
     RDKit          2D

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  1  2  1  0
  2  3  1  0
  3  4  2  0
  5  3  1  1
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
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 52 51  1  1
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 53 54  1  0
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 55 56  1  0
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 58 59  3  0
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 62 64  1  0
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 72 73  2  0
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  9  5  1  0
 19 14  1  0
 34 29  1  0
 40 35  1  0
 46 41  1  0
 56 52  1  0
 67 60  1  0
 75 70  1  0
M  CHG  2  57  -1  58   1
M  END
$$$$
