HMDB0252026 RDKit 3D Ethyl 2-cyanoacrylate 16 15 0 0 0 0 0 0 0 0999 V2000 -2.1592 1.2674 -0.1718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0605 0.0738 0.3577 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2049 -0.6504 0.8562 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1375 -1.2198 1.2673 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7455 -0.5408 0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6151 -1.6761 0.9425 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3946 0.1024 -0.0168 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6409 -0.5324 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7421 0.3309 -0.4666 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1178 1.7386 -0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2892 1.7693 -0.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5928 -1.5200 -0.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8171 -0.7880 1.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3554 -0.2582 -1.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4139 0.6756 0.3543 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3728 1.2276 -0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 3 0 2 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 1 10 1 0 1 11 1 0 8 12 1 0 8 13 1 0 9 14 1 0 9 15 1 0 9 16 1 0 M END