HMDB0014991
     RDKit          3D
Temozolomide
 20 21  0  0  0  0  0  0  0  0999 V2000
   -3.5811   -0.3954    1.0568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1519   -0.2958    0.8153 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2474   -0.6199    1.7074 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0410   -0.5098    1.4349 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4933   -0.0619    0.2347 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7345    0.1484   -0.3092 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0199   -0.0820    0.3374 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2260    0.1872   -0.3660 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1104   -0.5187    1.5179 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5542    0.6075   -1.5518 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2351    0.6867   -1.7906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4111    0.2724   -0.6849 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7152    0.1490   -0.3768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5370    0.4767   -1.2772 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7935   -0.9233    1.9966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0295    0.6314    1.0484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0722   -0.9408    0.2041 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5561   -0.5882   -1.0085 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7553    1.0835   -0.2623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1871    1.0303   -2.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  7  9  2  0
  6 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 13  2  1  0
 12  5  1  0
  1 15  1  0
  1 16  1  0
  1 17  1  0
  8 18  1  0
  8 19  1  0
 11 20  1  0
M  END