HMDB0029953 RDKit 3D D-erythro-D-galacto-octitol 34 33 0 0 0 0 0 0 0 0999 V2000 -3.9003 1.5511 0.7549 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8677 0.6717 -0.3274 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3525 0.4373 -0.6417 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3864 -0.4398 -1.7204 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8455 -0.2552 0.5847 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8466 -1.2781 0.8043 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5756 -1.0050 0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4535 -1.9129 -0.5453 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7146 -0.2874 0.6936 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6402 -1.3082 1.1331 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3413 0.2384 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5774 1.2428 -1.1158 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7222 0.8012 -0.3855 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7563 1.8938 0.4511 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -0.2158 -0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0189 0.4675 -0.2354 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7178 2.0971 0.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2959 -0.3207 -0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 1.1087 -1.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9894 1.4345 -0.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1597 -1.0552 -1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7947 0.4095 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6366 -1.9527 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6614 -1.7392 1.4137 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0088 -2.7609 -0.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7205 0.4599 1.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1768 -1.8266 1.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3502 -0.5981 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.6618 -1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0209 1.1872 -1.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0512 2.7295 0.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7732 -0.5376 1.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6983 -1.0825 -0.7417 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4643 0.1840 -1.0622 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 3 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 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 6 23 1 0 7 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 11 28 1 0 12 29 1 0 13 30 1 0 14 31 1 0 15 32 1 0 15 33 1 0 16 34 1 0 M END