Phenylacetylglutamine
  Mrv1652304062013142D          

 19 20  0  0  0  0            999 V2000
    3.4473   -5.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7329   -6.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7329   -6.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4473   -7.3072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1618   -6.8947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1618   -6.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4473   -4.8321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1618   -4.4196    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8763   -3.1821    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1618   -3.5946    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8763   -4.8321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5907   -4.4196    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5907   -3.5946    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.3052   -4.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3052   -3.1821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8763   -2.3571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4473   -3.1821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0197   -4.4196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3052   -5.6571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  1  7  1  0  0  0  0
  8  7  1  1  0  0  0
 10  8  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  1  1  0  0  0
 13 15  1  6  0  0  0
  9 16  1  1  0  0  0
 10 17  1  6  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
M  END