HMDB0039999
     RDKit          3D
2-Acetyl-3,5-dimethylpyrazine
 21 21  0  0  0  0  0  0  0  0999 V2000
   -2.9691   -1.2757    0.4102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1845   -0.0552    0.1042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8087    1.0095   -0.1042 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7359   -0.1656    0.0639 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0994   -1.3273    0.2932 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2432   -1.4218    0.2539 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9905   -0.2926   -0.0302 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4947   -0.3609   -0.0826 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3322    0.8492   -0.2541 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0091    0.9782   -0.2225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6480    2.2936   -0.4858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6533   -1.7511    1.3636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0552   -1.0675    0.4589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7239   -2.0190   -0.3866 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7737   -2.3448    0.4349 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8454    0.2888    0.7420 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7890   -1.4060    0.0113 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7849    0.1286   -1.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2247    2.6391    0.4225 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1632    3.0393   -0.5938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3050    2.2611   -1.3767 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 10  4  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  6 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
 11 19  1  0
 11 20  1  0
 11 21  1  0
M  END