HMDB0036044 RDKit 3D Marmelo oxide A 27 27 0 0 0 0 0 0 0 0999 V2000 -4.0568 -0.2581 0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7253 -0.1943 0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2888 0.9368 -0.7752 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -1.2263 0.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6858 -1.4805 0.6246 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2327 -0.5928 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9581 0.4011 0.7785 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1962 0.6830 -0.0889 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3475 0.8741 0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2991 -0.5814 -0.8997 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3134 -1.4609 -0.4721 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5218 -1.0472 0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6679 0.5114 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 1.6987 -0.9045 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0618 0.5772 -1.8123 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4119 1.5005 -0.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5351 -1.9959 1.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -2.3721 1.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1097 -0.2034 -1.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4826 1.3562 0.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2496 -0.1119 1.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0421 1.5217 -0.7654 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2569 1.9183 1.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3449 0.7783 0.3424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2508 0.1887 1.7039 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3094 -0.9840 -0.7085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1845 -0.4372 -1.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 6 1 0 1 12 1 0 1 13 1 0 3 14 1 0 3 15 1 0 3 16 1 0 4 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 9 24 1 0 9 25 1 0 10 26 1 0 10 27 1 0 M END