HMDB0002664 RDKit 3D Prostaglandin E3 55 55 0 0 0 0 0 0 0 0999 V2000 -7.8550 1.3627 1.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0656 0.6498 0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7784 -0.7449 0.5507 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5657 -1.2232 0.6647 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3539 -0.4608 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4759 -1.0184 -0.6582 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1556 -2.3381 -0.3007 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2592 -0.1574 -0.6608 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.6425 -0.8237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2198 0.1148 -0.8437 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0933 1.5652 -0.4690 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1547 2.3255 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0375 1.5963 1.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.2397 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3482 -0.2711 2.5738 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0527 -0.4302 0.2959 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5116 -0.0092 0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1713 -0.4463 -0.9877 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2144 -1.2250 -1.0442 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8954 -1.7908 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3561 -1.3033 0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3047 0.1981 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6389 0.8159 0.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6884 0.1406 0.1549 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7424 2.1828 0.2504 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3358 2.2462 0.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2405 1.6993 2.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6105 0.6644 1.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8053 0.6005 -0.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 1.2356 -0.1914 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6692 -1.4112 0.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4778 -2.2853 0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 0.6008 0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6917 -0.5607 1.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0087 -1.0308 -1.6088 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6112 -3.0019 -0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3994 0.9008 -0.5187 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0289 -1.7463 -0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 0.0275 -1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8092 1.9720 -0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8997 3.2327 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6264 2.4055 1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.7438 1.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0341 -1.5304 0.3557 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9757 -0.4353 1.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5879 1.1047 0.3757 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7761 -0.1035 -1.9653 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6492 -1.5037 -2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4985 -1.5138 1.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9946 -2.9033 0.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8132 -1.6846 1.0709 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8785 -1.6751 -0.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 0.4746 1.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6583 0.5958 -0.6306 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1781 2.7512 -0.4889 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 16 10 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 6 7 36 1 0 8 37 1 0 9 38 1 0 10 39 1 6 11 40 1 6 12 41 1 0 13 42 1 0 13 43 1 0 16 44 1 1 17 45 1 0 17 46 1 0 18 47 1 0 19 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 22 53 1 0 22 54 1 0 25 55 1 0 M END