HMDB0015363 RDKit 3D Metoclopramide 42 42 0 0 0 0 0 0 0 0999 V2000 -2.5833 2.5993 0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0745 1.1773 0.2784 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8572 0.1941 0.8551 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1788 -0.0285 0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1671 -0.6106 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3648 -0.8130 1.6899 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5285 -1.8150 0.9856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -1.3826 0.3996 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7271 -0.8726 1.2222 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4724 -0.8319 2.4882 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0254 -0.3958 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8884 0.0689 1.8016 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1355 0.5342 1.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 1.1271 2.6907 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5827 0.5662 0.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8799 1.0556 -0.1561 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 0.1154 -0.8459 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4792 -0.3607 -0.5033 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6455 -0.8139 -1.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0637 -0.7950 -2.8509 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8138 3.3245 0.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7176 2.6982 1.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5045 2.7894 -0.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0301 1.1431 0.6661 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0145 1.0784 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6855 0.9678 0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7767 -0.6523 1.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1152 -1.7420 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1184 -0.2894 -1.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2895 -0.2368 -1.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1976 -1.3728 2.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8196 -0.3280 2.5452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1268 -2.3426 0.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3329 -2.6647 1.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1967 -1.4542 -0.6304 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5907 0.0690 2.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6488 0.4736 -0.5391 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 2.0794 0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0042 0.0967 -1.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2338 -1.0685 -3.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4297 0.2181 -3.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8827 -1.5051 -3.0728 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 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 13 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 18 11 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 12 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 20 40 1 0 20 41 1 0 20 42 1 0 M END