HMDB0060518
     RDKit          3D
trans-4-Carboxymethylenebut-2-en-4-olide
 14 14  0  0  0  0  0  0  0  0999 V2000
   -1.9463   -1.3258    0.4043 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1431   -0.1462    0.1079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4410    0.3278    0.0928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0522    0.7407   -0.2208 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2125    0.3414   -0.2227 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8119   -0.9446    0.0676 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -0.8961   -0.0590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4513    0.4679   -0.4475 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6216    0.8743   -0.6554 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2781    1.1888   -0.5388 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7173    1.1687    0.5971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2886    1.7936   -0.4802 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2625   -1.8460    0.3538 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8071   -1.7446    0.1096 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  3
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10  5  1  0
  3 11  1  0
  4 12  1  0
  6 13  1  0
  7 14  1  0
M  END