HMDB0032637
     RDKit          3D
2-Phenylethanethiol
 19 19  0  0  0  0  0  0  0  0999 V2000
    3.8028   -0.7855    0.4786 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1010   -0.1780    0.7064 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3155   -0.5967   -0.5079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1051   -0.1586   -0.4489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5324    1.0559   -0.9467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8712    1.4360   -0.8754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7963    0.5891   -0.2979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3950   -0.6290    0.2065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0710   -0.9666    0.1178 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4634    0.1462   -0.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6654   -0.6185    1.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1067    0.9205    0.8567 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7728   -0.2628   -1.4529 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3058   -1.7119   -0.5191 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1745    1.7322   -1.4018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1815    2.3973   -1.2746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8543    0.8433   -0.2196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1435   -1.2953    0.6648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7576   -1.9174    0.5115 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  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9  4  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  5 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
M  END