HMDB0258931
     RDKit          3D
TETRASUL
 23 24  0  0  0  0  0  0  0  0999 V2000
   -5.1744    1.3059    1.0295 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.7071    0.5710    0.3748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1849   -0.5303    0.9984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0397   -1.1174    0.5013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3884   -0.6282   -0.6211 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0948   -1.4072   -1.2475 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4979   -0.6509   -0.4549 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9701   -1.1902    0.7465 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0553   -0.6274    1.3838 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6488   -1.3020    2.8898 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.6426    0.4717    0.7926 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0184    1.1820    1.6046 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.1736    1.0010   -0.3932 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0879    0.4478   -1.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4835    1.1120   -2.5521 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.9448    0.4821   -1.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0969    1.0961   -0.7448 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6945   -0.9098    1.8733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6149   -1.9917    0.9865 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4889   -2.0521    1.1852 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6498    1.8657   -0.8412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4719    0.9070   -2.1081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4942    1.9649   -1.2508 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  2  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
  9 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
  5 16  1  0
 16 17  2  0
 17  2  1  0
 14  7  1  0
  3 18  1  0
  4 19  1  0
  8 20  1  0
 13 21  1  0
 16 22  1  0
 17 23  1  0
M  END