HMDB0245828
     RDKit          3D
3-Butene-1,2-diol
 14 13  0  0  0  0  0  0  0  0999 V2000
   -2.1021    0.5990    0.1497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2923   -0.4211    0.3072 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0501   -0.5066   -0.3445 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0741    0.1308   -1.5562 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1511   -0.0525    0.5880 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3667   -0.3260   -0.0394 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0464    0.5864    0.6495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8384    1.4395   -0.4656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6320   -1.2456    0.9530 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2305   -1.5873   -0.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9279    0.4834   -1.8411 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0896    1.0154    0.8486 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1542   -0.6257    1.5357 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8671    0.5103   -0.2526 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  3  5  1  0
  5  6  1  0
  1  7  1  0
  1  8  1  0
  2  9  1  0
  3 10  1  0
  4 11  1  0
  5 12  1  0
  5 13  1  0
  6 14  1  0
M  END