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8c9795f535
* Fixes #2225 * A bit of extra cleanup * forgotten file * Make this thread safe and add support for v3K mol blocks * add the file * update expected results
27 lines
554 B
Plaintext
27 lines
554 B
Plaintext
MJ150720
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Mrv1824 01171906232D
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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 7 7 0 0 0
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M V30 BEGIN ATOM
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M V30 1 C -4.7917 1.5609 0 0
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M V30 2 C -6.1253 0.7909 0 0
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M V30 3 C -6.1253 -0.7491 0 0
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M V30 4 C -4.7917 -1.5191 0 0
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M V30 5 C -3.458 -0.7491 0 0
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M V30 6 C -3.458 0.7909 0 0
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M V30 7 Q -4.7917 3.1009 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 2 3
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M V30 3 2 3 4
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M V30 4 1 4 5
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M V30 5 2 5 6
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M V30 6 1 6 1
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M V30 7 1 1 7
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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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