HMDB0014496
     RDKit          3D
Thioguanine
 16 17  0  0  0  0  0  0  0  0999 V2000
    3.1464   -0.1706   -0.0033 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7463    0.0566    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2187    1.2911    0.2275 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1077    1.5093    0.2519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7481    2.9920    0.4988 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0006    0.4685    0.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3525    0.4225    0.0445 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6537   -0.8628   -0.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5360   -1.6057   -0.2939 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4677   -0.7841   -0.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8586   -0.9401   -0.1569 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7080   -0.4110   -0.8435 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6613   -0.0908    0.8963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0325    1.2140    0.1730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6946   -1.1997   -0.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2540   -1.8894   -0.3152 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
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 11  2  1  0
 10  6  2  0
  1 12  1  0
  1 13  1  0
  7 14  1  0
  8 15  1  0
 11 16  1  0
M  END