HMDB0000764
     RDKit          3D
Hydrocinnamic acid
 21 21  0  0  0  0  0  0  0  0999 V2000
    4.0705   -1.0791    0.7058 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2222   -0.4434    0.0279 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5984    0.3955   -1.0301 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7935   -0.6187    0.3966 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9455    0.2186   -0.5259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4898    0.1193   -0.2488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3289   -0.8073   -0.8232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6725   -0.8484   -0.5198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2114    0.0454    0.3738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3920    0.9862    0.9651 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0521    1.0034    0.6424 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7015    1.4041   -0.8585 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6797   -0.2031    1.4234 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5109   -1.6691    0.4260 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1641   -0.1439   -1.5701 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2437    1.2760   -0.4313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9336   -1.5302   -1.5357 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3465   -1.5822   -0.9723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2832    0.0151    0.6179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8115    1.7074    1.6823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4084    1.7545    1.1172 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11  6  1  0
  3 12  1  0
  4 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
M  END