HMDB0014562 RDKit 3D Secobarbital 35 35 0 0 0 0 0 0 0 0999 V2000 -1.2938 2.4838 -1.5074 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2728 1.7102 -0.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5294 0.2607 -0.5709 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4666 -0.6077 0.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8927 -0.4694 -0.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7931 -0.8379 -2.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6594 0.7599 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0678 1.4063 0.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0075 0.6227 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9105 -2.0399 -0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1616 -2.8181 -0.9657 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2003 -2.3920 0.0943 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8093 -1.8572 1.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -2.1687 1.6629 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9581 -0.9382 1.9722 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6384 -0.6099 1.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1984 -0.3688 2.3712 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4996 2.0407 -2.4687 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1058 3.5424 -1.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0616 2.1878 0.5224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7601 0.0183 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5281 0.0875 -0.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4951 -1.3223 -0.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1378 0.0493 -2.6222 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2364 -1.0065 -2.3504 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4739 -1.6629 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6738 0.5104 -0.9819 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 1.5649 -1.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2412 1.9091 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6966 2.3062 0.4798 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9121 0.9346 2.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0566 0.7664 1.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8377 -0.4727 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7584 -3.1006 -0.4826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2945 -0.4884 2.8655 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 8 9 1 0 4 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 2 0 16 4 1 0 1 18 1 0 1 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 5 23 1 0 6 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 8 29 1 0 8 30 1 0 9 31 1 0 9 32 1 0 9 33 1 0 12 34 1 0 15 35 1 0 M END