HMDB0031626
     RDKit          3D
2-Phenylpropanal
 20 20  0  0  0  0  0  0  0  0999 V2000
   -2.2411   -0.1969   -0.8631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4486    0.1087    0.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6219    1.5456    0.7999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1471    1.8413    1.8645 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0073   -0.1312    0.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7345    0.5167   -0.8008 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0839    0.2828   -0.9512 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7808   -0.5842   -0.1378 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0709   -1.2313    0.8608 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7220   -0.9950    1.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3403    0.7142   -1.5212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7654   -0.9659   -1.4914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2605   -0.5520   -0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7759   -0.5166    1.2325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2905    2.3682    0.1788 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1722    1.1990   -1.4363 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6413    0.7836   -1.7267 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8406   -0.7578   -0.2681 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6335   -1.9059    1.4871 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2043   -1.5234    1.8040 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  2  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  3 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
M  END