HMDB0011469
     RDKit          3D
2-Butanol
 15 14  0  0  0  0  0  0  0  0999 V2000
    1.9701    0.2475   -0.0831 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6609   -0.2414    0.4566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4849   -0.0300   -0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7344   -0.5664    0.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6104    1.3229   -0.7871 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2463    1.1775    0.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9299    0.5414   -1.1492 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7959   -0.5075    0.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7741   -1.3156    0.7085 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3710    0.2720    1.4098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3569   -0.5625   -1.4549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4704    0.2715    0.2508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5430   -0.9052    1.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1463   -1.4387   -0.3742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4019    1.7346   -0.3540 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
  1  6  1  0
  1  7  1  0
  1  8  1  0
  2  9  1  0
  2 10  1  0
  3 11  1  0
  4 12  1  0
  4 13  1  0
  4 14  1  0
  5 15  1  0
M  END