HMDB0033858
     RDKit          3D
2-Buten-1-ol
 13 12  0  0  0  0  0  0  0  0999 V2000
    1.6135    0.4269   -0.2546 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8878   -0.8443   -0.1755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3993   -0.8410    0.1367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1014    0.4373    0.4043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1333    0.5394   -0.5316 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3005    0.9981   -1.1615 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5208    1.0471    0.6697 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7079    0.2287   -0.3937 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4018   -1.7886   -0.3721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9562   -1.7692    0.2010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4731    1.3149    0.3329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5535    0.3867    1.3936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8156   -0.1360   -0.2494 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  1  6  1  0
  1  7  1  0
  1  8  1  0
  2  9  1  0
  3 10  1  0
  4 11  1  0
  4 12  1  0
  5 13  1  0
M  END