KEGG:C02231  3-Nitroacrylate
  ISISHOST03240423062D 1   1.00000     0.00000  2018
  8  7  0     0  0            999 V2000
    1.1448    0.2414    0.0000 C   0  0  0  0  0  0           0  0  0
    0.4966   -0.1345    0.0000 C   0  0  0  0  0  0           0  0  0
    1.7931   -0.1345    0.0000 O   0  0  0  0  0  0           0  0  0
    1.1448    0.9897    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.1552    0.2414    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.1828   -0.2276    0.0000 N   0  3  0  0  0  0           0  0  0
   -1.1724   -1.2793    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.0690    0.3069    0.0000 O   0  5  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  2  0     0  0
  2  5  2  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  6  8  1  0     0  0
M  CHG  2   6   1   8  -1
M  END