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@enzobrennerp
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22 51 1 0 0 0 0
22 52 1 0 0 0 0
M END
> <MOL Chiral Flag>
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Esses dados daqui em diante não precisariam estar aqui, parece que o pubchem está adicionando algo a mais aqui. Revisar e comparar com outros arquivos para ver como deveria ser.

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Veja o comentário na molécula do cardanol.

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2 participants