mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-12-22 19:43:32 +01:00
1002 lines
27 KiB
Plaintext
1002 lines
27 KiB
Plaintext
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SCANDIUM
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1 14228140.0000000 1.0000000
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S 1
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1 2129471.0000000 1.0000000
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S 1
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1 484447.9000000 1.0000000
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S 1
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1 137186.9000000 1.0000000
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S 1
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1 44749.8500000 1.0000000
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S 1
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1 16154.4900000 1.0000000
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S 1
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1 6300.9270000 1.0000000
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S 1
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1 2613.8920000 1.0000000
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S 1
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1 1140.6110000 1.0000000
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S 1
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1 519.1924000 1.0000000
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S 1
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1 244.8586000 1.0000000
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S 1
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1 119.0198000 1.0000000
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S 1
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1 59.3018400 1.0000000
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S 1
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1 29.8943600 1.0000000
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S 1
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1 14.1487700 1.0000000
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S 1
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1 7.1230790 1.0000000
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S 1
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1 3.6024530 1.0000000
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S 1
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1 1.6481300 1.0000000
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S 1
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1 0.8014280 1.0000000
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S 1
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1 0.3761780 1.0000000
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S 1
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1 0.0977590 1.0000000
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S 1
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1 0.0477060 1.0000000
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S 1
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1 0.0222420 1.0000000
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P 1
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1 15494.1000000 1.0000000
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P 1
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1 3666.6120000 1.0000000
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P 1
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1 1190.9240000 1.0000000
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P 1
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1 455.9083000 1.0000000
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P 1
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1 193.6241000 1.0000000
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P 1
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1 88.3229900 1.0000000
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P 1
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1 42.4671900 1.0000000
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P 1
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1 21.1481200 1.0000000
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P 1
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1 10.7603000 1.0000000
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P 1
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1 5.5703580 1.0000000
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P 1
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1 2.8766040 1.0000000
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P 1
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1 1.4537960 1.0000000
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P 1
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1 0.7190290 1.0000000
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P 1
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1 0.3460740 1.0000000
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P 1
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1 0.1419070 1.0000000
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D 1
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1 232.9690000 1.0000000
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D 1
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1 69.7482300 1.0000000
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D 1
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1 26.9284400 1.0000000
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D 1
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1 11.6380500 1.0000000
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D 1
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1 5.3198170 1.0000000
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D 1
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1 2.5503140 1.0000000
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D 1
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1 1.2418130 1.0000000
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D 1
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1 0.6006520 1.0000000
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D 1
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1 0.2861940 1.0000000
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D 1
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1 0.1319550 1.0000000
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D 1
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1 0.0572870 1.0000000
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TITANIUM
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S 1
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1 15688460.0000000 1.0000000
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S 1
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1 2348898.0000000 1.0000000
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S 1
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1 534521.8000000 1.0000000
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S 1
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1 151404.7000000 1.0000000
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S 1
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1 49398.7500000 1.0000000
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S 1
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1 17836.3900000 1.0000000
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S 1
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1 6958.2960000 1.0000000
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S 1
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1 2887.1390000 1.0000000
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S 1
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1 1260.0750000 1.0000000
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S 1
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1 573.6763000 1.0000000
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S 1
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1 270.6123000 1.0000000
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S 1
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1 131.5738000 1.0000000
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S 1
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1 65.5831100 1.0000000
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S 1
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1 33.0887500 1.0000000
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S 1
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1 15.6988800 1.0000000
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S 1
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1 7.9331840 1.0000000
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S 1
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1 4.0251500 1.0000000
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S 1
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1 1.8541480 1.0000000
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S 1
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1 0.9007890 1.0000000
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S 1
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1 0.4218080 1.0000000
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S 1
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1 0.1085430 1.0000000
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S 1
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1 0.0520430 1.0000000
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S 1
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1 0.0239520 1.0000000
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P 1
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1 17401.2000000 1.0000000
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P 1
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1 4118.6290000 1.0000000
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P 1
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1 1337.9480000 1.0000000
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P 1
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1 512.2883000 1.0000000
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P 1
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1 217.6497000 1.0000000
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P 1
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1 99.3449300 1.0000000
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P 1
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1 47.8083000 1.0000000
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P 1
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1 23.8407100 1.0000000
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P 1
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1 12.1557200 1.0000000
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P 1
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1 6.3079780 1.0000000
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P 1
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1 3.2660550 1.0000000
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P 1
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1 1.6553820 1.0000000
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P 1
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1 0.8203180 1.0000000
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P 1
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1 0.3949300 1.0000000
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P 1
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1 0.1625260 1.0000000
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D 1
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1 292.1649000 1.0000000
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D 1
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1 87.4401800 1.0000000
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D 1
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1 33.7444400 1.0000000
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D 1
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1 14.6443400 1.0000000
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D 1
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1 6.7292290 1.0000000
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D 1
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1 3.2411920 1.0000000
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D 1
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1 1.5897870 1.0000000
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D 1
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1 0.7750830 1.0000000
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D 1
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1 0.3719630 1.0000000
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D 1
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1 0.1724550 1.0000000
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D 1
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1 0.0746870 1.0000000
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VANADIUM
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S 1
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1 17242380.0000000 1.0000000
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S 1
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1 2581538.0000000 1.0000000
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S 1
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1 587483.2000000 1.0000000
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S 1
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1 166412.7000000 1.0000000
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S 1
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1 54297.2000000 1.0000000
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S 1
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1 19605.5700000 1.0000000
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S 1
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1 7648.6050000 1.0000000
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S 1
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1 3173.5880000 1.0000000
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S 1
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1 1385.1060000 1.0000000
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S 1
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1 630.6174000 1.0000000
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S 1
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1 297.4967000 1.0000000
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S 1
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1 144.6682000 1.0000000
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S 1
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1 72.1311500 1.0000000
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S 1
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1 36.4185600 1.0000000
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S 1
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1 17.3129200 1.0000000
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S 1
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1 8.7753250 1.0000000
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S 1
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1 4.4631810 1.0000000
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S 1
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1 2.0656460 1.0000000
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S 1
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1 1.0019660 1.0000000
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S 1
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1 0.4679380 1.0000000
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S 1
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1 0.1188030 1.0000000
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S 1
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1 0.0561220 1.0000000
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S 1
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1 0.0255500 1.0000000
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P 1
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1 19450.8800000 1.0000000
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P 1
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1 4603.3660000 1.0000000
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P 1
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1 1495.3130000 1.0000000
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P 1
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1 572.5294000 1.0000000
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P 1
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1 243.2758000 1.0000000
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P 1
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1 111.0804000 1.0000000
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P 1
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1 53.4865800 1.0000000
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P 1
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1 26.7007400 1.0000000
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P 1
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1 13.6375900 1.0000000
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P 1
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1 7.0910430 1.0000000
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P 1
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1 3.6792360 1.0000000
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P 1
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1 1.8687360 1.0000000
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P 1
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1 0.9271050 1.0000000
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P 1
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1 0.4463160 1.0000000
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P 1
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1 0.1843720 1.0000000
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D 1
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1 332.1785000 1.0000000
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D 1
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1 99.6685400 1.0000000
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D 1
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1 38.5666700 1.0000000
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D 1
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1 16.8067800 1.0000000
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D 1
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1 7.7667940 1.0000000
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D 1
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1 3.7601230 1.0000000
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D 1
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1 1.8530900 1.0000000
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D 1
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1 0.9072600 1.0000000
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D 1
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1 0.4365920 1.0000000
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D 1
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1 0.2026990 1.0000000
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D 1
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1 0.0875540 1.0000000
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CHROMIUM
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S 1
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1 18273400.0000000 1.0000000
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S 1
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1 2736169.0000000 1.0000000
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S 1
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1 622721.5000000 1.0000000
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S 1
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1 176403.1000000 1.0000000
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S 1
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1 57557.1200000 1.0000000
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S 1
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1 20782.0500000 1.0000000
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S 1
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1 8107.2140000 1.0000000
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S 1
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1 3363.6970000 1.0000000
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S 1
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1 1467.9890000 1.0000000
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S 1
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1 668.3000000 1.0000000
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S 1
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1 315.2450000 1.0000000
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S 1
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1 153.2895000 1.0000000
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S 1
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1 76.4313000 1.0000000
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S 1
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1 38.6244500 1.0000000
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S 1
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1 18.4522900 1.0000000
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S 1
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1 9.3682850 1.0000000
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S 1
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1 4.7709900 1.0000000
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S 1
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1 2.1955980 1.0000000
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S 1
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1 1.0522080 1.0000000
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S 1
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1 0.4815670 1.0000000
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S 1
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1 0.1174470 1.0000000
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S 1
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1 0.0559040 1.0000000
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S 1
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1 0.0252330 1.0000000
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P 1
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1 21337.7900000 1.0000000
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P 1
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1 5049.4980000 1.0000000
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P 1
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1 1640.1310000 1.0000000
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P 1
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1 627.9602000 1.0000000
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P 1
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1 266.8501000 1.0000000
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P 1
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1 121.8754000 1.0000000
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P 1
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1 58.7085600 1.0000000
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P 1
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1 29.3272500 1.0000000
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P 1
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1 14.9964900 1.0000000
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P 1
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1 7.8050300 1.0000000
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P 1
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1 4.0493280 1.0000000
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P 1
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1 2.0563890 1.0000000
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P 1
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1 1.0157240 1.0000000
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P 1
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1 0.4844630 1.0000000
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P 1
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1 0.2035720 1.0000000
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D 1
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1 317.6249000 1.0000000
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D 1
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1 95.2146500 1.0000000
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D 1
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1 36.7953200 1.0000000
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D 1
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1 15.9388600 1.0000000
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D 1
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1 7.3309550 1.0000000
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D 1
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1 3.5220990 1.0000000
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D 1
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1 1.7073720 1.0000000
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D 1
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1 0.8147770 1.0000000
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D 1
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1 0.3775320 1.0000000
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D 1
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1 0.1678180 1.0000000
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D 1
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1 0.0699560 1.0000000
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MANGANESE
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S 1
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1 20492660.0000000 1.0000000
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S 1
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1 3068183.0000000 1.0000000
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S 1
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1 698235.9000000 1.0000000
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S 1
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1 197786.6000000 1.0000000
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S 1
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1 64534.0200000 1.0000000
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S 1
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1 23301.7500000 1.0000000
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S 1
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1 9090.4910000 1.0000000
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S 1
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1 3771.8210000 1.0000000
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S 1
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