HMDB0013036
     RDKit          3D
1-Pentanol
 18 17  0  0  0  0  0  0  0  0999 V2000
    2.5050   -0.5839    0.0203 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0458   -0.4768   -0.3206 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3944    0.7136    0.3753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0600    0.8238    0.0382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8486   -0.3993    0.4460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1959   -0.2674    0.1199 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6921   -1.2498    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1393   -0.9067   -0.8192 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8821    0.4298    0.3345 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8493   -0.4262   -1.4069 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5490   -1.3886    0.1021 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5660    0.6967    1.4590 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8965    1.6154   -0.0561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4707    1.6734    0.6248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1601    0.9992   -1.0348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4840   -1.3095   -0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7900   -0.6020    1.5252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5103    0.6583    0.2524 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
  4  5  1  0
  5  6  1  0
  1  7  1  0
  1  8  1  0
  1  9  1  0
  2 10  1  0
  2 11  1  0
  3 12  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  6 18  1  0
M  END