HMDB0302935
     RDKit          3D
2-Hexen-4-olide
 16 16  0  0  0  0  0  0  0  0999 V2000
   -2.0726   -0.1117    0.6485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0871    0.6488   -0.1663 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0515   -0.1956   -0.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8355   -0.8222    0.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0876   -0.4022    0.3792 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2289    0.5474   -0.6995 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2738    1.1914   -1.0512 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9942    0.6487   -1.3149 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7990    0.6069    1.0718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6405   -0.7018    1.4633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6256   -0.8296   -0.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7237    1.5558    0.3566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6268    1.0321   -1.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2776   -0.9306   -1.4407 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4828   -1.5527    1.1124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8984   -0.6844    1.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  3  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  4 15  1  0
  5 16  1  0
M  END