ChEBI


 20 21  0     1  0            999 V2000
    1.3241    0.3138    0.0000 N   0  0  3  0  0  0           0  0  0
    0.5310    0.0517    0.0000 C   0  0  2  0  0  0           0  0  0
    1.9448   -0.2379    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4966    1.1207    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.1138    0.5276    0.0000 O   0  0  0  0  0  0           0  0  0
    0.2897   -0.7586    0.0000 C   0  0  0  0  0  0           0  0  0
    2.7345    0.0207    0.0000 N   0  0  0  0  0  0           0  0  0
    1.7793   -1.0483    0.0000 O   0  0  0  0  0  0           0  0  0
    2.2793    1.3862    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7862    0.0310    0.0000 C   0  0  1  0  0  0           0  0  0
   -0.5379   -0.7586    0.0000 C   0  0  1  0  0  0           0  0  0
    2.9035    0.8345    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.5759    0.2862    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.0310   -1.4207    0.0000 O   0  0  0  0  0  0           0  0  0
    3.6897    1.0897    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.1586   -0.2897    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.9862   -0.2897    0.0000 P   0  0  3  0  0  0           0  0  0
   -2.9897   -1.1138    0.0000 O   0  0  0  0  0  0           0  0  0
   -3.8103   -0.2897    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.9897    0.5379    0.0000 O   0  0  0  0  0  0           0  0  0
  2  1  1  1     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
  2  5  1  0     0  0
  2  6  1  0     0  0
  3  7  1  0     0  0
  3  8  2  0     0  0
  4  9  2  0     0  0
  5 10  1  0     0  0
  6 11  1  0     0  0
  7 12  1  0     0  0
 10 13  1  1     0  0
 11 14  1  6     0  0
 12 15  2  0     0  0
 13 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 17 19  1  0     0  0
 17 20  2  0     0  0
  9 12  1  0     0  0
 10 11  1  0     0  0
M  END