.36 al iv s2p5 3s - sp6 7p 2 6392.77 2089.98 al iv s2p5 3s - sp6 8p 2 5059.15 1674.68 al iv s2p5 3s - sp6 9p 2 4139.38 1381.56 al iv s2p5 3s - sp6 10p 2 3471.60 1165.40 al iv s2p5 4s - s2p5 5s 2 0.00 2208.79 al iv s2p5 4s - s2p5 6s 2 0.00 1589.73 al iv s2p5 4s - s2p5 7s 2 0.00 1215.91 al iv s2p5 4s - s2p5 8s 2 0.00 969.38 al iv s2p5 4s - s2p5 9s 2 0.00 796.52 al iv s2p5 4s - s2p5 10s 2 0.00 669.72 al iv s2p5 4s - s2p5 3d 2 3207.07 -946.11 al iv s2p5 4s - s2p5 4d 2 3160.95 -842.67 al iv s2p5 4s - s2p5 5d 2 2063.14 -667.92 al iv s2p5 4s - s2p5 6d 2 1461.82 -531.29 al iv s2p5 4s - s2p5 7d 2 1104.44 -431.47 al iv s2p5 4s - s2p5 8d 2 873.38 -357.89 al iv s2p5 4s - s2p5 9d 2 713.96 -302.42 al iv s2p5 4s - s2p5 10d 2 598.41 -259.60 al iv s2p5 4s - sp6 3p 2 14998.90 5417.98 al iv s2p5 4s - sp6 4p 2 16581.62 3064.61 al iv s2p5 4s - sp6 5p 2 9196.28 2039.59 al iv s2p5 4s - sp6 6p 2 6305.85 1485.33 al iv s2p5 4s - sp6 7p 2 4716.64 1145.19 al iv s2p5 4s - sp6 8p 2 3715.64 918.40 al iv s2p5 4s - sp6 9p 2 3031.90 758.08 al iv s2p5 4s - sp6 10p 2 2538.39 639.72 al iv s2p5 5s - s2p5 6s 2 0.00 1039.05 al iv s2p5 5s - s2p5 7s 2 0.00 794.99 al iv s2p5 5s - s2p5 8s 2 0.00 633.93 al iv s2p5 5s - s2p5 9s 2 0.00 520.96 al iv s2p5 5s - s2p5 10s 2 0.00 438.07 al iv s2p5 5s - s2p5 3d 2 1908.31 -563.28 al iv s2p5 5s - s2p5 4d 2 1537.52 -507.58 al iv s2p5 5s - s2p5 5d 2 1339.11 -404.10 al iv s2p5 5s - s2p5 6d 2 992.94 -322.13 al iv s2p5 5s - s2p5 7d 2 766.26 -261.93 al iv s2p5 5s - s2p5 8d 2 613.45 -217.43 al iv s2p5 5s - s2p5 9d 2 505.48 -183.83 al iv s2p5 5s - s2p5 10d 2 426.01 -157.86 al iv s2p5 5s - sp6 3p 2 8937.31 3522.25 al iv s2p5 5s - sp6 4p 2 7250.47 2000.30 al iv s2p5 5s - sp6 5p 2 7595.58 1333.37 al iv s2p5 5s - sp6 6p 2 4850.00 971.80 al iv s2p5 5s - sp6 7p 2 3569.37 749.61 al iv s2p5 5s - sp6 8p 2 2792.16 601.33 al iv s2p5 5s - sp6 9p 2 2269.67 496.45 al iv s2p5 5s - sp6 10p 2 1895.78 419.00 al iv s2p5 6s - s2p5 7s 2 0.00 572.77 al iv s2p5 6s - s2p5 8s 2 0.00 456.78 al iv s2p5 6s - s2p5 9s 2 0.00 375.40 al iv s2p5 6s - s2p5 10s 2 0.00 315.68 al iv s2p5 6s - s2p5 3d 2 1320.30 -387.27 al iv s2p5 6s - s2p5 4d 2 1046.05 -351.16 al iv s2p5 6s - s2p5 5d 2 813.21 -280.21 al iv s2p5 6s - s2p5 6d 2 693.04 -223.62 al iv s2p5 6s - s2p5 7d 2 547.66 -181.95 al iv s2p5 6s - s2p5 8d 2 443.37 -151.10 al iv s2p5 6s - s2p5 9d 2 367.72 -127.78 al iv s2p5 6s - s2p5 10d 2 311.23 -109.75 al iv s2p5 6s - sp6 3p 2 6192.82 2530.95 al iv s2p5 6s - sp6 4p 2 4830.49 1440.03 al iv s2p5 6s - sp6 5p 2 3968.29 960.62 al iv s2p5 6s - sp6 6p 2 4084.19 700.39 al iv s2p5 6s - sp6 7p 2 2841.99 540.37 al iv s2p5 6s - sp6 8p 2 2194.67 433.54 al iv s2p5 6s - sp6 9p 2 1773.85 357.96 al iv s2p5 6s - sp6 10p 2 1476.96 302.13 al iv s2p5 7s - s2p5 8s 2 0.00 349.59 al iv s2p5 7s - s2p5 9s 2 0.00 287.32 al iv s2p5 7s - s2p5 10s 2 0.00 241.62 al iv s2p5 7s - s2p5 3d 2 989.07 -288.55 al iv s2p5 7s - s2p5 4d 2 778.41 -262.61 al iv s2p5 7s - s2p5 5d 2 598.63 -209.84 al iv s2p5 7s - s2p5 6d 2 476.00 -167.57 al iv s2p5 7s - s2p5 7d 2 406.32 -136.40 al iv s2p5 7s - s2p5 8d 2 333.60 -113.30 al iv s2p5 7s - s2p5 9d 2 278.57 -95.83 al iv s2p5 7s - s2p5 10d 2 236.73 -82.31 al iv s2p5 7s - sp6 3p 2 4642.99 1934.08 al iv s2p5 7s - sp6 4p 2 3564.10 1101.56 al iv s2p5 7s - sp6 5p 2 2839.11 735.13 al iv s2p5 7s - sp6 6p 2 2391.48 536.10 al iv s2p5 7s - sp6 7p 2 2441.51 413.66 al iv s2p5 7s - sp6 8p 2 1800.62 331.91 al iv s2p5 7s - sp6 9p 2 1439.97 274.06 al iv s2p5 7s - sp6 10p 2 1193.29 231.32 al iv s2p5 8s - s2p5 9s 2 0.00 229.16 al iv s2p5 8s - s2p5 10s 2 0.00 192.71 al iv s2p5 8s - s2p5 3d 2 778.80 -226.31 al iv s2p5 8s - s2p5 4d 2 610.88 -206.45 al iv s2p5 8s - s2p5 5d 2 467.61 -165.11 al iv s2p5 8s - s2p5 6d 2 369.18 -131.91 al iv s2p5 8s - s2p5 7d 2 301.23 -107.39 al iv s2p5 8s - s2p5 8d 2 259.21 -89.22 al iv s2p5 8s - s2p5 9d 2 218.41 -75.47 al iv s2p5 8s - s2p5 10d 2 186.44 -64.83 al iv s2p5 8s - sp6 3p 2 3657.66 1541.09 al iv s2p5 8s - sp6 4p 2 2784.28 878.29 al iv s2p5 8s - sp6 5p 2 2189.50 586.28 al iv s2p5 8s - sp6 6p 2 1798.16 427.60 al iv s2p5 8s - sp6 7p 2 1548.04 329.96 al iv s2p5 8s - sp6 8p 2 1573.33 264.76 al iv s2p5 8s - sp6 9p 2 1210.10 218.62 al iv s2p5 8s - sp6 10p 2 993.80 184.54 al iv s2p5 9s - s2p5 10s 2 0.00 158.39 al iv s2p5 9s - s2p5 3d 2 634.77 -183.94 al iv s2p5 9s - s2p5 4d 2 496.95 -168.07 al iv s2p5 9s - s2p5 5d 2 379.46 -134.48 al iv s2p5 9s - s2p5 6d 2 298.61 -107.47 al iv s2p5 9s - s2p5 7d 2 242.47 -87.51 al iv s2p5 9s - s2p5 8d 2 202.30 -72.71 al iv s2p5 9s - s2p5 9d 2 175.75 -61.51 al iv s2p5 9s - s2p5 10d 2 150.93 -52.84 al iv s2p5 9s - sp6 3p 2 2982.16 1265.83 al iv s2p5 9s - sp6 4p 2 2258.73 721.71 al iv s2p5 9s - sp6 5p 2 1763.95 481.84 al iv s2p5 9s - sp6 6p 2 1433.12 351.46 al iv s2p5 9s - sp6 7p 2 1207.54 271.22 al iv s2p5 9s - sp6 8p 2 1058.01 217.63 al iv s2p5 9s - sp6 9p 2 1072.24 179.71 al iv s2p5 9s - sp6 10p 2 851.33 151.69 al iv s2p5 10s - s2p5 3d 2 530.73 -153.48 al iv s2p5 10s - s2p5 4d 2 415.01 -140.40 al iv s2p5 10s - s2p5 5d 2 316.42 -112.39 al iv s2p5 10s - s2p5 6d 2 248.56 -89.83 al iv s2p5 10s - s2p5 7d 2 201.36 -73.16 al iv s2p5 10s - s2p5 8d 2 167.42 -60.79 al iv s2p5 10s - s2p5 9d 2 142.28 -51.42 al iv s2p5 10s - s2p5 10d 2 124.78 -44.18 al iv s2p5 10s - sp6 3p 2 2493.97 1064.05 al iv s2p5 10s - sp6 4p 2 1882.82 606.84 al iv s2p5 10s - sp6 5p 2 1464.17 405.20 al iv s2p5 10s - sp6 6p 2 1182.57 295.57 al iv s2p5 10s - sp6 7p 2 987.23 228.10 al iv s2p5 10s - sp6 8p 2 848.99 183.04 al iv s2p5 10s - sp6 9p 2 754.46 151.14 al iv s2p5 10s - sp6 10p 2 763.12 127.58 al iv s2p5 3d - s2p5 4d 4 0.00 8859.24 6519.32 3697.06 al iv s2p5 3d - s2p5 5d 4 0.00 5885.70 4706.79 2674.09 al iv s2p5 3d - s2p5 6d 4 0.00 4290.15 3572.83 2031.54 al iv s2p5 3d - s2p5 7d 4 0.00 3314.08 2824.51 1606.76 al iv s2p5 3d - s2p5 8d 4 0.00 2663.74 2303.48 1310.71 al iv s2p5 3d - s2p5 9d 4 0.00 2203.71 1924.39 1095.19 al iv s2p5 3d - s2p5 10d 4 0.00 1863.61 1638.69 932.71 al iv s2p5 3d - s2p5 5g 2 847.32 52.01 al iv s2p5 3d - s2p5 6g 2 803.01 54.31 al iv s2p5 3d - s2p5 7g 2 701.41 50.08 al iv s2p5 3d - s2p5 8g 2 605.43 44.72 al iv s2p5 3d - s2p5 9g 2 524.54 39.64 al iv s2p5 3d - s2p5 10g 2 458.03 35.18 al iv s2p5 3d - sp6 3p 2 27746.18 -1969.93 al iv s2p5 3d - sp6 4p 2 7207.96 -597.07 al iv s2p5 3d - sp6 5p 2 4281.14 -268.23 al iv s2p5 3d - sp6 6p 2 2963.89 -148.86 al iv s2p5 3d - sp6 7p 2 2223.64 -94.31 al iv s2p5 3d - sp6 8p 2 1753.87 -65.36 al iv s2p5 3d - sp6 9p 2 1431.88 -48.27 al iv s2p5 3d - sp6 10p 2 1199.04 -37.37 al iv s2p5 3d - sp6 4f 2 -12377.06 -604.11 al iv s2p5 3d - sp6 5f 2 -8937.04 -551.92 al iv s2p5 3d - sp6 6f 2 -6773.98 -467.02 al iv s2p5 3d - sp6 7f 2 -5356.20 -392.91 al iv s2p5 3d - sp6 8f 2 -4372.21 -333.44 al iv s2p5 3d - sp6 9f 2 -3657.05 -286.30 al iv s2p5 3d - sp6 10f 2 -3118.07 -248.68 al iv s2p5 4d - s2p5 5d 4 0.00 4384.46 3337.82 1910.30 al iv s2p5 4d - s2p5 6d 4 0.00 3210.42 2536.45 1453.40 al iv s2p5 4d - s2p5 7d 4 0.00 2487.02 2006.48 1150.50 al iv s2p5 4d - s2p5 8d 4 0.00 2002.64 1637.01 939.03 al iv s2p5 4d - s2p5 9d 4 0.00 1658.86 1367.97 784.92 al iv s2p5 4d - s2p5 10d 4 0.00 1404.11 1165.11 668.65 al iv s2p5 4d - s2p5 5g 2 -290.78 34.05 al iv s2p5 4d - s2p5 6g 2 -110.99 35.62 al iv s2p5 4d - s2p5 7g 2 -34.12 32.88 al iv s2p5 4d - s2p5 8g 2 0.25 29.38 al iv s2p5 4d - s2p5 9g 2 16.13 26.06 al iv s2p5 4d - s2p5 10g 2 23.38 23.13 al iv s2p5 4d - sp6 3p 2 10260.28 -1694.89 al iv s2p5 4d - sp6 4p 2 10606.04 -582.67 al iv s2p5 4d - sp6 5p 2 4064.10 -293.67 al iv s2p5 4d - sp6 6p 2 2705.81 -179.96 al iv s2p5 4d - sp6 7p 2 1997.33 -123.83 al iv s2p5 4d - sp6 8p 2 1562.16 -91.81 al iv s2p5 4d - sp6 9p 2 1269.04 -71.64 al iv s2p5 4d - sp6 10p 2 1059.30 -58.00 al iv s2p5 4d - sp6 4f 2 869.59 -414.15 al iv s2p5 4d - sp6 5f 2 -3021.54 -379.30 al iv s2p5 4d - sp6 6f 2 -2876.02 -321.36 al iv s2p5 4d - sp6 7f 2 -2474.77 -270.57 al iv s2p5 4d - sp6 8f 2 -2109.87 -229.74 al iv s2p5 4d - sp6 9f 2 -1811.37 -197.32 al iv s2p5 4d - sp6 10f 2 -1571.14 -171.43 al iv s2p5 5d - s2p5 6d 4 0.00 2369.24 1837.70 1056.17 al iv s2p5 5d - s2p5 7d 4 0.00 1837.73 1454.12 836.37 al iv s2p5 5d - s2p5 8d 4 0.00 1481.28 1186.57 682.80 al iv s2p5 5d - s2p5 9d 4 0.00 1227.87 991.68 570.84 al iv s2p5 5d - s2p5 10d 4 0.00 1039.84 844.68 486.33 al iv s2p5 5d - s2p5 5g 2 -19.26 23.77 al iv s2p5 5d - s2p5 6g 2 -110.35 24.89 al iv s2p5 5d - s2p5 7g 2 -84.19 22.99 al iv s2p5 5d - s2p5 8g 2 -61.15 20.55 al iv s2p5 5d - s2p5 9g 2 -45.38 18.22 al iv s2p5 5d - s2p5 10g 2 -34.72 16.18 al iv s2p5 5d - sp6 3p 2 5467.73 -1326.26 al iv s2p5 5d - sp6 4p 2 5777.24 -475.41 al iv s2p5 5d - sp6 5p 2 5073.15 -247.54 al iv s2p5 5d - sp6 6p 2 2381.23 -155.46 al iv s2p5 5d - sp6 7p 2 1701.73 -108.93 al iv s2p5 5d - sp6 8p 2 1312.41 -81.87 al iv s2p5 5d - sp6 9p 2 1058.11 -64.55 al iv s2p5 5d - sp6 10p 2 879.15 -52.68 al iv s2p5 5d - sp6 4f 2 -47.57 -295.19 al iv s2p5 5d - sp6 5f 2 573.96 -270.64 al iv s2p5 5d - sp6 6f 2 -922.91 -229.43 al iv s2p5 5d - sp6 7f 2 -1051.19 -193.24 al iv s2p5 5d - sp6 8f 2 -990.07 -164.11 al iv s2p5 5d - sp6 9f 2 -894.06 -140.97 al iv s2p5 5d - sp6 10f 2 -799.27 -122.49 al iv s2p5 6d - s2p5 7d 4 0.00 1409.57 1105.94 637.07 al iv s2p5 6d - s2p5 8d 4 0.00 1136.57 902.53 520.17 al iv s2p5 6d - s2p5 9d 4 0.00 942.49 754.34 434.91 al iv s2p5 6d - s2p5 10d 4 0.00 798.42 642.55 370.55 al iv s2p5 6d - s2p5 5g 2 -13.70 17.73 al iv s2p5 6d - s2p5 6g 2 -15.75 18.56 al iv s2p5 6d - s2p5 7g 2 -48.63 17.15 al iv s2p5 6d - s2p5 8g 2 -45.25 15.33 al iv s2p5 6d - s2p5 9g 2 -38.41 13.60 al iv s2p5 6d - s2p5 10g 2 -32.27 12.07 al iv s2p5 6d - sp6 3p 2 3484.73 -1048.34 al iv s2p5 6d - sp6 4p 2 3821.45 -383.20 al iv s2p5 6d - sp6 5p 2 3255.62 -202.42 al iv s2p5 6d - sp6 6p 2 2798.54 -128.46 al iv s2p5 6d - sp6 7p 2 1494.48 -90.69 al iv s2p5 6d - sp6 8p 2 1121.89 -68.53 al iv s2p5 6d - sp6 9p 2 893.74 -54.25 al iv s2p5 6d - sp6 10p 2 737.70 -44.41 al iv s2p5 6d - sp6 4f 2 -76.57 -222.51 al iv s2p5 6d - sp6 5f 2 8.11 -204.11 al iv s2p5 6d - sp6 6f 2 366.04 -173.09 al iv s2p5 6d - sp6 7f 2 -319.22 -145.81 al iv s2p5 6d - sp6 8f 2 -431.71 -123.84 al iv s2p5 6d - sp6 9f 2 -439.33 -106.39 al iv s2p5 6d - sp6 10f 2 -416.71 -92.45 al iv s2p5 7d - s2p5 8d 4 0.00 903.62 714.34 412.07 al iv s2p5 7d - s2p5 9d 4 0.00 749.37 597.07 344.55 al iv s2p5 7d - s2p5 10d 4 0.00 634.92 508.60 293.57 al iv s2p5 7d - s2p5 5g 2 -9.62 13.86 al iv s2p5 7d - s2p5 6g 2 -11.99 14.52 al iv s2p5 7d - s2p5 7g 2 -11.76 13.42 al iv s2p5 7d - s2p5 8g 2 -25.00 12.00 al iv s2p5 7d - s2p5 9g 2 -25.12 10.64 al iv s2p5 7d - s2p5 10g 2 -22.87 9.45 al iv s2p5 7d - sp6 3p 2 2466.52 -848.33 al iv s2p5 7d - sp6 4p 2 2784.64 -313.47 al iv s2p5 7d - sp6 5p 2 2367.04 -166.88 al iv s2p5 7d - sp6 6p 2 1971.59 -106.49 al iv s2p5 7d - sp6 7p 2 1701.45 -75.48 al iv s2p5 7d - sp6 8p 2 994.56 -57.20 al iv s2p5 7d - sp6 9p 2 774.32 -45.38 al iv s2p5 7d - sp6 10p 2 632.56 -37.20 al iv s2p5 7d - sp6 4f 2 -67.41 -175.16 al iv s2p5 7d - sp6 5f 2 -35.53 -160.73 al iv s2p5 7d - sp6 6f 2 29.20 -136.32 al iv s2p5 7d - sp6 7f 2 241.15 -114.85 al iv s2p5 7d - sp6 8f 2 -113.65 -97.55 al iv s2p5 7d - sp6 9f 2 -191.29 -83.81 al iv s2p5 7d - sp6 10f 2 -210.36 -72.83 al iv s2p5 8d - s2p5 9d 4 0.00 613.22 487.31 281.36 al iv s2p5 8d - s2p5 10d 4 0.00 519.55 415.11 239.74 al iv s2p5 8d - s2p5 5g 2 -7.31 11.23 al iv s2p5 8d - s2p5 6g 2 -8.94 11.76 al iv s2p5 8d - s2p5 7g 2 -9.37 10.87 al iv s2p5 8d - s2p5 8g 2 -8.71 9.72 al iv s2p5 8d - s2p5 9g 2 -14.52 8.62 al iv s2p5 8d - s2p5 10g 2 -14.98 7.66 al iv s2p5 8d - sp6 3p 2 1867.19 -702.09 al iv s2p5 8d - sp6 4p 2 2154.41 -261.17 al iv s2p5 8d - sp6 5p 2 1833.04 -139.70 al iv s2p5 8d - sp6 6p 2 1517.78 -89.44 al iv s2p5 8d - sp6 7p 2 1273.67 -63.54 al iv s2p5 8d - sp6 8p 2 1109.66 -48.24 al iv s2p5 8d - sp6 9p 2 693.72 -38.31 al iv s2p5 8d - sp6 10p 2 555.54 -31.44 al iv s2p5 8d - sp6 4f 2 -56.33 -142.46 al iv s2p5 8d - sp6 5f 2 -40.26 -130.75 al iv s2p5 8d - sp6 6f 2 -9.17 -110.91 al iv s2p5 8d - sp6 7f 2 33.81 -93.44 al iv s2p5 8d - sp6 8f 2 165.35 -79.37 al iv s2p5 8d - sp6 9f 2 -35.76 -68.20 al iv s2p5 8d - sp6 10f 2 -87.89 -59.26 al iv s2p5 9d - s2p5 10d 4 0.00 435.00 346.98 200.47 al iv s2p5 9d - s2p5 5g 2 -5.85 9.34 al iv s2p5 9d - s2p5 6g 2 -7.04 9.78 al iv s2p5 9d - s2p5 7g 2 -7.32 9.04 al iv s2p5 9d - s2p5 8g 2 -7.18 8.08 al iv s2p5 9d - s2p5 9g 2 -6.52 7.17 al iv s2p5 9d - s2p5 10g 2 -9.25 6.37 al iv s2p5 9d - sp6 3p 2 1480.03 -592.38 al iv s2p5 9d - sp6 4p 2 1735.98 -221.34 al iv s2p5 9d - sp6 5p 2 1479.10 -118.76 al iv s2p5 9d - sp6 6p 2 1222.25 -76.20 al iv s2p5 9d - sp6 7p 2 1019.60 -54.22 al iv s2p5 9d - sp6 8p 2 866.92 -41.20 al iv s2p5 9d - sp6 9p 2 763.04 -32.75 al iv s2p5 9d - sp6 10p 2 502.52 -26.89 al iv s2p5 9d - sp6 4f 2 -47.16 -118.79 al iv s2p5 9d - sp6 5f 2 -37.72 -109.04 al iv s2p5 9d - sp6 6f 2 -18.36 -92.50 al iv s2p5 9d - sp6 7f 2 3.92 -77.94 al iv s2p5 9d - sp6 8f 2 32.26 -66.21 al iv s2p5 9d - sp6 9f 2 117.61 -56.88 al iv s2p5 9d - sp6 10f 2 -4.53 -49.43 al iv s2p5 10d - s2p5 5g 2 -4.84 7.92 al iv s2p5 10d - s2p5 6g 2 -5.77 8.30 al iv s2p5 10d - s2p5 7g 2 -5.94 7.67 al iv s2p5 10d - s2p5 8g 2 -5.80 6.86 al iv s2p5 10d - s2p5 9g 2 -5.51 6.09 al iv s2p5 10d - s2p5 10g 2 -4.97 5.40 al iv s2p5 10d - sp6 3p 2 1212.69 -507.97 al iv s2p5 10d - sp6 4p 2 1440.47 -190.39 al iv s2p5 10d - sp6 5p 2 1228.95 -102.38 al iv s2p5 10d - sp6 6p 2 1014.70 -65.79 al iv s2p5 10d - sp6 7p 2 844.46 -46.86 al iv s2p5 10d - sp6 8p 2 714.17 -35.64 al iv s2p5 10d - sp6 9p 2 615.34 -28.34 al iv s2p5 10d - sp6 10p 2 546.83 -23.28 al iv s2p5 10d - sp6 4f 2 -39.96 -101.02 al iv s2p5 10d - sp6 5f 2 -33.85 -92.74 al iv s2p5 10d - sp6 6f 2 -20.16 -78.67 al iv s2p5 10d - sp6 7f 2 -5.50 -66.29 al iv s2p5 10d - sp6 8f 2 9.71 -56.31 al iv s2p5 10d - sp6 9f 2 28.76 -48.38 al iv s2p5 10d - sp6 10f 2 86.35 -42.05 al iv s2p5 5g - s2p5 6g 4 0.00 281.29 0.99 0.69 al iv s2p5 5g - s2p5 7g 4 0.00 199.02 0.91 0.63 al iv s2p5 5g - s2p5 8g 4 0.00 152.62 0.81 0.56 al iv s2p5 5g - s2p5 9g 4 0.00 122.71 0.72 0.50 al iv s2p5 5g - s2p5 10g 4 0.00 101.85 0.63 0.44 al iv s2p5 5g - s2p5 7i 2 84.40 0.00 al iv s2p5 5g - s2p5 8i 2 83.47 0.00 al iv s2p5 5g - s2p5 9i 2 75.54 0.01 al iv s2p5 5g - s2p5 10i 2 67.16 0.01 al iv s2p5 5g - sp6 4f 2 -4515.45 -8.13 al iv s2p5 5g - sp6 5f 2 16.75 -7.27 al iv s2p5 5g - sp6 6f 2 -143.41 -6.08 al iv s2p5 5g - sp6 7f 2 -116.25 -5.08 al iv s2p5 5g - sp6 8f 2 -92.59 -4.29 al iv s2p5 5g - sp6 9f 2 -75.48 -3.68 al iv s2p5 5g - sp6 10f 2 -62.98 -3.19 al iv s2p5 6g - s2p5 7g 4 0.00 197.62 0.94 0.66 al iv s2p5 6g - s2p5 8g 4 0.00 152.19 0.84 0.58 al iv s2p5 6g - s2p5 9g 4 0.00 122.74 0.74 0.52 al iv s2p5 6g - s2p5 10g 4 0.00 102.09 0.65 0.46 al iv s2p5 6g - s2p5 7i 2 -19.13 0.00 al iv s2p5 6g - s2p5 8i 2 8.43 0.01 al iv s2p5 6g - s2p5 9i 2 18.32 0.01 al iv s2p5 6g - s2p5 10i 2 21.51 0.01 al iv s2p5 6g - sp6 4f 2 -3195.26 -8.45 al iv s2p5 6g - sp6 5f 2 -1685.47 -7.56 al iv s2p5 6g - sp6 6f 2 16.05 -6.33 al iv s2p5 6g - sp6 7f 2 -108.02 -5.29 al iv s2p5 6g - sp6 8f 2 -96.03 -4.47 al iv s2p5 6g - sp6 9f 2 -80.79 -3.83 al iv s2p5 6g - sp6 10f 2 -68.33 -3.32 al iv s2p5 7g - s2p5 8g 4 0.00 135.62 0.77 0.53 al iv s2p5 7g - s2p5 9g 4 0.00 109.59 0.68 0.47 al iv s2p5 7g - s2p5 10g 4 0.00 91.31 0.60 0.42 al iv s2p5 7g - s2p5 7i 2 0.00 0.00 al iv s2p5 7g - s2p5 8i 2 -10.10 0.00 al iv s2p5 7g - s2p5 9i 2 -2.33 0.00 al iv s2p5 7g - s2p5 10i 2 2.46 0.00 al iv s2p5 7g - sp6 4f 2 -2416.90 -7.77 al iv s2p5 7g - sp6 5f 2 -1510.39 -6.96 al iv s2p5 7g - sp6 6f 2 -754.96 -5.82 al iv s2p5 7g - sp6 7f 2 13.21 -4.87 al iv s2p5 7g - sp6 8f 2 -74.55 -4.11 al iv s2p5 7g - sp6 9f 2 -70.88 -3.52 al iv s2p5 7g - sp6 10f 2 -62.20 -3.05 al iv s2p5 8g - s2p5 9g 4 0.00 95.50 0.60 0.42 al iv s2p5 8g - s2p5 10g 4 0.00 79.64 0.53 0.37 al iv s2p5 8g - s2p5 7i 2 0.26 0.00 al iv s2p5 8g - s2p5 8i 2 0.00 0.00 al iv s2p5 8g - s2p5 9i 2 -5.28 0.00 al iv s2p5 8g - s2p5 10i 2 -2.99 0.00 al iv s2p5 8g - sp6 4f 2 -1917.59 -6.93 al iv s2p5 8g - sp6 5f 2 -1277.36 -6.20 al iv s2p5 8g - sp6 6f 2 -757.86 -5.19 al iv s2p5 8g - sp6 7f 2 -383.18 -4.34 al iv s2p5 8g - sp6 8f 2 10.48 -3.67 al iv s2p5 8g - sp6 9f 2 -51.18 -3.14 al iv s2p5 8g - sp6 10f 2 -51.27 -2.72 al iv s2p5 9g - s2p5 10g 4 0.00 69.33 0.47 0.33 al iv s2p5 9g - s2p5 7i 2 0.32 0.00 al iv s2p5 9g - s2p5 8i 2 0.21 0.00 al iv s2p5 9g - s2p5 9i 2 0.00 0.00 al iv s2p5 9g - s2p5 10i 2 -2.88 0.00 al iv s2p5 9g - sp6 4f 2 -1573.47 -6.13 al iv s2p5 9g - sp6 5f 2 -1083.30 -5.49 al iv s2p5 9g - sp6 6f 2 -685.73 -4.60 al iv s2p5 9g - sp6 7f 2 -412.26 -3.84 al iv s2p5 9g - sp6 8f 2 -212.99 -3.25 al iv s2p5 9g - sp6 9f 2 8.28 -2.78 al iv s2p5 9g - sp6 10f 2 -35.64 -2.41 al iv s2p5 10g - s2p5 7i 2 0.32 0.00 al iv s2p5 10g - s2p5 8i 2 0.29 0.00 al iv s2p5 10g - s2p5 9i 2 0.15 0.00 al iv s2p5 10g - s2p5 10i 2 0.00 0.00 al iv s2p5 10g - sp6 4f 2 -1323.53 -5.44 al iv s2p5 10g - sp6 5f 2 -929.51 -4.87 al iv s2p5 10g - sp6 6f 2 -608.53 -4.08 al iv s2p5 10g - sp6 7f 2 -390.58 -3.41 al iv s2p5 10g - sp6 8f 2 -240.38 -2.88 al iv s2p5 10g - sp6 9f 2 -126.85 -2.47 al iv s2p5 10g - sp6 10f 2 6.57 -2.14 al iv s2p5 7i - s2p5 8i 4 0.00 32.51 0.00 0.00 al iv s2p5 7i - s2p5 9i 4 0.00 22.60 0.00 0.00 al iv s2p5 7i - s2p5 10i 4 0.00 17.18 0.00 0.00 al iv s2p5 8i - s2p5 9i 4 0.00 26.97 0.00 0.00 al iv s2p5 8i - s2p5 10i 4 0.00 20.64 0.00 0.00 al iv s2p5 9i - s2p5 10i 4 0.00 20.84 0.00 0.00 al iv sp6 3p - sp6 4p 2 0.00 4887.49 al iv sp6 3p - sp6 5p 2 0.00 3237.86 al iv sp6 3p - sp6 6p 2 0.00 2352.56 al iv sp6 3p - sp6 7p 2 0.00 1811.45 al iv sp6 3p - sp6 8p 2 0.00 1451.51 al iv sp6 3p - sp6 9p 2 0.00 1197.46 al iv sp6 3p - sp6 10p 2 0.00 1010.11 al iv sp6 4p - sp6 5p 2 0.00 1850.52 al iv sp6 4p - sp6 6p 2 0.00 1348.74 al iv sp6 4p - sp6 7p 2 0.00 1040.37 al iv sp6 4p - sp6 8p 2 0.00 834.58 al iv sp6 4p - sp6 9p 2 0.00 689.03 al iv sp6 4p - sp6 10p 2 0.00 581.53 al iv sp6 5p - sp6 6p 2 0.00 902.34 al iv sp6 5p - sp6 7p 2 0.00 696.51 al iv sp6 5p - sp6 8p 2 0.00 558.98 al iv sp6 5p - sp6 9p 2 0.00 461.62 al iv sp6 5p - sp6 10p 2 0.00 389.68 al iv sp6 6p - sp6 7p 2 0.00 508.73 al iv sp6 6p - sp6 8p 2 0.00 408.37 al iv sp6 6p - sp6 9p 2 0.00 337.29 al iv sp6 6p - sp6 10p 2 0.00 284.76 al iv sp6 7p - sp6 8p 2 0.00 315.42 al iv sp6 7p - sp6 9p 2 0.00 260.55 al iv sp6 7p - sp6 10p 2 0.00 219.98 al iv sp6 8p - sp6 9p 2 0.00 209.20 al iv sp6 8p - sp6 10p 2 0.00 176.63 al iv sp6 9p - sp6 10p 2 0.00 145.92 al iv sp6 4f - sp6 5f 2 0.00 70.66 al iv sp6 4f - sp6 6f 2 0.00 59.55 al iv sp6 4f - sp6 7f 2 0.00 49.97 al iv sp6 4f - sp6 8f 2 0.00 42.34 al iv sp6 4f - sp6 9f 2 0.00 36.32 al iv sp6 4f - sp6 10f 2 0.00 31.52 al iv sp6 5f - sp6 6f 2 0.00 54.05 al iv sp6 5f - sp6 7f 2 0.00 45.37 al iv sp6 5f - sp6 8f 2 0.00 38.45 al iv sp6 5f - sp6 9f 2 0.00 32.98 al iv sp6 5f - sp6 10f 2 0.00 28.63 al iv sp6 6f - sp6 7f 2 0.00 38.26 al iv sp6 6f - sp6 8f 2 0.00 32.43 al iv sp6 6f - sp6 9f 2 0.00 27.82 al iv sp6 6f - sp6 10f 2 0.00 24.14 al iv sp6 7f - sp6 8f 2 0.00 27.23 al iv sp6 7f - sp6 9f 2 0.00 23.36 al iv sp6 7f - sp6 10f 2 0.00 20.27 al iv sp6 8f - sp6 9f 2 0.00 19.80 al iv sp6 8f - sp6 10f 2 0.00 17.18 al iv sp6 9f - sp6 10f 2 0.00 14.74