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8009b867b5
* backup commit * typo * forgot the test file * also test that atom chirality is handled properly
20 lines
380 B
Plaintext
20 lines
380 B
Plaintext
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Mrv1561 08241614192D
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0 0 0 0 0 999 V3000
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M V30 BEGIN CTAB
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M V30 COUNTS 4 3 0 0 0
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M V30 BEGIN ATOM
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M V30 1 C -9.8333 0.4583 0 0
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M V30 2 C -8.4933 0.4583 0 0
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M V30 3 C -10.6033 1.792 0 0
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M V30 4 C -7.7233 -0.8753 0 0
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M V30 END ATOM
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M V30 BEGIN BOND
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M V30 1 2 1 2
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M V30 2 1 1 3
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M V30 3 1 2 4 CFG=2
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M V30 END BOND
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M V30 END CTAB
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M END
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