mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-12-22 19:43:32 +01:00
255 lines
10 KiB
Plaintext
255 lines
10 KiB
Plaintext
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TITANIUM
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S 17
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S 17
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S 16
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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 10
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P 10
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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 4
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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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F 1
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F 1
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G 1
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1 0.6300000 1.0000000
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IRON
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S 18
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1 4316265.3000000 0.0000090
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2 646342.4200000 0.0000670
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18 0.1467570 0.0000560
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S 18
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1 4316265.3000000 -0.0000030
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2 646342.4200000 -0.0000200
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S 18
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1 4316265.3000000 0.0000010
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2 646342.4200000 0.0000080
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S 17
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1 646342.4200000 0.0000020
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S 1
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S 1
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P 9
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P 1
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D 5
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G 1
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