File: tautomer.sdf

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file content (46 lines) | stat: -rw-r--r-- 1,552 bytes parent folder | download | duplicates (5)
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  Amide

  8  7  0  0  0  0  0  0  0  0999 V2000
   -5.2545    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5114    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7683    3.3355    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5114    4.6227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9977    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7408    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0251    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2820    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
M  END



$$$$

  Imide

  8  7  0  0  0  0  0  0  0  0999 V2000
   -5.2545    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5114    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7683    3.3355    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5114    4.6227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9977    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7408    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0251    3.7646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2820    3.3355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
M  END