HMDB0034221 RDKit 3D L-Quebrachitol 27 27 0 0 0 0 0 0 0 0999 V2000 -3.2561 -0.2600 -0.4204 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0055 -0.1030 -1.0127 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9937 0.0125 -0.0597 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0989 -1.1827 -0.2036 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8034 -2.2835 0.3269 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.0563 0.5047 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9934 -2.1620 0.1368 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9101 0.1796 -0.0064 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1027 0.3274 0.7155 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0822 1.3983 0.2382 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1630 1.7339 1.5976 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3103 1.3216 -0.2683 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4060 1.7354 -1.6152 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0072 -0.3449 -1.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2486 -1.1889 0.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5212 0.5690 0.2587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4803 -0.0548 0.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0933 -1.4283 -1.2759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -2.3892 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0632 -1.0190 1.5954 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1851 -2.0576 -0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1223 0.0685 -1.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6086 1.1079 0.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5908 2.2488 -0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3185 1.5660 2.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9046 2.0947 0.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1304 1.1667 -2.2095 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 1 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 3 1 0 1 14 1 0 1 15 1 0 1 16 1 0 3 17 1 1 4 18 1 6 5 19 1 0 6 20 1 1 7 21 1 0 8 22 1 6 9 23 1 0 10 24 1 6 11 25 1 0 12 26 1 1 13 27 1 0 M END