HMDB0245932
     RDKit          3D
3-Methylhexane
 23 22  0  0  0  0  0  0  0  0999 V2000
    2.6106   -0.3751    0.4865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5707    0.6539    0.8188 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5709    0.8401   -0.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2108   -0.3681   -0.6413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1584    0.0718   -1.7723 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0917   -0.9179    0.4235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1337    0.0823    0.8850 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6277    0.0856    0.3556 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7323   -1.1034    1.3163 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3297   -0.9712   -0.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1047    0.3954    1.7825 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0931    1.6221    0.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1311    1.1670   -1.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1240    1.6664   -0.0379 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4090   -1.1912   -1.0481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5122    0.2958   -2.6271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8836   -0.7297   -1.9222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6238    1.0221   -1.3887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6721   -1.7586   -0.0463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5842   -1.3389    1.2910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6648   -0.3915    1.7394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6155    0.9993    1.1865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9052    0.2437    0.0958 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
  4  6  1  0
  6  7  1  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  5 18  1  0
  6 19  1  0
  6 20  1  0
  7 21  1  0
  7 22  1  0
  7 23  1  0
M  END