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https://github.com/rdkit/rdkit.git
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30 lines
1.2 KiB
Plaintext
30 lines
1.2 KiB
Plaintext
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12 13 0 0 0 0 0 0 0 0 1 V2000
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0.0 0.0 0.0 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 O 0 0 0 0 0 0 0 0 0 0 0 0
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0.0 0.0 0.0 H 0 0 0 0 0 0 0 0 0 0 0 0
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1 2 1 0 0 0 0
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1 5 1 0 0 0 0
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1 6 1 0 0 0 0
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1 7 1 0 0 0 0
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2 3 2 0 0 0 0
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2 11 1 0 0 0 0
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3 4 1 0 0 0 0
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3 11 1 0 0 0 0
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4 5 1 0 0 0 0
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4 8 1 0 0 0 0
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4 12 1 0 0 0 0
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5 9 1 0 0 0 0
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5 10 1 0 0 0 0
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M END |