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24 lines
684 B
Plaintext
24 lines
684 B
Plaintext
4
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MACCS-II FROM NCI/DIS
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121-66-4
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9 9
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0.0000 0.0000 0.0000 N 0 0 0 0 0
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0.0000 0.0000 0.0000 O 0 0 0 0 0
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0.0000 0.0000 0.0000 O 0 0 0 0 0
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0.0000 0.0000 0.0000 C 0 0 0 0 0
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0.0000 0.0000 0.0000 S 0 0 0 0 0
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0.0000 0.0000 0.0000 C 0 0 0 0 0
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0.0000 0.0000 0.0000 C 0 0 0 0 0
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0.0000 0.0000 0.0000 N 0 0 0 0 0
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0.0000 0.0000 0.0000 N 0 0 0 0 0
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2 1 2 0 0 0
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3 1 2 0 0 0
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4 1 1 0 0 0
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5 4 1 0 0 0
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6 4 2 0 0 0
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7 5 1 0 0 0
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8 6 1 0 0 0
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9 7 2 0 0 0
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7 8 1 0 0 0
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M END
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