HMDB0094698
     RDKit          3D
N-Propionylalanine
 21 20  0  0  0  0  0  0  0  0999 V2000
    2.4476    0.3404    1.0067 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6532    0.1328   -0.2769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8955   -1.1369   -0.1946 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5543   -2.3425   -0.0202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3754   -1.1442   -0.2826 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2043    0.0086   -0.4634 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.6091   -0.3704   -0.9152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2912    0.7522    0.7989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6983    0.3615    1.8218 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0384    1.9325    0.9249 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4290    1.3814    1.3526 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5050    0.0727    0.7543 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0640   -0.3124    1.8166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0019    1.0076   -0.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3241    0.1160   -1.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9215   -2.8076   -0.8223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8113    0.7041   -1.2588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8199   -1.4486   -0.7086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7335   -0.2139   -2.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3645    0.2170   -0.3533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8502    2.7495    0.3882 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
  3  5  2  3
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  2  0
  8 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  4 16  1  0
  6 17  1  6
  7 18  1  0
  7 19  1  0
  7 20  1  0
 10 21  1  0
M  END