HMDB0246509 RDKit 3D 4-Methylethcathinone 31 31 0 0 0 0 0 0 0 0999 V2000 3.6637 1.5926 0.5262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 0.2030 -0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7574 -0.2243 -0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5648 -0.4379 0.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8974 -1.5826 1.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4563 -0.7366 -0.8401 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 -1.3468 -1.9462 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -0.4407 -0.6572 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9113 -0.7868 -1.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2472 -0.4736 -1.3951 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6715 0.2080 -0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1258 0.5524 -0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7167 0.5610 0.6548 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3901 0.2462 0.4693 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7648 1.5898 1.6535 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3615 2.3446 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 1.9383 0.2824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7473 0.3127 -0.7595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2779 -0.4701 0.7553 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5758 0.4743 -1.5209 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3107 0.4628 0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -1.9082 1.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6686 -1.1967 1.6995 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3454 -2.3801 0.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5665 -1.3252 -2.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9992 -0.7524 -2.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3909 0.7585 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2798 1.4486 -0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7134 -0.2620 -0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0821 1.0938 1.5296 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6501 0.5375 1.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 14 8 1 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 3 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 5 24 1 0 9 25 1 0 10 26 1 0 12 27 1 0 12 28 1 0 12 29 1 0 13 30 1 0 14 31 1 0 M END