HMDB0031320
     RDKit          3D
1,3-Butanediol
 16 15  0  0  0  0  0  0  0  0999 V2000
   -1.8741   -0.6592    0.4125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6394    0.1944    0.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8948    1.5393    0.6213 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3910   -0.2456   -0.3705 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6809    0.5328   -0.2715 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5488    0.0177   -1.2480 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5283   -1.6985    0.3021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4142   -0.3955   -0.5103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5363   -0.6317    1.2976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2525   -0.0779    1.6407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7366    1.8222    0.2338 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6563   -1.3099   -0.1131 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0462   -0.2298   -1.4094 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5210    1.6096   -0.5519 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1919    0.4193    0.6928 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8402   -0.8871   -0.9133 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  1  7  1  0
  1  8  1  0
  1  9  1  0
  2 10  1  0
  3 11  1  0
  4 12  1  0
  4 13  1  0
  5 14  1  0
  5 15  1  0
  6 16  1  0
M  END