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mirror of https://github.com/pfloos/quack synced 2024-12-23 04:43:42 +01:00
QuAcK/basis/uncontracted_2_partridge
2020-01-17 13:57:03 +01:00

2586 lines
69 KiB
Plaintext

LITHIUM
S 1
1 108401.4000000 1.0000000
S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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BERYLLIUM
S 1
1 126512.3000000 1.0000000
S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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BORON
S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
1 0.0801320 1.0000000
P 1
1 0.0374420 1.0000000
CARBON
S 1
1 312229.0000000 1.0000000
S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
1 2.5435940 1.0000000
P 1
1 1.1737790 1.0000000
P 1
1 0.5536750 1.0000000
P 1
1 0.2621730 1.0000000
P 1
1 0.1236170 1.0000000
P 1
1 0.0566710 1.0000000
NITROGEN
S 1
1 432381.1000000 1.0000000
S 1
1 64743.4200000 1.0000000
S 1
1 14733.7000000 1.0000000
S 1
1 4173.2540000 1.0000000
S 1
1 1361.4770000 1.0000000
S 1
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S 1
1 191.6857000 1.0000000
S 1
1 79.4549900 1.0000000
S 1
1 34.5496800 1.0000000
S 1
1 15.5867300 1.0000000
S 1
1 7.2354440 1.0000000
S 1
1 3.3837390 1.0000000
S 1
1 1.3697280 1.0000000
S 1
1 0.6250890 1.0000000
S 1
1 0.2748190 1.0000000
S 1
1 0.1192090 1.0000000
P 1
1 673.5556000 1.0000000
P 1
1 159.5845000 1.0000000
P 1
1 51.8017000 1.0000000
P 1
1 19.6734300 1.0000000
P 1
1 8.1753450 1.0000000
P 1
1 3.6161310 1.0000000
P 1
1 1.6734140 1.0000000
P 1
1 0.7892460 1.0000000
P 1
1 0.3723390 1.0000000
P 1
1 0.1740380 1.0000000
P 1
1 0.0786810 1.0000000
OXYGEN
S 1
1 570979.8000000 1.0000000
S 1
1 85496.9000000 1.0000000
S 1
1 19456.6500000 1.0000000
S 1
1 5511.0300000 1.0000000
S 1
1 1797.9190000 1.0000000
S 1
1 649.0677000 1.0000000
S 1
1 253.1386000 1.0000000
S 1
1 104.9379000 1.0000000
S 1
1 45.6503600 1.0000000
S 1
1 20.6176200 1.0000000
S 1
1 9.5867590 1.0000000
S 1
1 4.4925100 1.0000000
S 1
1 1.8369430 1.0000000
S 1
1 0.8348030 1.0000000
S 1
1 0.3657220 1.0000000
S 1
1 0.1570340 1.0000000
P 1
1 848.8125000 1.0000000
P 1
1 201.1044000 1.0000000
P 1
1 65.2765400 1.0000000
P 1
1 24.7946700 1.0000000
P 1
1 10.3206000 1.0000000
P 1
1 4.5798170 1.0000000
P 1
1 2.1189860 1.0000000
P 1
1 0.9925870 1.0000000
P 1
1 0.4615960 1.0000000
P 1
1 0.2114110 1.0000000
P 1
1 0.0933490 1.0000000
FLUORINE
S 1
1 720491.5000000 1.0000000
S 1
1 107968.2000000 1.0000000
S 1
1 24588.9900000 1.0000000
S 1
1 6969.6740000 1.0000000
S 1
1 2275.3060000 1.0000000
S 1
1 821.9317000 1.0000000
S 1
1 320.7533000 1.0000000
S 1
1 133.0541000 1.0000000
S 1
1 57.9326500 1.0000000
S 1
1 26.2013400 1.0000000
S 1
1 12.2050300 1.0000000
S 1
1 5.7308280 1.0000000
S 1
1 2.3596050 1.0000000
S 1
1 1.0684590 1.0000000
S 1
1 0.4668570 1.0000000
S 1
1 0.1990230 1.0000000
P 1
1 1091.1960000 1.0000000
P 1
1 257.8959000 1.0000000
P 1
1 83.5221700 1.0000000
P 1
1 31.6786200 1.0000000
P 1
1 13.1866800 1.0000000
P 1
1 5.8551870 1.0000000
P 1
1 2.7048560 1.0000000
P 1
1 1.2608580 1.0000000
P 1
1 0.5810680 1.0000000
P 1
1 0.2624950 1.0000000
P 1
1 0.1138770 1.0000000
NEON
S 1
1 902420.7000000 1.0000000
S 1
1 135126.9000000 1.0000000
S 1
1 30751.4600000 1.0000000
S 1
1 8710.3800000 1.0000000
S 1
1 2841.7140000 1.0000000
S 1
1 1025.9010000 1.0000000
S 1
1 400.1128000 1.0000000
S 1
1 165.8865000 1.0000000
S 1
1 72.2059400 1.0000000
S 1
1 32.6597700 1.0000000
S 1
1 15.2187400 1.0000000
S 1
1 7.1490320 1.0000000
S 1
1 2.9571440 1.0000000
S 1
1 1.3351450 1.0000000
S 1
1 0.5815790 1.0000000
S 1
1 0.2463310 1.0000000
P 1
1 1312.6100000 1.0000000
P 1
1 310.9703000 1.0000000
P 1
1 100.9378000 1.0000000
P 1
1 38.3762300 1.0000000
P 1
1 16.0283200 1.0000000
P 1
1 7.1420500 1.0000000
P 1
1 3.3044750 1.0000000
P 1
1 1.5393700 1.0000000
P 1
1 0.7074590 1.0000000
P 1
1 0.3178960 1.0000000
P 1
1 0.1368120 1.0000000
SODIUM
S 1
1 1223821.0000000 1.0000000
S 1
1 183243.9000000 1.0000000
S 1
1 41700.3000000 1.0000000
S 1
1 11811.3800000 1.0000000
S 1
1 3853.3350000 1.0000000
S 1
1 1391.0820000 1.0000000
S 1
1 542.5201000 1.0000000
S 1
1 224.9305000 1.0000000
S 1
1 97.9280000 1.0000000
S 1
1 44.3082800 1.0000000
S 1
1 20.6509500 1.0000000
S 1
1 9.7292670 1.0000000
S 1
1 4.2279390 1.0000000
S 1
1 1.9690550 1.0000000
S 1
1 0.8889570 1.0000000
S 1
1 0.3964430 1.0000000
S 1
1 0.0699330 1.0000000
S 1
1 0.0328930 1.0000000
S 1
1 0.0161220 1.0000000
P 1
1 1774.8570000 1.0000000
P 1
1 420.4154000 1.0000000
P 1
1 136.4986000 1.0000000
P 1
1 51.9839400 1.0000000
P 1
1 21.7832100 1.0000000
P 1
1 9.7469380 1.0000000
P 1
1 4.5396400 1.0000000
P 1
1 2.1378420 1.0000000
P 1
1 1.0005380 1.0000000
P 1
1 0.4610700 1.0000000
P 1
1 0.1975960 1.0000000
MAGNESIUM
S 1
1 1708066.0000000 1.0000000
S 1
1 255748.6000000 1.0000000
S 1
1 58200.0500000 1.0000000
S 1
1 16485.1200000 1.0000000
S 1
1 5378.2480000 1.0000000
S 1
1 1941.6640000 1.0000000
S 1
1 757.2925000 1.0000000
S 1
1 314.0328000 1.0000000
S 1
1 136.8060000 1.0000000
S 1
1 61.9856900 1.0000000
S 1
1 28.9764300 1.0000000
S 1
1 13.8051500 1.0000000
S 1
1 6.4643120 1.0000000
S 1
1 2.9940690 1.0000000
S 1
1 1.3649190 1.0000000
S 1
1 0.6163810 1.0000000
S 1
1 0.1475130 1.0000000
S 1
1 0.0667150 1.0000000
S 1
1 0.0295140 1.0000000
P 1
1 2263.1060000 1.0000000
P 1
1 536.0126000 1.0000000
P 1
1 174.0500000 1.0000000
P 1
1 66.3474200 1.0000000
P 1
1 27.8598200 1.0000000
P 1
1 12.5005900 1.0000000
P 1
1 5.8466490 1.0000000
P 1
1 2.7727110 1.0000000
P 1
1 1.3134760 1.0000000
P 1
1 0.6125210 1.0000000
P 1
1 0.2540300 1.0000000
ALUMINUM
S 1
1 1328078.0000000 1.0000000
S 1
1 198873.3000000 1.0000000
S 1
1 45258.9800000 1.0000000
S 1
1 12819.5100000 1.0000000
S 1
1 4182.2170000 1.0000000
S 1
1 1509.8190000 1.0000000
S 1
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S 1
1 244.1548000 1.0000000
S 1
1 106.3231000 1.0000000
S 1
1 48.1899600 1.0000000
S 1
1 22.5669400 1.0000000
S 1
1 10.7131100 1.0000000
S 1
1 4.4656150 1.0000000
S 1
1 1.9968120 1.0000000
S 1
1 0.8896640 1.0000000
S 1
1 0.2412300 1.0000000
S 1
1 0.1109820 1.0000000
S 1
1 0.0476330 1.0000000
P 1
1 2266.4030000 1.0000000
P 1
1 536.8778000 1.0000000
P 1
1 174.2806000 1.0000000
P 1
1 66.3507800 1.0000000
P 1
1 27.8201100 1.0000000
P 1
1 12.4612000 1.0000000
P 1
1 5.7964350 1.0000000
P 1
1 2.7327590 1.0000000
P 1
1 1.2971100 1.0000000
P 1
1 0.6058540 1.0000000
P 1
1 0.2269580 1.0000000
P 1
1 0.0886370 1.0000000
P 1
1 0.0345970 1.0000000
SILICON
S 1
1 1634321.0000000 1.0000000
S 1
1 244742.0000000 1.0000000
S 1
1 55699.3400000 1.0000000
S 1
1 15776.9200000 1.0000000
S 1
1 5147.0700000 1.0000000
S 1
1 1858.1480000 1.0000000
S 1
1 724.7153000 1.0000000
S 1
1 300.5200000 1.0000000
S 1
1 130.9134000 1.0000000
S 1
1 59.3673800 1.0000000
S 1
1 27.8170500 1.0000000
S 1
1 13.2093600 1.0000000
S 1
1 5.5281800 1.0000000
S 1
1 2.5167620 1.0000000
S 1
1 1.1437940 1.0000000
S 1
1 0.3508980 1.0000000
S 1
1 0.1595110 1.0000000
S 1
1 0.0673870 1.0000000
P 1
1 2505.7800000 1.0000000
P 1
1 593.5910000 1.0000000
P 1
1 192.6644000 1.0000000
P 1
1 73.3272300 1.0000000
P 1
1 30.7430700 1.0000000
P 1
1 13.7644700 1.0000000
P 1
1 6.3876560 1.0000000
P 1
1 3.0038410 1.0000000
P 1
1 1.4197650 1.0000000
P 1
1 0.6474540 1.0000000
P 1
1 0.2781970 1.0000000
P 1
1 0.1166910 1.0000000
P 1
1 0.0477570 1.0000000
PHOSPHORUS
S 1
1 1948462.0000000 1.0000000
S 1
1 291808.8000000 1.0000000
S 1
1 66414.4900000 1.0000000
S 1
1 18812.8200000 1.0000000
S 1
1 6137.6770000 1.0000000
S 1
1 2215.7920000 1.0000000
S 1
1 864.2240000 1.0000000
S 1
1 358.3963000 1.0000000
S 1
1 156.1584000 1.0000000
S 1
1 70.8394000 1.0000000
S 1
1 33.2032600 1.0000000
S 1
1 15.7730600 1.0000000
S 1
1 6.6411840 1.0000000
S 1
1 3.0675010 1.0000000
S 1
1 1.4162150 1.0000000
S 1
1 0.4708110 1.0000000
S 1
1 0.2115790 1.0000000
S 1
1 0.0887770 1.0000000
P 1
1 2956.2620000 1.0000000
P 1
1 700.2848000 1.0000000
P 1
1 227.3139000 1.0000000
P 1
1 86.5618400 1.0000000
P 1
1 36.3338600 1.0000000
P 1
1 16.2934700 1.0000000
P 1
1 7.5789660 1.0000000
P 1
1 3.5788590 1.0000000
P 1
1 1.6980420 1.0000000
P 1
1 0.7633580 1.0000000
P 1
1 0.3421190 1.0000000
P 1
1 0.1486200 1.0000000
P 1
1 0.0623450 1.0000000
SULFUR
S 1
1 2274842.0000000 1.0000000
S 1
1 340650.2000000 1.0000000
S 1
1 77524.8700000 1.0000000
S 1
1 21958.9600000 1.0000000
S 1
1 7164.0410000 1.0000000
S 1
1 2586.3930000 1.0000000
S 1
1 1008.8010000 1.0000000
S 1
1 418.3794000 1.0000000
S 1
1 182.3255000 1.0000000
S 1
1 82.7341500 1.0000000
S 1
1 38.7914500 1.0000000
S 1
1 18.4391100 1.0000000
S 1
1 7.8093160 1.0000000
S 1
1 3.6498620 1.0000000
S 1
1 1.7065700 1.0000000
S 1
1 0.5992540 1.0000000
S 1
1 0.2671050 1.0000000
S 1
1 0.1111440 1.0000000
P 1
1 3409.8860000 1.0000000
P 1
1 807.7113000 1.0000000
P 1
1 262.1962000 1.0000000
P 1
1 99.8831300 1.0000000
P 1
1 41.9644300 1.0000000
P 1
1 18.8444800 1.0000000
P 1
1 8.7845420 1.0000000
P 1
1 4.1668210 1.0000000
P 1
1 1.9883750 1.0000000
P 1
1 0.8899970 1.0000000
P 1
1 0.3992300 1.0000000
P 1
1 0.1725460 1.0000000
P 1
1 0.0717380 1.0000000
CHLORINE
S 1
1 2609488.0000000 1.0000000
S 1
1 391014.6000000 1.0000000
S 1
1 89016.9000000 1.0000000
S 1
1 25215.8100000 1.0000000
S 1
1 8225.8960000 1.0000000
S 1
1 2969.4460000 1.0000000
S 1
1 1158.1540000 1.0000000
S 1
1 480.3547000 1.0000000
S 1
1 209.3989000 1.0000000
S 1
1 95.0755300 1.0000000
S 1
1 44.6140500 1.0000000
S 1
1 21.2325700 1.0000000
S 1
1 9.0347380 1.0000000
S 1
1 4.2651030 1.0000000
S 1
1 2.0151050 1.0000000
S 1
1 0.7371100 1.0000000
S 1
1 0.3265140 1.0000000
S 1
1 0.1353310 1.0000000
P 1
1 3935.2100000 1.0000000
P 1
1 932.1996000 1.0000000
P 1
1 302.6459000 1.0000000
P 1
1 115.3447000 1.0000000
P 1
1 48.5082000 1.0000000
P 1
1 21.8163400 1.0000000
P 1
1 10.1967400 1.0000000
P 1
1 4.8617670 1.0000000
P 1
1 2.3378570 1.0000000
P 1
1 1.0564980 1.0000000
P 1
1 0.4748120 1.0000000
P 1
1 0.2051910 1.0000000
P 1
1 0.0850230 1.0000000
ARGON
S 1
1 2922053.0000000 1.0000000
S 1
1 445704.9000000 1.0000000
S 1
1 101280.2000000 1.0000000
S 1
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S 1
1 9415.0380000 1.0000000
S 1
1 3415.1810000 1.0000000
S 1
1 1335.7520000 1.0000000
S 1
1 554.6218000 1.0000000
S 1
1 241.7787000 1.0000000
S 1
1 109.7204000 1.0000000
S 1
1 51.4455200 1.0000000
S 1
1 24.4538400 1.0000000
S 1
1 10.3829400 1.0000000
S 1
1 4.9357510 1.0000000
S 1
1 2.3490890 1.0000000
S 1
1 0.8850570 1.0000000
S 1
1 0.3902620 1.0000000
S 1
1 0.1615060 1.0000000
P 1
1 4495.4320000 1.0000000
P 1
1 1064.5410000 1.0000000
P 1
1 345.5496000 1.0000000
P 1
1 131.7266000 1.0000000
P 1
1 55.4399100 1.0000000
P 1
1 24.9652400 1.0000000
P 1
1 11.6946200 1.0000000
P 1
1 5.6015830 1.0000000
P 1
1 2.7126580 1.0000000
P 1
1 1.2401480 1.0000000
P 1
1 0.5596690 1.0000000
P 1
1 0.2427220 1.0000000
P 1
1 0.1006650 1.0000000
POTASSIUM
S 1
1 9643537.0000000 1.0000000
S 1
1 1443689.0000000 1.0000000
S 1
1 328535.9000000 1.0000000
S 1
1 93061.1500000 1.0000000
S 1
1 30363.0000000 1.0000000
S 1
1 10962.8200000 1.0000000
S 1
1 4276.5210000 1.0000000
S 1
1 1774.2110000 1.0000000
S 1
1 774.1564000 1.0000000
S 1
1 352.2324000 1.0000000
S 1
1 165.9201000 1.0000000
S 1
1 80.4536500 1.0000000
S 1
1 39.8538300 1.0000000
S 1
1 19.8518200 1.0000000
S 1
1 9.6408470 1.0000000
S 1
1 4.8309610 1.0000000
S 1
1 2.4362750 1.0000000
S 1
1 1.0646140 1.0000000
S 1
1 0.4966100 1.0000000
S 1
1 0.2253080 1.0000000
S 1
1 0.0388050 1.0000000
S 1
1 0.0166650 1.0000000
P 1
1 8066.7020000 1.0000000
P 1
1 1909.8160000 1.0000000
P 1
1 620.3136000 1.0000000
P 1
1 237.1839000 1.0000000
P 1
1 100.3696000 1.0000000
P 1
1 45.5518000 1.0000000
P 1
1 21.7048300 1.0000000
P 1
1 10.6327500 1.0000000
P 1
1 5.3176730 1.0000000
P 1
1 2.6792220 1.0000000
P 1
1 1.2969570 1.0000000
P 1
1 0.6113540 1.0000000
P 1
1 0.2820620 1.0000000
P 1
1 0.1212260 1.0000000
CALCIUM
S 1
1 7503960.0000000 1.0000000
S 1
1 1123486.0000000 1.0000000
S 1
1 255663.5000000 1.0000000
S 1
1 72416.0600000 1.0000000
S 1
1 23626.0400000 1.0000000
S 1
1 8529.9860000 1.0000000
S 1
1 3327.3410000 1.0000000
S 1
1 1380.3540000 1.0000000
S 1
1 602.2149000 1.0000000
S 1
1 273.8874000 1.0000000
S 1
1 128.9451000 1.0000000
S 1
1 62.4229900 1.0000000
S 1
1 30.5743700 1.0000000
S 1
1 13.8552200 1.0000000
S 1
1 6.8362040 1.0000000
S 1
1 3.3781530 1.0000000
S 1
1 1.4919070 1.0000000
S 1
1 0.7211400 1.0000000
S 1
1 0.3341520 1.0000000
S 1
1 0.0823820 1.0000000
S 1
1 0.0416550 1.0000000
S 1
1 0.0199730 1.0000000
P 1
1 9339.1100000 1.0000000
P 1
1 2210.9710000 1.0000000
P 1
1 718.1424000 1.0000000
P 1
1 274.6512000 1.0000000
P 1
1 116.2980000 1.0000000
P 1
1 52.8310400 1.0000000
P 1
1 25.2143200 1.0000000
P 1
1 12.3863100 1.0000000
P 1
1 6.2191280 1.0000000
P 1
1 3.1495510 1.0000000
P 1
1 1.5411910 1.0000000
P 1
1 0.7378260 1.0000000
P 1
1 0.3466030 1.0000000
P 1
1 0.1445670 1.0000000
SCANDIUM
S 1
1 8414748.0000000 1.0000000
S 1
1 1259880.0000000 1.0000000
S 1
1 286711.1000000 1.0000000
S 1
1 81213.3500000 1.0000000
S 1
1 26497.1700000 1.0000000
S 1
1 9566.8930000 1.0000000
S 1
1 3731.9030000 1.0000000
S 1
1 1548.2150000 1.0000000
S 1
1 675.4697000 1.0000000
S 1
1 307.2292000 1.0000000
S 1
1 144.6618000 1.0000000
S 1
1 70.0438700 1.0000000
S 1
1 34.3237900 1.0000000
S 1
1 15.6145700 1.0000000
S 1
1 7.7450310 1.0000000
S 1
1 3.8449290 1.0000000
S 1
1 1.7200810 1.0000000
S 1
1 0.8325940 1.0000000
S 1
1 0.3855520 1.0000000
S 1
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S 1
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S 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
1 0.0852640 1.0000000
TITANIUM
S 1
1 9317034.0000000 1.0000000
S 1
1 1394971.0000000 1.0000000
S 1
1 317453.1000000 1.0000000
S 1
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S 1
1 29338.1600000 1.0000000
S 1
1 10592.6600000 1.0000000
S 1
1 4132.0560000 1.0000000
S 1
1 1714.2350000 1.0000000
S 1
1 747.9151000 1.0000000
S 1
1 340.1991000 1.0000000
S 1
1 160.2060000 1.0000000
S 1
1 77.5885100 1.0000000
S 1
1 38.0448900 1.0000000
S 1
1 17.3536200 1.0000000
S 1
1 8.6420620 1.0000000
S 1
1 4.3044040 1.0000000
S 1
1 1.9377180 1.0000000
S 1
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S 1
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S 1
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S 1
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S 1
1 0.0240380 1.0000000
P 1
1 11912.0300000 1.0000000
P 1
1 2819.9470000 1.0000000
P 1
1 915.9479000 1.0000000
P 1
1 350.3842000 1.0000000
P 1
1 148.4825000 1.0000000
P 1
1 67.5394400 1.0000000
P 1
1 32.3033200 1.0000000
P 1
1 15.9278600 1.0000000
P 1
1 8.0380350 1.0000000
P 1
1 4.0939160 1.0000000
P 1
1 2.0223900 1.0000000
P 1
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P 1
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P 1
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D 1
1 134.2157000 1.0000000
D 1
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D 1
1 15.1114500 1.0000000
D 1
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D 1
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D 1
1 1.2514220 1.0000000
D 1
1 0.5566000 1.0000000
D 1
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D 1
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VANADIUM
S 1
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S 1
1 1534898.0000000 1.0000000
S 1
1 349294.7000000 1.0000000
S 1
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S 1
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S 1
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S 1
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S 1
1 1886.1490000 1.0000000
S 1
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S 1
1 374.3444000 1.0000000
S 1
1 176.3089000 1.0000000
S 1
1 85.4082200 1.0000000
S 1
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S 1
1 19.1559900 1.0000000
S 1
1 9.5721340 1.0000000
S 1
1 4.7803890 1.0000000
S 1
1 2.1619340 1.0000000
S 1
1 1.0427270 1.0000000
S 1
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S 1
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S 1
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S 1
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P 1
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P 1
1 4604.8580000 1.0000000
P 1
1 1495.7970000 1.0000000
P 1
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P 1
1 243.3576000 1.0000000
P 1
1 111.1192000 1.0000000
P 1
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P 1
1 26.7095500 1.0000000
P 1
1 13.6414900 1.0000000
P 1
1 7.0929120 1.0000000
P 1
1 3.6802870 1.0000000
P 1
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P 1
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P 1
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P 1
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D 1
1 229.0224000 1.0000000
D 1
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D 1
1 26.3370400 1.0000000
D 1
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D 1
1 5.1117690 1.0000000
D 1
1 2.4138080 1.0000000
D 1
1 1.1404400 1.0000000
D 1
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D 1
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D 1
1 0.0986050 1.0000000
CHROMIUM
S 1
1 11016640.0000000 1.0000000
S 1
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S 1
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S 1
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S 1
1 34689.7600000 1.0000000
S 1
1 12524.8300000 1.0000000
S 1
1 4885.7520000 1.0000000
S 1
1 2026.9180000 1.0000000
S 1
1 884.3645000 1.0000000
S 1
1 402.3170000 1.0000000
S 1
1 189.5271000 1.0000000
S 1
1 91.8609500 1.0000000
S 1
1 45.1247600 1.0000000
S 1
1 20.6251200 1.0000000
S 1
1 10.3197300 1.0000000
S 1
1 5.1577230 1.0000000
S 1
1 2.3126280 1.0000000
S 1
1 1.1030790 1.0000000
S 1
1 0.4980420 1.0000000
S 1
1 0.1182470 1.0000000
S 1
1 0.0573560 1.0000000
S 1
1 0.0257600 1.0000000
P 1
1 14454.2000000 1.0000000
P 1
1 3421.6760000 1.0000000
P 1
1 1111.3870000 1.0000000
P 1
1 425.1918000 1.0000000
P 1
1 180.2623000 1.0000000
P 1
1 82.0611700 1.0000000
P 1
1 39.2972600 1.0000000
P 1
1 19.4195900 1.0000000
P 1
1 9.8288990 1.0000000
P 1
1 5.0168100 1.0000000
P 1
1 2.4870910 1.0000000
P 1
1 1.1987800 1.0000000
P 1
1 0.5586950 1.0000000
P 1
1 0.2344000 1.0000000
D 1
1 220.4620000 1.0000000
D 1
1 65.9100700 1.0000000
D 1
1 25.2668200 1.0000000
D 1
1 10.7218800 1.0000000
D 1
1 4.8494890 1.0000000
D 1
1 2.2589440 1.0000000
D 1
1 1.0421590 1.0000000
D 1
1 0.4663420 1.0000000
D 1
1 0.1992210 1.0000000
D 1
1 0.0792260 1.0000000
MANGANESE
S 1
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S 1
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S 1
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S 1
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S 1
1 38462.8700000 1.0000000
S 1
1 13886.7200000 1.0000000
S 1
1 5416.7860000 1.0000000
S 1
1 2247.1270000 1.0000000
S 1
1 980.4106000 1.0000000
S 1
1 446.0052000 1.0000000
S 1
1 210.1016000 1.0000000
S 1
1 101.8229000 1.0000000
S 1
1 50.0184900 1.0000000
S 1
1 22.9461800 1.0000000
S 1
1 11.5255200 1.0000000
S 1
1 5.7776390 1.0000000
S 1
1 2.6269120 1.0000000
S 1
1 1.2606690 1.0000000
S 1
1 0.5772350 1.0000000
S 1
1 0.1366690 1.0000000
S 1
1 0.0636100 1.0000000
S 1
1 0.0285530 1.0000000
P 1
1 23797.1700000 1.0000000
P 1
1 5631.6010000 1.0000000
P 1
1 1829.2580000 1.0000000
P 1
1 700.4122000 1.0000000
P 1
1 297.6977000 1.0000000
P 1
1 136.0188000 1.0000000
P 1
1 65.5623600 1.0000000
P 1
1 32.7877300 1.0000000
P 1
1 16.7946000 1.0000000
P 1
1 8.7597320 1.0000000
P 1
1 4.5587130 1.0000000
P 1
1 2.3220830 1.0000000
P 1
1 1.1534020 1.0000000
P 1
1 0.5550090 1.0000000
P 1
1 0.2310180 1.0000000
D 1
1 424.5513000 1.0000000
D 1
1 127.5869000 1.0000000
D 1
1 49.4485500 1.0000000
D 1
1 21.6355600 1.0000000
D 1
1 10.0621000 1.0000000
D 1
1 4.8976780 1.0000000
D 1
1 2.4245700 1.0000000
D 1
1 1.1906930 1.0000000
D 1
1 0.5731360 1.0000000
D 1
1 0.2655520 1.0000000
D 1
1 0.1137740 1.0000000
IRON
S 1
1 13277140.0000000 1.0000000
S 1
1 1987888.0000000 1.0000000
S 1
1 452387.1000000 1.0000000
S 1
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S 1
1 41809.1700000 1.0000000
S 1
1 15095.3300000 1.0000000
S 1
1 5888.4380000 1.0000000
S 1
1 2442.8760000 1.0000000
S 1
1 1065.8570000 1.0000000
S 1
1 484.9096000 1.0000000
S 1
1 228.4585000 1.0000000
S 1
1 110.7453000 1.0000000
S 1
1 54.4311600 1.0000000
S 1
1 25.0109600 1.0000000
S 1
1 12.5926200 1.0000000
S 1
1 6.3232020 1.0000000
S 1
1 2.8833840 1.0000000
S 1
1 1.3828680 1.0000000
S 1
1 0.6322010 1.0000000
S 1
1 0.1492380 1.0000000
S 1
1 0.0684940 1.0000000
S 1
1 0.0303810 1.0000000
P 1
1 26063.0300000 1.0000000
P 1
1 6168.0170000 1.0000000
P 1
1 2003.5260000 1.0000000
P 1
1 767.1618000 1.0000000
P 1
1 326.1070000 1.0000000
P 1
1 149.0380000 1.0000000
P 1
1 71.8673800 1.0000000
P 1
1 35.9671400 1.0000000
P 1
1 18.4454400 1.0000000
P 1
1 9.6328710 1.0000000
P 1
1 5.0185100 1.0000000
P 1
1 2.5591840 1.0000000
P 1
1 1.2722100 1.0000000
P 1
1 0.6119260 1.0000000
P 1
1 0.2542990 1.0000000
D 1
1 460.2520000 1.0000000
D 1
1 138.3811000 1.0000000
D 1
1 53.6572600 1.0000000
D 1
1 23.4878200 1.0000000
D 1
1 10.9393900 1.0000000
D 1
1 5.3293630 1.0000000
D 1
1 2.6344630 1.0000000
D 1
1 1.2886620 1.0000000
D 1
1 0.6159260 1.0000000
D 1
1 0.2827080 1.0000000
D 1
1 0.1198450 1.0000000
COBALT
S 1
1 14369330.0000000 1.0000000
S 1
1 2151370.0000000 1.0000000
S 1
1 489582.1000000 1.0000000
S 1
1 138677.1000000 1.0000000
S 1
1 45245.4000000 1.0000000
S 1
1 16335.9600000 1.0000000
S 1
1 6372.4100000 1.0000000
S 1
1 2643.6770000 1.0000000
S 1
1 1153.4880000 1.0000000
S 1
1 524.8010000 1.0000000
S 1
1 247.2778000 1.0000000
S 1
1 119.8921000 1.0000000
S 1
1 58.9573900 1.0000000
S 1
1 27.1324500 1.0000000
S 1
1 13.6870800 1.0000000
S 1
1 6.8818990 1.0000000
S 1
1 3.1444600 1.0000000
S 1
1 1.5062590 1.0000000
S 1
1 0.6873070 1.0000000
S 1
1 0.1610610 1.0000000
S 1
1 0.0730950 1.0000000
S 1
1 0.0320840 1.0000000
P 1
1 28448.5900000 1.0000000
P 1
1 6732.5750000 1.0000000
P 1
1 2186.9170000 1.0000000
P 1
1 837.4082000 1.0000000
P 1
1 356.0115000 1.0000000
P 1
1 162.7487000 1.0000000
P 1
1 78.5118100 1.0000000
P 1
1 39.3196400 1.0000000
P 1
1 20.1858700 1.0000000
P 1
1 10.5519800 1.0000000
P 1
1 5.5009960 1.0000000
P 1
1 2.8054300 1.0000000
P 1
1 1.3940930 1.0000000
P 1
1 0.6698620 1.0000000
P 1
1 0.2781750 1.0000000
D 1
1 159.5771000 1.0000000
D 1
1 47.6083300 1.0000000
D 1
1 17.7816900 1.0000000
D 1
1 7.3456370 1.0000000
D 1
1 3.1673230 1.0000000
D 1
1 1.3443590 1.0000000
D 1
1 0.5442370 1.0000000
D 1
1 0.1993530 1.0000000
NICKEL
S 1
1 15503020.0000000 1.0000000
S 1
1 2321071.0000000 1.0000000
S 1
1 528180.2000000 1.0000000
S 1
1 149604.0000000 1.0000000
S 1
1 48809.0700000 1.0000000
S 1
1 17622.3900000 1.0000000
S 1
1 6874.2010000 1.0000000
S 1
1 2851.8570000 1.0000000
S 1
1 1244.3340000 1.0000000
S 1
1 566.1547000 1.0000000
S 1
1 266.7873000 1.0000000
S 1
1 129.3752000 1.0000000
S 1
1 63.6516100 1.0000000
S 1
1 29.3330200 1.0000000
S 1
1 14.8221200 1.0000000
S 1
1 7.4605130 1.0000000
S 1
1 3.4135760 1.0000000
S 1
1 1.6328840 1.0000000
S 1
1 0.7435790 1.0000000
S 1
1 0.1725920 1.0000000
S 1
1 0.0774200 1.0000000
S 1
1 0.0337010 1.0000000
P 1
1 30915.0500000 1.0000000
P 1
1 7316.0990000 1.0000000
P 1
1 2376.4140000 1.0000000
P 1
1 909.9714000 1.0000000
P 1
1 386.8928000 1.0000000
P 1
1 176.9042000 1.0000000
P 1
1 85.3699200 1.0000000
P 1
1 42.7810500 1.0000000
P 1
1 21.9860200 1.0000000
P 1
1 11.5056500 1.0000000
P 1
1 6.0043770 1.0000000
P 1
1 3.0668000 1.0000000
P 1
1 1.5256580 1.0000000
P 1
1 0.7330920 1.0000000
P 1
1 0.3046340 1.0000000
D 1
1 545.8386000 1.0000000
D 1
1 164.2348000 1.0000000
D 1
1 63.7340100 1.0000000
D 1
1 27.9386200 1.0000000
D 1
1 13.0518700 1.0000000
D 1
1 6.3705910 1.0000000
D 1
1 3.1464460 1.0000000
D 1
1 1.5333270 1.0000000
D 1
1 0.7274280 1.0000000
D 1
1 0.3304100 1.0000000
D 1
1 0.1381790 1.0000000
COPPER
S 1
1 16057550.0000000 1.0000000
S 1
1 2404206.0000000 1.0000000
S 1
1 547134.0000000 1.0000000
S 1
1 154981.8000000 1.0000000
S 1
1 50565.7900000 1.0000000
S 1
1 18257.1600000 1.0000000
S 1
1 7121.9580000 1.0000000
S 1
1 2954.7000000 1.0000000
S 1
1 1289.2460000 1.0000000
S 1
1 586.6445000 1.0000000
S 1
1 276.5331000 1.0000000
S 1
1 134.2132000 1.0000000
S 1
1 66.1541000 1.0000000
S 1
1 30.4326700 1.0000000
S 1
1 15.3557700 1.0000000
S 1
1 7.7228720 1.0000000
S 1
1 3.4856340 1.0000000
S 1
1 1.6421270 1.0000000
S 1
1 0.7314660 1.0000000
S 1
1 0.1417240 1.0000000
S 1
1 0.0643230 1.0000000
S 1
1 0.0284060 1.0000000
P 1
1 22287.6200000 1.0000000
P 1
1 5275.8730000 1.0000000
P 1
1 1713.6390000 1.0000000
P 1
1 655.7449000 1.0000000
P 1
1 278.2540000 1.0000000
P 1
1 126.8780000 1.0000000
P 1
1 60.9210600 1.0000000
P 1
1 30.2483800 1.0000000
P 1
1 15.3970200 1.0000000
P 1
1 7.8940000 1.0000000
P 1
1 3.9391870 1.0000000
P 1
1 1.9072930 1.0000000
P 1
1 0.8887510 1.0000000
P 1
1 0.3698940 1.0000000
D 1
1 361.8313000 1.0000000
D 1
1 108.5176000 1.0000000
D 1
1 41.8095400 1.0000000
D 1
1 17.9416800 1.0000000
D 1
1 8.2069660 1.0000000
D 1
1 3.8438960 1.0000000
D 1
1 1.7727230 1.0000000
D 1
1 0.7865110 1.0000000
D 1
1 0.3294310 1.0000000
D 1
1 0.1257690 1.0000000
ZINC
S 1
1 17825590.0000000 1.0000000
S 1
1 2669077.0000000 1.0000000
S 1
1 607450.2000000 1.0000000
S 1
1 172079.5000000 1.0000000
S 1
1 56148.5600000 1.0000000
S 1
1 20274.4200000 1.0000000
S 1
1 7909.4510000 1.0000000
S 1
1 3281.6320000 1.0000000
S 1
1 1431.9950000 1.0000000
S 1
1 651.6360000 1.0000000
S 1
1 307.1495000 1.0000000
S 1
1 149.0193000 1.0000000
S 1
1 73.3956400 1.0000000
S 1
1 33.9018600 1.0000000
S 1
1 17.1777800 1.0000000
S 1
1 8.6616000 1.0000000
S 1
1 3.9709890 1.0000000
S 1
1 1.8941390 1.0000000
S 1
1 0.8592800 1.0000000
S 1
1 0.1953840 1.0000000
S 1
1 0.0859820 1.0000000
S 1
1 0.0368080 1.0000000
P 1
1 36051.1300000 1.0000000
P 1
1 8531.9330000 1.0000000
P 1
1 2771.5710000 1.0000000
P 1
1 1061.4090000 1.0000000
P 1
1 451.3886000 1.0000000
P 1
1 206.4890000 1.0000000
P 1
1 99.7171100 1.0000000
P 1
1 50.0285600 1.0000000
P 1
1 25.7560600 1.0000000
P 1
1 13.4995200 1.0000000
P 1
1 7.0512860 1.0000000
P 1
1 3.6016070 1.0000000
P 1
1 1.7903160 1.0000000
P 1
1 0.8588500 1.0000000
P 1
1 0.3568720 1.0000000
D 1
1 205.6247000 1.0000000
D 1
1 61.4538700 1.0000000
D 1
1 23.0595100 1.0000000
D 1
1 9.5790710 1.0000000
D 1
1 4.1342200 1.0000000
D 1
1 1.7476030 1.0000000
D 1
1 0.6995430 1.0000000
D 1
1 0.2515870 1.0000000
GALLIUM
S 1
1 11280660.0000000 1.0000000
S 1
1 1689168.0000000 1.0000000
S 1
1 384417.2000000 1.0000000
S 1
1 108888.0000000 1.0000000
S 1
1 35524.6700000 1.0000000
S 1
1 12825.1100000 1.0000000
S 1
1 5002.0550000 1.0000000
S 1
1 2074.4480000 1.0000000
S 1
1 904.3413000 1.0000000
S 1
1 410.6592000 1.0000000
S 1
1 192.6824000 1.0000000
S 1
1 92.0761000 1.0000000
S 1
1 42.0577000 1.0000000
S 1
1 21.0726200 1.0000000
S 1
1 10.4488100 1.0000000
S 1
1 4.7773930 1.0000000
S 1
1 2.2824560 1.0000000
S 1
1 1.0352480 1.0000000
S 1
1 0.2576740 1.0000000
S 1
1 0.1191660 1.0000000
S 1
1 0.0512850 1.0000000
P 1
1 22071.0400000 1.0000000
P 1
1 5225.1120000 1.0000000
P 1
1 1697.0650000 1.0000000
P 1
1 649.1857000 1.0000000
P 1
1 275.2799000 1.0000000
P 1
1 125.4136000 1.0000000
P 1
1 60.0752400 1.0000000
P 1
1 29.7282200 1.0000000
P 1
1 15.0397500 1.0000000
P 1
1 7.5713980 1.0000000
P 1
1 3.7381350 1.0000000
P 1
1 1.7965430 1.0000000
P 1
1 0.8298260 1.0000000
P 1
1 0.2728600 1.0000000
P 1
1 0.1015390 1.0000000
P 1
1 0.0376560 1.0000000
D 1
1 530.6813000 1.0000000
D 1
1 159.5222000 1.0000000
D 1
1 61.7978000 1.0000000
D 1
1 26.8637200 1.0000000
D 1
1 12.4622500 1.0000000
D 1
1 5.9804550 1.0000000
D 1
1 2.8603900 1.0000000
D 1
1 1.3364970 1.0000000
D 1
1 0.5992230 1.0000000
D 1
1 0.2444540 1.0000000
GERMANIUM
S 1
1 12425670.0000000 1.0000000
S 1
1 1860498.0000000 1.0000000
S 1
1 423393.5000000 1.0000000
S 1
1 119926.6000000 1.0000000
S 1
1 39125.9700000 1.0000000
S 1
1 14125.2900000 1.0000000
S 1
1 5509.1690000 1.0000000
S 1
1 2284.7620000 1.0000000
S 1
1 996.0400000 1.0000000
S 1
1 452.3130000 1.0000000
S 1
1 212.2503000 1.0000000
S 1
1 101.5324000 1.0000000
S 1
1 46.9165300 1.0000000
S 1
1 23.5038400 1.0000000
S 1
1 11.6761600 1.0000000
S 1
1 5.4317600 1.0000000
S 1
1 2.6075680 1.0000000
S 1
1 1.1980480 1.0000000
S 1
1 0.3298470 1.0000000
S 1
1 0.1554160 1.0000000
S 1
1 0.0669000 1.0000000
P 1
1 23984.8200000 1.0000000
P 1
1 5677.8340000 1.0000000
P 1
1 1844.0680000 1.0000000
P 1
1 705.4626000 1.0000000
P 1
1 299.2086000 1.0000000
P 1
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P 1
1 65.3708300 1.0000000
P 1
1 32.3885300 1.0000000
P 1
1 16.4139400 1.0000000
P 1
1 8.2869420 1.0000000
P 1
1 4.1121270 1.0000000
P 1
1 1.9985780 1.0000000
P 1
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P 1
1 0.3412030 1.0000000
P 1
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P 1
1 0.0517340 1.0000000
D 1
1 615.2990000 1.0000000
D 1
1 185.1251000 1.0000000
D 1
1 71.8161200 1.0000000
D 1
1 31.3428500 1.0000000
D 1
1 14.6057400 1.0000000
D 1
1 7.0590180 1.0000000
D 1
1 3.4126620 1.0000000
D 1
1 1.6194000 1.0000000
D 1
1 0.7402840 1.0000000
D 1
1 0.3060870 1.0000000
ARSENIC
S 1
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