HMDB0031627
     RDKit          3D
1-Phenyl-1-propanol
 22 22  0  0  0  0  0  0  0  0999 V2000
    2.1364    1.1066   -0.5579 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0570    0.2655    0.6636 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0850   -0.8702    0.5682 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4024   -1.7332   -0.4556 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3133   -0.4330    0.3983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2468   -1.4138    0.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5721   -1.0969   -0.0852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9514    0.2151    0.0508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0077    1.1830    0.3581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6729    0.8904    0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2599    0.9901   -1.2383 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0425    0.8417   -1.1415 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2199    2.2011   -0.3459 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0579   -0.1734    0.8714 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8175    0.9046    1.5339 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1383   -1.4367    1.5257 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9725   -1.3867   -1.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9397   -2.4594   -0.0168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2641   -1.8987   -0.3245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9862    0.4577   -0.0873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3048    2.2092    0.4643 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0699    1.6369    0.7788 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  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
  2 15  1  0
  3 16  1  0
  4 17  1  0
  6 18  1  0
  7 19  1  0
  8 20  1  0
  9 21  1  0
 10 22  1  0
M  END