HMDB0036584 RDKit 3D Tetramethylpyrazine 22 22 0 0 0 0 0 0 0 0999 V2000 -2.4682 1.4235 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 0.7223 0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0064 1.3844 -0.1905 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1528 0.6819 -0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4479 1.3703 -0.5384 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1576 -0.6848 -0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4551 -1.3976 -0.1526 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0037 -1.3303 0.1884 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1642 -0.6409 0.2575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4421 -1.3284 0.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3213 2.5252 0.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9964 1.2006 1.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1753 1.1358 -0.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2144 0.9796 0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3589 2.4535 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8044 1.0499 -1.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1993 -1.0169 0.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 -2.4610 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9255 -1.3385 -1.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -0.7876 0.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5058 -1.6500 1.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4087 -2.2909 -0.0566 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 1 0 4 6 2 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 9 2 1 0 1 11 1 0 1 12 1 0 1 13 1 0 5 14 1 0 5 15 1 0 5 16 1 0 7 17 1 0 7 18 1 0 7 19 1 0 10 20 1 0 10 21 1 0 10 22 1 0 M END