HMDB0036181
     RDKit          3D
2-[(Isopropylthio)methyl]furan
 22 22  0  0  0  0  0  0  0  0999 V2000
   -2.4879   -0.2337   -0.5433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4336    0.8070   -0.2299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0156    2.2010   -0.1232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7341    0.3201    1.3931 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1516   -1.2527    1.2321 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3273   -0.9898    0.3511 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5972   -0.5836    0.7880 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4031   -0.4472   -0.3167 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6128   -0.7704   -1.3914 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4151   -1.0786   -0.9515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1390   -0.2926    0.3742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0507   -0.0192   -1.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9375   -1.2106   -0.5811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6201    0.7635   -0.9873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9924    2.7206   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3359    2.8147    0.5265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0123    2.2050    0.3200 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4663   -1.5710    2.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4612   -2.0507    0.8051 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8874   -0.4086    1.8236 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4296   -0.1527   -0.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9298   -0.7706   -2.4403 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10  6  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  3 17  1  0
  5 18  1  0
  5 19  1  0
  7 20  1  0
  8 21  1  0
  9 22  1  0
M  END