mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-12-29 07:35:48 +01:00
1439 lines
43 KiB
Plaintext
1439 lines
43 KiB
Plaintext
|
LITHIUM
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S 3
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1 3.0473270 0.0065550
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2 0.6035790 -0.1404010
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3 0.0691380 0.6237560
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S 1
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1 0.0265020 1.0000000
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P 3
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1 0.8371580 0.0435070
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2 0.1719410 0.2296490
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3 0.0520790 0.5629490
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P 1
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1 0.0191720 1.0000000
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BERYLLIUM
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S 3
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1 1.1106443 -0.1718890
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2 0.3714650 0.1291580
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3 0.1326780 0.6148590
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S 1
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1 0.0477510 1.0000000
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P 3
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1 2.8845777 0.0315250
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2 0.7801440 0.1438880
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3 0.2200610 0.4846120
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P 1
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1 0.0664070 1.0000000
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BORON
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S 3
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1 1.6905600 -0.2722080
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2 0.9836660 0.2011280
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3 0.2569790 0.5777630
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S 1
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1 0.0950380 1.0000000
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P 3
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1 5.3999130 0.0349410
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2 1.2712170 0.1868340
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3 0.3619090 0.4684630
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P 1
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1 0.1076610 1.0000000
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CARBON
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S 3
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1 2.2631010 0.4965480
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2 1.7731860 -0.4223910
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3 0.4086190 -0.5993560
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S 1
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1 0.1391750 1.0000000
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P 3
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1 8.3830250 -0.0385440
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2 1.9931320 -0.2031850
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3 0.5595430 -0.4981760
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P 1
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1 0.1561260 1.0000000
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NITROGEN
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S 3
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1 32.6568390 -0.0137940
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2 4.5891890 0.1291290
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3 0.7062510 -0.5680940
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S 1
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1 0.2163990 1.0000000
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P 3
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1 12.1469740 -0.0412960
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2 2.8842650 -0.2140090
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3 0.8085640 -0.5027830
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P 1
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1 0.2221630 1.0000000
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OXYGEN
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S 3
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1 47.1055180 -0.0144080
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2 5.9113460 0.1295680
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3 0.9764830 -0.5631180
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S 1
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1 0.2960700 1.0000000
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P 3
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1 16.6922190 0.0448560
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2 3.9007020 0.2226130
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3 1.0782530 0.5001880
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P 1
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1 0.2841890 1.0000000
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P 1
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1 0.0702000 1.0000000
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FLUORINE
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S 3
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1 51.6427630 0.0085660
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2 9.4142770 -0.1530090
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3 1.2141230 0.5898350
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S 1
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1 0.3700810 1.0000000
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P 3
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1 22.3008300 0.0518510
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2 4.9545730 0.2372870
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3 1.3423110 0.5076660
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P 1
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1 0.3465300 1.0000000
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P 1
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1 0.0847720 1.0000000
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NEON
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S 4
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1 612.0024370 -0.0061070
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2 80.9520440 -0.0426030
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3 13.8642010 0.4521960
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4 8.7455260 0.5799560
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S 1
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1 1.9923460 1.0000000
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S 1
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1 0.8008030 1.0000000
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S 1
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1 0.3077740 1.0000000
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P 4
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1 158.3145350 0.0078510
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2 37.3011280 0.0713160
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3 12.7055580 0.2863920
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4 4.5870870 0.7353940
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P 1
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1 1.7356620 1.0000000
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P 1
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1 0.6405530 1.0000000
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P 1
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1 0.2225440 1.0000000
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D 1
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1 4.2748000 1.0000000
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D 1
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1 1.1717000 1.0000000
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D 1
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1 0.3211000 1.0000000
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F 1
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1 2.5795000 1.0000000
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SODIUM
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S 3
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1 2.6033363 0.0088240
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2 0.5172170 -0.1832270
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3 0.0581960 0.6520170
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S 1
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1 0.0231410 1.0000000
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P 3
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1 0.4992060 0.0185470
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2 0.0792190 0.2762110
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3 0.0299460 0.5870040
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P 1
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1 0.0126050 1.0000000
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MAGNESIUM
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S 3
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1 2.4257193 0.0267640
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2 0.8226250 -0.2238800
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3 0.1077490 0.6204640
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S 1
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1 0.0394850 1.0000000
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P 3
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1 0.7690470 -0.0366480
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2 0.1886750 0.2431450
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3 0.0751010 0.5547840
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P 1
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1 0.0294970 1.0000000
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ALUMINUM
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S 3
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1 2.7863370 -0.0464110
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2 1.1436350 0.2744720
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3 0.1700270 -0.6252340
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S 1
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1 0.0673240 1.0000000
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P 3
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1 0.9837940 0.0520360
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2 0.3582450 -0.1550940
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3 0.1381580 -0.5325840
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P 1
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1 0.0449750 1.0000000
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SILICON
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S 3
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1 4.0143780 -0.0395080
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2 1.3937070 0.2961500
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3 0.2516580 -0.5997520
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S 1
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1 0.1001800 1.0000000
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P 3
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1 1.1024810 0.0845830
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2 0.5831270 -0.1857480
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3 0.2086750 -0.5548520
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P 1
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1 0.0691470 1.0000000
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PHOSPHORUS
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S 3
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1 6.7223080 -0.0324550
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2 1.6240630 0.2850560
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3 0.3319290 -0.6469140
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S 1
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1 0.1208190 1.0000000
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P 3
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1 1.2832210 -0.0559620
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2 0.5997250 0.2863630
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3 0.2277590 0.5522570
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P 1
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1 0.0844240 1.0000000
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SULFUR
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S 3
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1 6.8335180 -0.0438750
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2 2.0777380 0.3198940
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3 0.4191210 -0.6612330
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S 1
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1 0.1532370 1.0000000
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P 3
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1 1.8171390 -0.0792270
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2 0.8550700 0.2636710
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3 0.3120530 0.5806820
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P 1
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1 0.1016870 1.0000000
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P 1
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1 0.0298100 1.0000000
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CHLORINE
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S 3
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1 14.0730760 0.0203450
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2 2.3315650 -0.2892230
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3 0.5071000 0.6303670
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S 1
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1 0.1824330 1.0000000
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P 3
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1 3.3531290 -0.0415520
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2 0.7856860 0.3997480
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3 0.2674540 0.5918290
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P 1
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1 0.0782750 1.0000000
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P 1
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1 0.0154770 1.0000000
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ARGON
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S 3
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1 174.6696550 0.0025870
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2 12.6957680 0.0623130
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3 2.9178340 -1.0421580
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S 1
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1 0.6708400 1.0000000
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S 1
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1 0.2991120 1.0000000
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S 1
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1 0.1314020 1.0000000
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P 3
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1 19.8872210 0.0233460
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2 3.7761720 -0.2246210
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3 1.2115160 1.1375960
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P 1
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1 0.5384990 1.0000000
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P 1
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1 0.2295750 1.0000000
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P 1
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1 0.0951030 1.0000000
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D 1
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1 1.4509000 1.0000000
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D 1
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1 0.4385000 1.0000000
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D 1
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1 0.1325000 1.0000000
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F 1
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1 0.9305000 1.0000000
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POTASSIUM
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S 3
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1 1.1054926 0.0251350
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2 0.2694510 -0.2849110
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3 0.0448520 0.4735740
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S 1
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1 0.0205690 1.0000000
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P 3
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1 0.2202780 -0.0644430
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2 0.0516110 0.2701400
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3 0.0222530 0.6012890
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P 1
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1 0.0098480 1.0000000
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CALCIUM
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S 3
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1 0.8382650 0.1068310
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2 0.4323130 -0.3872400
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3 0.0651100 0.6454090
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S 1
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1 0.0271070 1.0000000
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P 3
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1 0.3169150 -0.1171340
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2 0.1160180 0.2385410
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3 0.0497080 0.5986320
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P 1
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1 0.0214780 1.0000000
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ZINC
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S 2
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1 1.5727550 0.3138620
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2 1.1989050 -0.5418010
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S 1
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1 0.1488560 1.0000000
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S 1
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1 0.0510160 1.0000000
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P 1
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1 0.1362700 1.0000000
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P 1
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1 0.0415000 1.0000000
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GALLIUM
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S 3
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1 3.4847750 0.1143940
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2 1.6858350 -0.3601310
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3 0.1785420 0.6937990
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S 1
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1 0.0678140 1.0000000
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P 3
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1 1.2832310 0.1028340
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2 0.4761630 -0.1408860
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3 0.1556210 -0.4773150
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P 1
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1 0.0542940 1.0000000
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GERMANIUM
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S 3
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1 3.2312530 0.2221800
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2 1.9475450 -0.5066160
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3 0.2323200 0.7088450
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S 1
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1 0.0866690 1.0000000
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P 3
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1 1.2278050 0.2239500
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2 0.7568560 -0.2291340
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3 0.2043470 -0.5764140
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P 1
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1 0.0677920 1.0000000
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ARSENIC
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S 3
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1 3.4314740 0.1481660
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2 1.8968660 -0.4498900
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3 0.2944490 0.6956820
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S 1
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1 0.1118960 1.0000000
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P 3
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1 1.2964470 -0.3699540
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2 0.9499710 0.3732140
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3 0.2544210 0.6003040
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P 1
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1 0.0875930 1.0000000
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SELENIUM
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S 3
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1 3.5881800 0.2496300
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2 2.2397110 -0.5814600
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3 0.3437730 0.7289380
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S 1
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1 0.1313990 1.0000000
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P 3
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|
1 1.5094270 0.1952710
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2 0.8751060 -0.2539150
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3 0.2908260 -0.5904870
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P 1
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|
1 0.1002210 1.0000000
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P 1
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|
1 0.0325160 1.0000000
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BROMINE
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S 3
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1 4.7218810 0.1072970
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2 2.2575550 -0.4338020
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3 0.3896080 0.7720430
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S 1
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|
1 0.1471340 1.0000000
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P 3
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|
1 1.8969420 -0.1793950
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2 0.9108990 0.2637290
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3 0.3168550 0.6069520
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P 1
|
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|
1 0.1095030 1.0000000
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P 1
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|
1 0.0360970 1.0000000
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KRYPTON
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S 3
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|
1 35.4029610 0.0204950
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2 15.6650890 -0.0991880
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3 6.2477110 1.0720510
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S 1
|
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|
1 2.3942460 1.0000000
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|
S 1
|
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|
1 0.4534890 1.0000000
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|
S 1
|
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|
1 0.1721580 1.0000000
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|
P 3
|
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|
1 23.0290850 0.0056250
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|
2 9.5030920 -0.0750510
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|
3 2.8424610 1.0456890
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|
P 1
|
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|
1 0.6892930 1.0000000
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|
P 1
|
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|
1 0.2851360 1.0000000
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|
P 1
|
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|
1 0.1087820 1.0000000
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|
D 1
|
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|
1 0.7379000 1.0000000
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|
D 1
|
||
|
1 0.3225000 1.0000000
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|
D 1
|
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|
1 0.1409000 1.0000000
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F 1
|
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|
1 0.7052000 1.0000000
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RUBIDIUM
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|
S 3
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|
1 0.7182880 0.0772200
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2 0.2739780 -0.3446230
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3 0.0323060 0.7263260
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S 1
|
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|
1 0.0152320 1.0000000
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|
P 3
|
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|
1 0.1619670 -0.0962530
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|
2 0.0507710 0.2008450
|
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|
3 0.0221330 0.6076980
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P 1
|
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|
1 0.0099340 1.0000000
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STRONTIUM
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S 3
|
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|
1 0.7917400 0.0835140
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2 0.3161780 -0.4292370
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3 0.0665650 0.5239690
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S 1
|
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|
1 0.0269900 1.0000000
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|
P 3
|
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|
1 0.2258250 -0.1673350
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2 0.0956910 0.2554970
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|
3 0.0420770 0.6116690
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P 1
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|
1 0.0180770 1.0000000
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INDIUM
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S 3
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|
1 1.5325620 0.2617740
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2 0.9442690 -0.6254060
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3 0.1767330 0.6513040
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S 1
|
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|
1 0.0643430 1.0000000
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P 3
|
||
|
1 0.6414740 0.2111030
|
||
|
2 0.3427390 -0.2430290
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||
|
3 0.1095460 -0.5601910
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P 1
|
||
|
1 0.0389580 1.0000000
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TIN
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|
S 3
|
||
|
1 1.6003220 0.6357680
|
||
|
2 1.1663410 -1.0762620
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||
|
3 0.2397610 0.6085820
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||
|
S 1
|
||
|
1 0.0872370 1.0000000
|
||
|
P 3
|
||
|
1 2.1046770 0.0789500
|
||
|
2 1.3710940 -0.1911590
|
||
|
3 0.2013930 0.5425460
|
||
|
P 1
|
||
|
1 0.0659950 1.0000000
|
||
|
|
||
|
ANTIMONY
|
||
|
S 3
|
||
|
1 2.2207990 0.2567130
|
||
|
2 1.2678380 -0.6690110
|
||
|
3 0.2609560 0.6464600
|
||
|
S 1
|
||
|
1 0.1000660 1.0000000
|
||
|
P 3
|
||
|
1 2.1493490 0.1089150
|
||
|
2 1.4342120 -0.2513970
|
||
|
3 0.2426310 0.5739470
|
||
|
P 1
|
||
|
1 0.0834160 1.0000000
|
||
|
|
||
|
TELLURIUM
|
||
|
S 3
|
||
|
1 2.4712220 0.2419560
|
||
|
2 1.5099950 -0.6004880
|
||
|
3 0.2546770 0.7635220
|
||
|
S 1
|
||
|
1 0.1026310 1.0000000
|
||
|
P 3
|
||
|
1 2.3887340 0.1581810
|
||
|
2 1.6441650 -0.3249320
|
||
|
3 0.2899730 0.5856550
|
||
|
P 1
|
||
|
1 0.0967530 1.0000000
|
||
|
P 1
|
||
|
1 0.0297670 1.0000000
|
||
|
|
||
|
IODINE
|
||
|
S 3
|
||
|
1 2.1227650 1.1040280
|
||
|
2 1.7704810 -1.5353260
|
||
|
3 0.3130840 0.7516030
|
||
|
S 1
|
||
|
1 0.1240710 1.0000000
|
||
|
P 3
|
||
|
1 2.4328870 0.4422320
|
||
|
2 2.1372490 -0.5838090
|
||
|
3 0.3145460 0.6266060
|
||
|
P 1
|
||
|
1 0.1049450 1.0000000
|
||
|
P 1
|
||
|
1 0.0326410 1.0000000
|
||
|
|
||
|
XENON
|
||
|
S 3
|
||
|
1 7.8580150 0.0599280
|
||
|
2 3.4957720 -0.6490760
|
||
|
3 1.7588690 1.5298140
|
||
|
S 1
|
||
|
1 0.3147450 1.0000000
|
||
|
S 1
|
||
|
1 0.1511600 1.0000000
|
||
|
S 1
|
||
|
1 0.0712260 1.0000000
|
||
|
P 3
|
||
|
1 3.2145230 0.2110050
|
||
|
2 1.8849440 -0.7126740
|
||
|
3 0.4488760 1.2280800
|
||
|
P 1
|
||
|
1 0.2122320 1.0000000
|
||
|
P 1
|
||
|
1 0.1001150 1.0000000
|
||
|
P 1
|
||
|
1 0.0469790 1.0000000
|
||
|
D 1
|
||
|
1 0.4460000 1.0000000
|
||
|
D 1
|
||
|
1 0.2322000 1.0000000
|
||
|
D 1
|
||
|
1 0.1208000 1.0000000
|
||
|
F 1
|
||
|
1 0.5157000 1.0000000
|
||
|
|
||
|
CESIUM
|
||
|
S 3
|
||
|
1 0.3974310 0.2396470
|
||
|
2 0.2297960 -0.5541720
|
||
|
3 0.0365350 0.2513590
|
||
|
S 1
|
||
|
1 0.0189010 1.0000000
|
||
|
P 3
|
||
|
1 0.1239000 -0.1309060
|
||
|
2 0.0522810 0.1313700
|
||
|
3 0.0218970 0.6195840
|
||
|
P 1
|
||
|
1 0.0095740 1.0000000
|
||
|
|
||
|
BARIUM
|
||
|
S 3
|
||
|
1 0.4928470 0.2289670
|
||
|
2 0.2828440 -0.5810350
|
||
|
3 0.0448740 0.6673080
|
||
|
S 1
|
||
|
1 0.0205860 1.0000000
|
||
|
P 3
|
||
|
1 0.1537520 -0.2715930
|
||
|
2 0.0809870 0.3542340
|
||
|
3 0.0325660 0.6642640
|
||
|
P 1
|
||
|
1 0.0142380 1.0000000
|
||
|
|
||
|
MERCURY
|
||
|
S 3
|
||
|
1 1.3548420 0.2364940
|
||
|
2 0.8288920 -0.5996280
|
||
|
3 0.1339320 0.8463050
|
||
|
S 1
|
||
|
1 0.0510170 1.0000000
|
||
|
P 3
|
||
|
1 1.0001460 0.1449540
|
||
|
2 0.8664530 -0.2049710
|
||
|
3 0.1182060 0.4903010
|
||
|
P 1
|
||
|
1 0.0351550 1.0000000
|
||
|
D 1
|
||
|
1 0.1900000 1.0000000
|
||
|
|
||
|
THALLIUM
|
||
|
S 3
|
||
|
1 1.4633390 0.4254620
|
||
|
2 0.9909960 -0.8297730
|
||
|
3 0.1632550 0.8324440
|
||
|
S 1
|
||
|
1 0.0608020 1.0000000
|
||
|
P 3
|
||
|
1 1.3425020 0.0971080
|
||
|
2 0.9939890 -0.1932540
|
||
|
3 0.1496930 0.5147750
|
||
|
P 1
|
||
|
1 0.0456120 1.0000000
|
||
|
D 1
|
||
|
1 0.1500000 1.0000000
|
||
|
|
||
|
LEAD
|
||
|
S 3
|
||
|
1 1.3051750 1.0104020
|
||
|
2 1.1352820 -1.4023550
|
||
|
3 0.2027710 0.7933720
|
||
|
S 1
|
||
|
1 0.0817960 1.0000000
|
||
|
P 3
|
||
|
1 1.4416840 0.1456260
|
||
|
2 0.9771430 -0.3198630
|
||
|
3 0.1945050 0.5536900
|
||
|
P 1
|
||
|
1 0.0627100 1.0000000
|
||
|
D 1
|
||
|
1 0.1700000 1.0000000
|
||
|
|
||
|
BISMUTH
|
||
|
S 3
|
||
|
1 1.4253880 0.0760080
|
||
|
2 0.9849140 -0.4574080
|
||
|
3 0.2525140 0.7021840
|
||
|
S 1
|
||
|
1 0.1006190 1.0000000
|
||
|
P 3
|
||
|
1 1.5172830 0.3466820
|
||
|
2 1.2533070 -0.5133130
|
||
|
3 0.2079490 0.6484570
|
||
|
P 1
|
||
|
1 0.0694330 1.0000000
|
||
|
D 1
|
||
|
1 0.1700000 1.0000000
|
||
|
|
||
|
POLONIUM
|
||
|
S 3
|
||
|
1 1.9570300 0.3567870
|
||
|
2 1.2992660 -0.8254650
|
||
|
3 0.2844790 0.8602430
|
||
|
S 1
|
||
|
1 0.0994230 1.0000000
|
||
|
P 3
|
||
|
1 1.7311350 0.1738230
|
||
|
2 1.2821620 -0.3364260
|
||
|
3 0.2354460 0.6932420
|
||
|
P 1
|
||
|
1 0.0722990 1.0000000
|
||
|
P 1
|
||
|
1 0.0202070 1.0000000
|
||
|
D 1
|
||
|
1 0.2100000 1.0000000
|
||
|
|
||
|
ASTATINE
|
||
|
S 3
|
||
|
1 1.9624200 0.5190180
|
||
|
2 1.3873590 -1.0256140
|
||
|
3 0.2962310 0.9535080
|
||
|
S 1
|
||
|
1 0.1041270 1.0000000
|
||
|
P 3
|
||
|
1 2.2021380 0.0634430
|
||
|
2 1.3387910 -0.1945740
|
||
|
3 0.2620810 0.6511040
|
||
|
P 1
|
||
|
1 0.0962680 1.0000000
|
||
|
P 1
|
||
|
1 0.0378490 1.0000000
|
||
|
D 1
|
||
|
1 0.2300000 1.0000000
|
||
|
|
||
|
RADON
|
||
|
S 3
|
||
|
1 1.9783250 0.6789880
|
||
|
2 1.5140330 -1.1841590
|
||
|
3 0.3246540 0.9210860
|
||
|
S 1
|
||
|
1 0.1273660 1.0000000
|
||
|
P 3
|
||
|
1 2.0310950 0.2320400
|
||
|
2 1.6561220 -0.3545180
|
||
|
3 0.2983650 0.6651200
|
||
|
P 1
|
||
|
1 0.1032220 1.0000000
|
||
|
D 1
|
||
|
1 0.2600000 1.0000000
|
||
|
|
||
|
ACTINIUM
|
||
|
S 4
|
||
|
1 22.1940300 0.0005820
|
||
|
2 5.1618960 -0.2274570
|
||
|
3 3.4412640 1.1136920
|
||
|
4 2.2941760 -1.3602950
|
||
|
S 1
|
||
|
1 1.5294510 1.0000000
|
||
|
S 1
|
||
|
1 0.3858870 1.0000000
|
||
|
S 1
|
||
|
1 0.1023360 1.0000000
|
||
|
S 1
|
||
|
1 0.0409150 1.0000000
|
||
|
P 4
|
||
|
1 15.5815980 0.0023080
|
||
|
2 10.2112020 -0.0094080
|
||
|
3 4.2944280 0.0724550
|
||
|
4 1.9233260 -0.2925100
|
||
|
P 1
|
||
|
1 0.4718650 1.0000000
|
||
|
P 1
|
||
|
1 0.2073300 1.0000000
|
||
|
P 1
|
||
|
1 0.0613570 1.0000000
|
||
|
P 1
|
||
|
1 0.0230620 1.0000000
|
||
|
D 3
|
||
|
1 4.4321410 0.0035050
|
||
|
2 1.7006940 -0.0472170
|
||
|
3 1.0747940 0.0081990
|
||
|
D 1
|
||
|
1 0.3492750 1.0000000
|
||
|
D 1
|
||
|
1 0.1349570 1.0000000
|
||
|
D 1
|
||
|
1 0.0473780 1.0000000
|
||
|
F 3
|
||
|
1 2.1578980 0.3431490
|
||
|
2 0.7499590 0.4469380
|
||
|
3 0.2244120 0.4292070
|
||
|
F 1
|
||
|
1 0.0557480 1.0000000
|
||
|
F 1
|
||
|
1 0.0071560 1.0000000
|
||
|
G 1
|
||
|
1 0.5100000 1.0000000
|
||
|
G 1
|
||
|
1 0.1800000 1.0000000
|
||
|
|
||
|
THORIUM
|
||
|
S 4
|
||
|
1 10.5166570 0.0330960
|
||
|
2 7.0109060 -0.2339080
|
||
|
3 4.6738090 0.5198480
|
||
|
4 1.8620810 -1.0189420
|
||
|
S 1
|
||
|
1 0.5373270 1.0000000
|
||
|
S 1
|
||
|
1 0.2614820 1.0000000
|
||
|
S 1
|
||
|
1 0.0682570 1.0000000
|
||
|
S 1
|
||
|
1 0.0275220 1.0000000
|
||
|
P 4
|
||
|
1 15.8728110 0.0015590
|
||
|
2 10.5818740 -0.0069170
|
||
|
3 3.9249540 0.1150440
|
||
|
4 2.2082920 -0.3349900
|
||
|
P 1
|
||
|
1 0.4929470 1.0000000
|
||
|
P 1
|
||
|
1 0.2151610 1.0000000
|
||
|
P 1
|
||
|
1 0.0545080 1.0000000
|
||
|
P 1
|
||
|
1 0.0143650 1.0000000
|
||
|
D 3
|
||
|
1 6.0714120 0.0017310
|
||
|
2 1.9840490 -0.0398500
|
||
|
3 0.4607160 0.2696270
|
||
|
D 1
|
||
|
1 0.2185020 1.0000000
|
||
|
D 1
|
||
|
1 0.0987470 1.0000000
|
||
|
D 1
|
||
|
1 0.0418720 1.0000000
|
||
|
F 3
|
||
|
1 2.2991460 0.3237190
|
||
|
2 1.0205490 0.3795530
|
||
|
3 0.4433930 0.3340230
|
||
|
F 1
|
||
|
1 0.1862010 1.0000000
|
||
|
F 1
|
||
|
1 0.0715740 1.0000000
|
||
|
G 1
|
||
|
1 0.5200000 1.0000000
|
||
|
G 1
|
||
|
1 0.2200000 1.0000000
|
||
|
|
||
|
PROTACTINIUM
|
||
|
S 4
|
||
|
1 11.3479200 0.0253300
|
||
|
2 7.0871300 -0.2229290
|
||
|
3 4.7242860 0.5295950
|
||
|
4 1.9345370 -1.0268620
|
||
|
S 1
|
||
|
1 0.5545750 1.0000000
|
||
|
S 1
|
||
|
1 0.2644890 1.0000000
|
||
|
S 1
|
||
|
1 0.0617110 1.0000000
|
||
|
S 1
|
||
|
1 0.0250180 1.0000000
|
||
|
P 4
|
||
|
1 17.4537430 0.0011780
|
||
|
2 7.6978150 -0.0298850
|
||
|
3 5.1322690 0.0983920
|
||
|
4 2.1613490 -0.2977200
|
||
|
P 1
|
||
|
1 0.5246520 1.0000000
|
||
|
P 1
|
||
|
1 0.2265150 1.0000000
|
||
|
P 1
|
||
|
1 0.0531380 1.0000000
|
||
|
P 1
|
||
|
1 0.0137180 1.0000000
|
||
|
D 3
|
||
|
1 6.7811600 0.0020550
|
||
|
2 2.2671730 -0.0397730
|
||
|
3 0.5406500 0.2501230
|
||
|
D 1
|
||
|
1 0.2566310 1.0000000
|
||
|
D 1
|
||
|
1 0.1138060 1.0000000
|
||
|
D 1
|
||
|
1 0.0471060 1.0000000
|
||
|
F 3
|
||
|
1 2.1660530 0.3672780
|
||
|
2 0.9571210 0.4121360
|
||
|
3 0.4186070 0.3133340
|
||
|
F 1
|
||
|
1 0.1770450 1.0000000
|
||
|
F 1
|
||
|
1 0.0673510 1.0000000
|
||
|
G 1
|
||
|
1 0.7000000 1.0000000
|
||
|
G 1
|
||
|
1 0.2000000 1.0000000
|
||
|
|
||
|
URANIUM
|
||
|
S 4
|
||
|
1 12.1252530 0.0219210
|
||
|
2 7.1615450 -0.2251600
|
||
|
3 4.7748360 0.5602990
|
||
|
4 2.0116930 -1.0712090
|
||
|
S 1
|
||
|
1 0.5868520 1.0000000
|
||
|
S 1
|
||
|
1 0.2791150 1.0000000
|
||
|
S 1
|
||
|
1 0.0633720 1.0000000
|
||
|
S 1
|
||
|
1 0.0256110 1.0000000
|
||
|
P 4
|
||
|
1 17.2547700 0.0013980
|
||
|
2 7.7353560 -0.0333460
|
||
|
3 5.1558780 0.1105780
|
||
|
4 2.2416700 -0.3172680
|
||
|
P 1
|
||
|
1 0.5818580 1.0000000
|
||
|
P 1
|
||
|
1 0.2679080 1.0000000
|
||
|
P 1
|
||
|
1 0.0834420 1.0000000
|
||
|
P 1
|
||
|
1 0.0321300 1.0000000
|
||
|
D 3
|
||
|
1 4.8410700 0.0057310
|
||
|
2 2.1601620 -0.0572360
|
||
|
3 0.5756300 0.2388280
|
||
|
D 1
|
||
|
1 0.2781360 1.0000000
|
||
|
D 1
|
||
|
1 0.1248790 1.0000000
|
||
|
D 1
|
||
|
1 0.0515480 1.0000000
|
||
|
F 3
|
||
|
1 2.4364410 0.3550110
|
||
|
2 1.1446820 0.4008460
|
||
|
3 0.5296930 0.3046790
|
||
|
F 1
|
||
|
1 0.2405960 1.0000000
|
||
|
F 1
|
||
|
1 0.1018670 1.0000000
|
||
|
G 1
|
||
|
1 1.1800000 1.0000000
|
||
|
G 1
|
||
|
1 0.4200000 1.0000000
|
||
|
|
||
|
NEPTUNIUM
|
||
|
S 4
|
||
|
1 13.4609030 0.0196310
|
||
|
2 7.7809600 -0.1612090
|
||
|
3 4.6203520 0.5363840
|
||
|
4 2.0983940 -1.1202000
|
||
|
S 1
|
||
|
1 0.6129150 1.0000000
|
||
|
S 1
|
||
|
1 0.2909640 1.0000000
|
||
|
S 1
|
||
|
1 0.0643400 1.0000000
|
||
|
S 1
|
||
|
1 0.0259310 1.0000000
|
||
|
P 4
|
||
|
1 12.7691190 0.0063010
|
||
|
2 8.5105620 -0.0368350
|
||
|
3 5.1851320 0.1181380
|
||
|
4 2.3558060 -0.3255550
|
||
|
P 1
|
||
|
1 0.5770820 1.0000000
|
||
|
P 1
|
||
|
1 0.2463730 1.0000000
|
||
|
P 1
|
||
|
1 0.0549020 1.0000000
|
||
|
P 1
|
||
|
1 0.0138670 1.0000000
|
||
|
D 3
|
||
|
1 4.7617310 0.0071940
|
||
|
2 2.3097960 -0.0585300
|
||
|
3 0.6076910 0.2470820
|
||
|
D 1
|
||
|
1 0.2879910 1.0000000
|
||
|
D 1
|
||
|
1 0.1274170 1.0000000
|
||
|
D 1
|
||
|
1 0.0521610 1.0000000
|
||
|
F 3
|
||
|
1 2.6460180 0.3411570
|
||
|
2 1.3025000 0.4007460
|
||
|
3 0.6025570 0.3174910
|
||
|
F 1
|
||
|
1 0.2624020 1.0000000
|
||
|
F 1
|
||
|
1 0.1011290 1.0000000
|
||
|
G 1
|
||
|
1 1.3100000 1.0000000
|
||
|
G 1
|
||
|
1 0.3700000 1.0000000
|
||
|
|
||
|
PLUTONIUM
|
||
|
S 4
|
||
|
1 12.9393940 0.0087160
|
||
|
2 6.6453900 -0.2082290
|
||
|
3 4.4293300 0.7092390
|
||
|
4 2.2320720 -1.2462920
|
||
|
S 1
|
||
|
1 0.6322700 1.0000000
|
||
|
S 1
|
||
|
1 0.3002480 1.0000000
|
||
|
S 1
|
||
|
1 0.0654080 1.0000000
|
||
|
S 1
|
||
|
1 0.0262790 1.0000000
|
||
|
P 4
|
||
|
1 13.4448440 0.0021300
|
||
|
2 8.9625080 -0.0142420
|
||
|
3 4.1465400 0.1946170
|
||
|
4 2.6559140 -0.4186030
|
||
|
P 1
|
||
|
1 0.5957420 1.0000000
|
||
|
P 1
|
||
|
1 0.2535360 1.0000000
|
||
|
P 1
|
||
|
1 0.0557050 1.0000000
|
||
|
P 1
|
||
|
1 0.0139630 1.0000000
|
||
|
D 3
|
||
|
1 4.4260630 0.0114530
|
||
|
2 2.5068130 -0.0617940
|
||
|
3 0.6223960 0.2690650
|
||
|
D 1
|
||
|
1 0.2853480 1.0000000
|
||
|
D 1
|
||
|
1 0.1234910 1.0000000
|
||
|
D 1
|
||
|
1 0.0502340 1.0000000
|
||
|
F 3
|
||
|
1 2.8431700 0.3069440
|
||
|
2 1.4979210 0.3911510
|
||
|
3 0.7130630 0.3304900
|
||
|
F 1
|
||
|
1 0.3127230 1.0000000
|
||
|
F 1
|
||
|
1 0.1204860 1.0000000
|
||
|
G 1
|
||
|
1 1.5900000 1.0000000
|
||
|
G 1
|
||
|
1 0.4500000 1.0000000
|
||
|
|
||
|
AMERICIUM
|
||
|
S 4
|
||
|
1 8.0784100 -0.1888230
|
||
|
2 5.3856070 0.6640350
|
||
|
3 3.5904040 -0.1589370
|
||
|
4 2.3936030 -1.0980600
|
||
|
S 1
|
||
|
1 0.8842150 1.0000000
|
||
|
S 1
|
||
|
1 0.3796470 1.0000000
|
||
|
S 1
|
||
|
1 0.0706530 1.0000000
|
||
|
S 1
|
||
|
1 0.0285350 1.0000000
|
||
|
P 4
|
||
|
1 13.1928620 0.0023030
|
||
|
2 8.7943810 -0.0161990
|
||
|
3 4.1701030 0.2273360
|
||
|
4 2.7798220 -0.4524170
|
||
|
P 1
|
||
|
1 0.6207000 1.0000000
|
||
|
P 1
|
||
|
1 0.2625320 1.0000000
|
||
|
P 1
|
||
|
1 0.0565640 1.0000000
|
||
|
P 1
|
||
|
1 0.0140170 1.0000000
|
||
|
D 3
|
||
|
1 4.7379970 0.0096180
|
||
|
2 2.5473960 -0.0597000
|
||
|
3 0.6685140 0.2456710
|
||
|
D 1
|
||
|
1 0.3095740 1.0000000
|
||
|
D 1
|
||
|
1 0.1342570 1.0000000
|
||
|
D 1
|
||
|
1 0.0538380 1.0000000
|
||
|
F 3
|
||
|
1 15.8487130 0.0051350
|
||
|
2 2.9128810 0.3509070
|
||
|
3 1.3806330 0.4442870
|
||
|
F 1
|
||
|
1 0.5687520 1.0000000
|
||
|
F 1
|
||
|
1 0.2032570 1.0000000
|
||
|
G 1
|
||
|
1 1.7100000 1.0000000
|
||
|
G 1
|
||
|
1 0.5100000 1.0000000
|
||
|
|
||
|
CURIUM
|
||
|
S 4
|
||
|
1 10.3780570 0.1489790
|
||
|
2 6.9194130 -1.0464340
|
||
|
3 4.6124700 2.6281060
|
||
|
4 2.9225060 -2.5507410
|
||
|
S 1
|
||
|
1 0.6925480 1.0000000
|
||
|
S 1
|
||
|
1 0.3252690 1.0000000
|
||
|
S 1
|
||
|
1 0.0719370 1.0000000
|
||
|
S 1
|
||
|
1 0.0284880 1.0000000
|
||
|
P 4
|
||
|
1 13.5512720 0.0029010
|
||
|
2 9.0334230 -0.0171440
|
||
|
3 4.2198500 0.2298140
|
||
|
4 2.8129820 -0.4565430
|
||
|
P 1
|
||
|
1 0.6329320 1.0000000
|
||
|
P 1
|
||
|
1 0.2674550 1.0000000
|
||
|
P 1
|
||
|
1 0.0573670 1.0000000
|
||
|
P 1
|
||
|
1 0.0142630 1.0000000
|
||
|
D 3
|
||
|
1 4.6918850 0.0099220
|
||
|
2 2.6067960 -0.0560920
|
||
|
3 0.6715960 0.2344090
|
||
|
D 1
|
||
|
1 0.3058520 1.0000000
|
||
|
D 1
|
||
|
1 0.1302170 1.0000000
|
||
|
D 1
|
||
|
1 0.0509310 1.0000000
|
||
|
F 3
|
||
|
1 14.0677900 0.0098400
|
||
|
2 3.2430340 0.3505310
|
||
|
3 1.5613510 0.4651530
|
||
|
F 1
|
||
|
1 0.6350000 1.0000000
|
||
|
F 1
|
||
|
1 0.2237200 1.0000000
|
||
|
G 1
|
||
|
1 2.0000000 1.0000000
|
||
|
G 1
|
||
|
1 0.6000000 1.0000000
|
||
|
|
||
|
BERKELIUM
|
||
|
S 4
|
||
|
1 11.1885950 0.1082070
|
||
|
2 7.4583660 -0.7838590
|
||
|
3 4.9717790 2.0043850
|
||
|
4 3.0303410 -2.1197910
|
||
|
S 1
|
||
|
1 0.7476860 1.0000000
|
||
|
S 1
|
||
|
1 0.3513140 1.0000000
|
||
|
S 1
|
||
|
1 0.0755400 1.0000000
|
||
|
S 1
|
||
|
1 0.0297670 1.0000000
|
||
|
P 4
|
||
|
1 9.1227940 -0.0191240
|
||
|
2 6.0818630 0.0549250
|
||
|
3 4.0545750 0.1216600
|
||
|
4 2.7030500 -0.4251490
|
||
|
P 1
|
||
|
1 0.7046200 1.0000000
|
||
|
P 1
|
||
|
1 0.2971790 1.0000000
|
||
|
P 1
|
||
|
1 0.0607040 1.0000000
|
||
|
P 1
|
||
|
1 0.0149380 1.0000000
|
||
|
D 3
|
||
|
1 4.9745860 0.0092270
|
||
|
2 2.7232250 -0.0527810
|
||
|
3 0.6956860 0.2366330
|
||
|
D 1
|
||
|
1 0.3057570 1.0000000
|
||
|
D 1
|
||
|
1 0.1261230 1.0000000
|
||
|
D 1
|
||
|
1 0.0481280 1.0000000
|
||
|
F 3
|
||
|
1 14.4907480 0.0093760
|
||
|
2 3.1677510 0.3504540
|
||
|
3 1.5355330 0.4662840
|
||
|
F 1
|
||
|
1 0.6321710 1.0000000
|
||
|
F 1
|
||
|
1 0.2241100 1.0000000
|
||
|
G 1
|
||
|
1 1.9400000 1.0000000
|
||
|
G 1
|
||
|
1 0.5800000 1.0000000
|
||
|
|
||
|
CALIFORNIUM
|
||
|
S 4
|
||
|
1 10.4687000 0.1846040
|
||
|
2 6.9795690 -1.2965940
|
||
|
3 4.6527560 3.4178270
|
||
|
4 3.1020310 -3.2195380
|
||
|
S 1
|
||
|
1 0.7821150 1.0000000
|
||
|
S 1
|
||
|
1 0.3689890 1.0000000
|
||
|
S 1
|
||
|
1 0.0770900 1.0000000
|
||
|
S 1
|
||
|
1 0.0303740 1.0000000
|
||
|
P 4
|
||
|
1 9.1227940 -0.0202820
|
||
|
2 6.0818630 0.0638650
|
||
|
3 4.0545750 0.1004600
|
||
|
4 2.7030500 -0.4123110
|
||
|
P 1
|
||
|
1 0.7322650 1.0000000
|
||
|
P 1
|
||
|
1 0.3079780 1.0000000
|
||
|
P 1
|
||
|
1 0.0616650 1.0000000
|
||
|
P 1
|
||
|
1 0.0150500 1.0000000
|
||
|
D 3
|
||
|
1 3.7360750 0.0136870
|
||
|
2 2.4902140 -0.0690280
|
||
|
3 0.8888290 0.1565290
|
||
|
D 1
|
||
|
1 0.3844070 1.0000000
|
||
|
D 1
|
||
|
1 0.1497000 1.0000000
|
||
|
D 1
|
||
|
1 0.0531450 1.0000000
|
||
|
F 3
|
||
|
1 14.2301040 0.0120850
|
||
|
2 3.3861670 0.3221160
|
||
|
3 1.6617850 0.4611230
|
||
|
F 1
|
||
|
1 0.6834420 1.0000000
|
||
|
F 1
|
||
|
1 0.2416560 1.0000000
|
||
|
G 1
|
||
|
1 2.0200000 1.0000000
|
||
|
G 1
|
||
|
1 0.6300000 1.0000000
|
||
|
|
||
|
EINSTEINIUM
|
||
|
S 4
|
||
|
1 10.6465220 0.1761280
|
||
|
2 7.0976810 -1.2641950
|
||
|
3 4.7317870 3.3976820
|
||
|
4 3.1545250 -3.2554800
|
||
|
S 1
|
||
|
1 0.8135990 1.0000000
|
||
|
S 1
|
||
|
1 0.3846960 1.0000000
|
||
|
S 1
|
||
|
1 0.0786830 1.0000000
|
||
|
S 1
|
||
|
1 0.0309250 1.0000000
|
||
|
P 4
|
||
|
1 8.8997400 -0.0294250
|
||
|
2 5.9331600 0.1152900
|
||
|
3 3.9554400 0.0081060
|
||
|
4 2.6369600 -0.3815860
|
||
|
P 1
|
||
|
1 0.7654780 1.0000000
|
||
|
P 1
|
||
|
1 0.3208260 1.0000000
|
||
|
P 1
|
||
|
1 0.0628750 1.0000000
|
||
|
P 1
|
||
|
1 0.0152460 1.0000000
|
||
|
D 3
|
||
|
1 4.7675570 0.0133700
|
||
|
2 2.9571700 -0.0537940
|
||
|
3 0.7222570 0.2413910
|
||
|
D 1
|
||
|
1 0.3087550 1.0000000
|
||
|
D 1
|
||
|
1 0.1244680 1.0000000
|
||
|
D 1
|
||
|
1 0.0465140 1.0000000
|
||
|
F 3
|
||
|
1 14.4143500 0.0156580
|
||
|
2 3.6407300 0.3169930
|
||
|
3 1.8056490 0.4821520
|
||
|
F 1
|
||
|
1 0.7412470 1.0000000
|
||
|
F 1
|
||
|
1 0.2612550 1.0000000
|
||
|
G 1
|
||
|
1 2.0800000 1.0000000
|
||
|
G 1
|
||
|
1 0.6500000 1.0000000
|
||
|
|
||
|
FERMIUM
|
||
|
S 4
|
||
|
1 10.7588270 0.1814860
|
||
|
2 7.1725510 -1.2994410
|
||
|
3 4.7817010 3.4979230
|
||
|
4 3.1878000 -3.3675860
|
||
|
S 1
|
||
|
1 0.8520540 1.0000000
|
||
|
S 1
|
||
|
1 0.4054190 1.0000000
|
||
|
S 1
|
||
|
1 0.0802740 1.0000000
|
||
|
S 1
|
||
|
1 0.0314830 1.0000000
|
||
|
P 4
|
||
|
1 7.3672040 -0.0364020
|
||
|
2 4.9108760 0.2272540
|
||
|
3 2.9729090 -0.4722210
|
||
|
4 0.7879560 0.6979440
|
||
|
P 1
|
||
|
1 0.3532160 1.0000000
|
||
|
P 1
|
||
|
1 0.1181410 1.0000000
|
||
|
P 1
|
||
|
1 0.0403570 1.0000000
|
||
|
P 1
|
||
|
1 0.0108980 1.0000000
|
||
|
D 3
|
||
|
1 4.7916180 0.0146930
|
||
|
2 3.0489580 -0.0545640
|
||
|
3 0.7441840 0.2432000
|
||
|
D 1
|
||
|
1 0.3165720 1.0000000
|
||
|
D 1
|
||
|
1 0.1269570 1.0000000
|
||
|
D 1
|
||
|
1 0.0471480 1.0000000
|
||
|
F 3
|
||
|
1 14.8061920 0.0183250
|
||
|
2 3.9000190 0.2950550
|
||
|
3 1.9457800 0.4932440
|
||
|
F 1
|
||
|
1 0.7981540 1.0000000
|
||
|
F 1
|
||
|
1 0.2802310 1.0000000
|
||
|
G 1
|
||
|
1 2.2100000 1.0000000
|
||
|
G 1
|
||
|
1 0.7000000 1.0000000
|
||
|
|
||
|
MENDELEVIUM
|
||
|
S 4
|
||
|
1 10.4785060 0.2443880
|
||
|
2 6.9856710 -1.6753500
|
||
|
3 4.6571140 4.3401660
|
||
|
4 3.1047420 -4.0874640
|
||
|
S 1
|
||
|
1 0.9440160 1.0000000
|
||
|
S 1
|
||
|
1 0.4613860 1.0000000
|
||
|
S 1
|
||
|
1 0.0809620 1.0000000
|
||
|
S 1
|
||
|
1 0.0318010 1.0000000
|
||
|
P 4
|
||
|
1 7.2938400 -0.0361000
|
||
|
2 4.8630470 0.2511630
|
||
|
3 3.0403170 -0.5130490
|
||
|
4 0.8629920 0.6465640
|
||
|
P 1
|
||
|
1 0.4227390 1.0000000
|
||
|
P 1
|
||
|
1 0.1923680 1.0000000
|
||
|
P 1
|
||
|
1 0.0501460 1.0000000
|
||
|
P 1
|
||
|
1 0.0040390 1.0000000
|
||
|
D 3
|
||
|
1 5.3500450 0.0101030
|
||
|
2 3.0106320 -0.0501600
|
||
|
3 0.7653980 0.2483860
|
||
|
D 1
|
||
|
1 0.3203070 1.0000000
|
||
|
D 1
|
||
|
1 0.1264090 1.0000000
|
||
|
D 1
|
||
|
1 0.0464610 1.0000000
|
||
|
F 3
|
||
|
1 15.3181320 0.0202410
|
||
|
2 4.1456120 0.2721840
|
||
|
3 2.0723740 0.5039190
|
||
|
F 1
|
||
|
1 0.8513500 1.0000000
|
||
|
F 1
|
||
|
1 0.2981560 1.0000000
|
||
|
G 1
|
||
|
1 2.3000000 1.0000000
|
||
|
G 1
|
||
|
1 0.7300000 1.0000000
|
||
|
|
||
|
NOBELIUM
|
||
|
S 4
|
||
|
1 10.5500640 0.2460360
|
||
|
2 7.0333770 -1.6659760
|
||
|
3 4.6889170 4.2797680
|
||
|
4 3.1259450 -4.0009080
|
||
|
S 1
|
||
|
1 0.9136190 1.0000000
|
||
|
S 1
|
||
|
1 0.4335410 1.0000000
|
||
|
S 1
|
||
|
1 0.0705070 1.0000000
|
||
|
S 1
|
||
|
1 0.0277230 1.0000000
|
||
|
P 4
|
||
|
1 7.2126040 -0.0315180
|
||
|
2 4.8084910 0.2350020
|
||
|
3 3.0269210 -0.4843320
|
||
|
4 0.8335940 0.6465870
|
||
|
P 1
|
||
|
1 0.3842610 1.0000000
|
||
|
P 1
|
||
|
1 0.1619280 1.0000000
|
||
|
P 1
|
||
|
1 0.0392760 1.0000000
|
||
|
P 1
|
||
|
1 0.0096540 1.0000000
|
||
|
D 3
|
||
|
1 2.2472690 -0.0290700
|
||
|
2 0.8464050 0.1094090
|
||
|
3 0.3358880 0.2305710
|
||
|
D 1
|
||
|
1 0.1253000 1.0000000
|
||
|
D 1
|
||
|
1 0.0466790 1.0000000
|
||
|
D 1
|
||
|
1 0.0173090 1.0000000
|
||
|
F 3
|
||
|
1 16.8637190 0.0231750
|
||
|
2 4.9464410 0.2204960
|
||
|
3 2.4231320 0.5148740
|
||
|
F 1
|
||
|
1 0.9882010 1.0000000
|
||
|
F 1
|
||
|
1 0.3418850 1.0000000
|
||
|
G 1
|
||
|
1 2.5600000 1.0000000
|
||
|
G 1
|
||
|
1 0.8200000 1.0000000
|
||
|
|
||
|
LAWRENCIUM
|
||
|
S 4
|
||
|
1 10.1456750 0.3039820
|
||
|
2 6.7643220 -2.0335410
|
||
|
3 4.5095480 5.1691290
|
||
|
4 3.0063650 -4.8520130
|
||
|
S 1
|
||
|
1 1.0737890 1.0000000
|
||
|
S 1
|
||
|
1 0.5279120 1.0000000
|
||
|
S 1
|
||
|
1 0.0858790 1.0000000
|
||
|
S 1
|
||
|
1 0.0339150 1.0000000
|
||
|
P 4
|
||
|
1 6.9311460 -0.0346010
|
||
|
2 4.6204770 0.3009700
|
||
|
3 3.1317520 -0.5515050
|
||
|
4 0.8384750 0.6690650
|
||
|
P 1
|
||
|
1 0.3963410 1.0000000
|
||
|
P 1
|
||
|
1 0.1675290 1.0000000
|
||
|
P 1
|
||
|
1 0.0625550 1.0000000
|
||
|
P 1
|
||
|
1 0.0231000 1.0000000
|
||
|
D 3
|
||
|
1 4.6951760 -0.0154400
|
||
|
2 3.1304290 0.0477220
|
||
|
3 0.7128390 -0.2309240
|
||
|
D 1
|
||
|
1 0.2845060 1.0000000
|
||
|
D 1
|
||
|
1 0.1069760 1.0000000
|
||
|
D 1
|
||
|
1 0.0376250 1.0000000
|
||
|
F 3
|
||
|
1 20.1066180 0.0225040
|
||
|
2 6.3747990 0.1614720
|
||
|
3 2.9695080 0.5336010
|
||
|
F 1
|
||
|
1 1.2481740 1.0000000
|
||
|
F 1
|
||
|
1 0.4429700 1.0000000
|
||
|
G 1
|
||
|
1 2.9100000 1.0000000
|
||
|
G 1
|
||
|
1 0.9500000 1.0000000
|
||
|
|
||
|
|