File: diethylether.mol

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rdkit 202503.6-3
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file content (22 lines) | stat: -rw-r--r-- 806 bytes parent folder | download | duplicates (4)
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     RDKit          3D

  9  8  0  0  0  0  0  0  0  0999 V2000
    1.1671   -0.0430    0.1359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0465    0.8308    0.1212 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1625    0.1252   -0.1239 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2774   -0.5409   -0.8323 H   0  0  0  0  0  1  0  0  0  0  0  0
    1.0628   -0.7863    0.9323 H   0  0  0  0  0  1  0  0  0  0  0  0
    2.0648    0.5508    0.3277 H   0  0  0  0  0  1  0  0  0  0  0  0
   -1.9868    0.8434   -0.1243 H   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3419   -0.6127    0.6641 H   0  0  0  0  0  1  0  0  0  0  0  0
   -1.1274   -0.3672   -1.1006 H   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  1  4  1  0
  1  5  1  0
  1  6  1  0
  3  7  1  0
  3  8  1  0
  3  9  1  0
M  END