HMDB0014641 RDKit 3D Phenindione 27 29 0 0 0 0 0 0 0 0999 V2000 0.1029 -2.0891 0.9389 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5319 -1.0877 0.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9057 -0.5849 0.3325 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1056 -1.1897 0.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2908 -0.4873 0.6007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2562 0.8395 0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0729 1.4645 -0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8822 0.7552 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4926 1.1145 -0.3568 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0233 2.2930 -0.3811 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2092 -0.1583 -0.5968 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6438 -0.1192 -0.3322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5529 -0.4901 -1.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9076 -0.4693 -1.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4347 -0.0705 0.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5353 0.2998 1.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1673 0.2795 0.8786 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0868 -2.2255 0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1917 -0.9997 0.8678 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2006 1.3728 0.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 2.4997 -0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0225 -0.5073 -1.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2118 -0.8167 -2.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6237 -0.7638 -1.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5083 -0.0499 0.2755 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9206 0.6181 2.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4625 0.5725 1.6537 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 11 2 1 0 17 12 1 0 8 3 1 0 4 18 1 0 5 19 1 0 6 20 1 0 7 21 1 0 11 22 1 0 13 23 1 0 14 24 1 0 15 25 1 0 16 26 1 0 17 27 1 0 M END