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26 lines
1.1 KiB
Plaintext
26 lines
1.1 KiB
Plaintext
CHEBI:28227
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Marvin 11190719022D
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11 10 0 0 1 0 999 V2000
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2.1434 -0.1768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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1.4289 0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-0.7145 -0.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0000 0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.7145 -0.1768 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
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-2.1434 -0.1768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
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-1.4289 0.2357 0.0000 S 0 0 1 0 0 0 0 0 0 0 0 0
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0.7144 -1.0017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
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1.4290 1.0607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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-1.4289 1.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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-1.4289 -0.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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2 1 1 0 0 0 0
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2 9 2 0 0 0 0
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3 4 1 0 0 0 0
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5 2 1 0 0 0 0
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4 5 1 0 0 0 0
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5 8 1 1 0 0 0
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7 6 2 0 0 0 0
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7 3 1 0 0 0 0
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7 10 2 0 0 0 0
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7 11 1 6 0 0 0
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M END |