HMDB0039998
     RDKit          3D
2-Acetyl-3,6-dimethylpyrazine
 21 21  0  0  0  0  0  0  0  0999 V2000
   -2.5026   -1.4309    0.2075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9630   -0.0512   -0.0403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7955    0.8417   -0.2321 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5249    0.1391   -0.0382 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3378   -0.8678    0.1761 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6849   -0.6572    0.1719 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6164   -1.7909    0.4121 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2033    0.5942   -0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3488    1.6136   -0.2686 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0062    1.3895   -0.2617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9150    2.5278   -0.5025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2420   -1.4252    1.0434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0318   -1.7995   -0.7012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6949   -2.1524    0.4330 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0005   -1.6763    1.4380 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4540   -1.7357   -0.2911 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1187   -2.7774    0.2840 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2794    0.7066   -0.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3476    3.4782   -0.6773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5467    2.7184    0.3801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4860    2.3553   -1.4363 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  1  0
  6  8  2  0
  8  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
  7 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
 11 19  1  0
 11 20  1  0
 11 21  1  0
M  END