HMDB0000773 RDKit 3D N-Acetyl-a-neuraminic acid 40 40 0 0 0 0 0 0 0 0999 V2000 -1.5392 -4.0642 -0.3241 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0907 -2.7604 0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6531 -2.7419 1.4131 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1366 -1.5662 -0.4907 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6955 -0.3089 0.0711 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9572 0.5700 0.1215 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9418 0.0140 0.8957 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4856 1.9190 0.6122 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6233 2.4959 -0.5117 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4663 3.2153 0.0223 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4802 3.4980 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5393 3.1424 -1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1756 4.8517 -1.2565 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1693 1.5428 -1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3102 0.3861 -0.7928 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6508 0.5886 -0.1257 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5928 1.0142 -1.0675 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -0.7111 0.4321 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4563 -0.4840 1.0322 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4926 -1.7159 -0.6898 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0306 -2.8566 -0.0835 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6926 -4.5617 -0.8535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3773 -3.9305 -1.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8734 -4.7161 0.4976 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4952 -1.5615 -1.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3348 -0.5031 1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3071 0.6387 -0.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8328 0.2215 0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9282 1.8265 1.5555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 2.5561 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 3.4841 -0.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7648 5.4527 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5189 -0.3086 -1.6622 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6287 1.3070 0.7024 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 0.8321 -1.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5819 -1.1577 1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4845 0.4251 1.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5581 -1.9908 -1.1961 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2487 -1.2573 -1.3566 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0071 -2.7853 -0.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 1 9 11 1 0 11 12 2 0 11 13 1 0 9 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 15 5 1 0 1 22 1 0 1 23 1 0 1 24 1 0 4 25 1 0 5 26 1 1 6 27 1 6 7 28 1 0 8 29 1 0 8 30 1 0 10 31 1 0 13 32 1 0 15 33 1 6 16 34 1 1 17 35 1 0 18 36 1 1 19 37 1 0 20 38 1 0 20 39 1 0 21 40 1 0 M END