HMDB0029506 RDKit 3D Kuwanon B 55 58 0 0 0 0 0 0 0 0999 V2000 -3.8922 -4.1024 1.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4475 -3.1934 0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1953 -3.2963 -1.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4389 -2.3663 0.3617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0265 -1.4870 -0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8864 -0.0595 -0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7424 0.5667 -0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5981 0.0015 0.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8659 -1.3067 0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2068 -1.7495 0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2569 -0.9030 -0.0751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9866 0.4136 -0.2819 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 0.8785 -0.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5039 2.1970 -0.4438 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0836 1.3178 -0.6021 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2929 0.8349 -0.6858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6788 -0.5714 -0.4871 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7293 -0.7137 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2801 -1.1268 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5674 -1.3414 -0.1327 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8303 1.8698 0.3293 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8978 2.5909 0.3393 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8813 3.9317 0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0054 4.7117 0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9326 6.0616 1.1065 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1856 4.1301 0.3575 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2503 2.7793 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4682 2.3173 -0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1159 2.0168 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0833 0.6970 -0.3869 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 0.1205 -0.7284 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4611 -3.4563 2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -4.5593 1.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5575 -4.8951 0.9769 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8106 -4.2436 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9303 -2.4565 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -3.3239 -1.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9477 -2.3500 1.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -1.7997 -1.3142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8436 -1.5268 -1.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1307 -2.0494 0.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3943 -2.7869 0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8558 2.8787 -0.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8779 2.3635 -0.7644 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0835 1.5430 -0.9272 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2715 -0.9777 1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 -1.4956 0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 0.2852 0.7423 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3738 -0.9995 -1.7592 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8654 -0.5082 -2.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0015 -2.1997 -1.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9417 4.3762 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7634 6.7824 0.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0702 4.7336 0.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7687 1.4465 -0.6542 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 12 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 7 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 24 26 2 0 26 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 2 0 30 6 1 0 13 8 1 0 29 22 1 0 20 11 1 0 1 32 1 0 1 33 1 0 1 34 1 0 3 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 9 41 1 0 10 42 1 0 14 43 1 0 15 44 1 0 16 45 1 0 18 46 1 0 18 47 1 0 18 48 1 0 19 49 1 0 19 50 1 0 19 51 1 0 23 52 1 0 25 53 1 0 26 54 1 0 28 55 1 0 M END