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23 lines
871 B
Plaintext
23 lines
871 B
Plaintext
CHEBI:30113
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Marvin 03261211572D
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8 8 0 0 0 0 999 V2000
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-2.1458 1.2083 0.0000 Cl 0 0 0 0 0 1 0 0 0 0 0 0
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-2.1458 0.0416 0.0000 Cl 0 0 0 0 0 1 0 0 0 0 0 0
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-1.5624 0.6250 0.0000 Al 0 5 0 0 0 4 0 0 0 0 0 0
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-0.9790 1.2083 0.0000 Cl 0 3 0 0 0 2 0 0 0 0 0 0
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-0.9790 0.0219 0.0000 Cl 0 3 0 0 0 2 0 0 0 0 0 0
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0.1876 1.2083 0.0000 Cl 0 0 0 0 0 1 0 0 0 0 0 0
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-0.3826 0.6250 0.0000 Al 0 5 0 0 0 4 0 0 0 0 0 0
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0.1876 0.0416 0.0000 Cl 0 0 0 0 0 1 0 0 0 0 0 0
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3 1 1 0 0 0 0
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3 4 1 0 0 0 0
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3 2 1 0 0 0 0
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3 5 1 0 0 0 0
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7 4 1 0 0 0 0
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7 5 1 0 0 0 0
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7 6 1 0 0 0 0
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7 8 1 0 0 0 0
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M CHG 4 3 -1 4 1 5 1 7 -1
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M END
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