HMDB0034273
     RDKit          3D
Benzyl thiocyanate
 17 17  0  0  0  0  0  0  0  0999 V2000
    5.2675   -0.0533    0.2870 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1437   -0.0138    0.5708 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4217    0.0708    1.0076 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4924   -0.1226   -0.5514 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0430   -0.0593   -0.2431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5679    1.1755   -0.2701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9361    1.2437    0.0199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6752    0.1202    0.3273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0223   -1.1140    0.3451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6572   -1.2057    0.0588 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6930   -1.1133   -1.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7511    0.7066   -1.2525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0163    2.0820   -0.5083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3813    2.2283   -0.0107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7304    0.2134    0.5457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6252   -1.9765    0.5888 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2004   -2.1819    0.0859 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  4 11  1  0
  4 12  1  0
  6 13  1  0
  7 14  1  0
  8 15  1  0
  9 16  1  0
 10 17  1  0
M  END