HMDB0302204 RDKit 3D Prostaglandin B-1 56 56 0 0 0 0 0 0 0 0999 V2000 -5.7453 0.8151 1.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9655 2.0328 0.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 2.3832 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2626 1.1973 -0.8734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9961 1.2886 -1.6643 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 1.5199 -0.8604 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8669 2.7459 -0.1351 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5162 0.5017 0.1641 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.5409 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0265 -0.9388 -1.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7837 -2.0390 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9422 -2.9783 0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3818 -3.0820 0.5188 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8433 -1.7099 0.9797 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2709 -1.7398 1.4601 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7443 -0.4025 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6884 0.6378 0.8294 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1632 1.9576 1.3056 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5439 2.0596 2.5131 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1863 3.0391 0.4502 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 -2.2111 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5004 -2.9012 -2.6077 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -1.3859 -3.3237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.3174 -2.3932 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7989 0.8525 2.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8751 -0.1281 0.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5827 0.8271 2.2538 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6989 1.7604 -0.1483 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3547 2.8720 1.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9467 2.5292 0.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8164 3.2966 -0.6253 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0767 0.9601 -1.5892 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2266 0.3049 -0.1837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0897 2.0726 -2.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8986 0.3161 -2.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8756 1.6792 -1.4769 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1941 2.7940 0.5704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0372 0.6064 1.1627 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7305 -1.1858 0.9939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6122 -4.0007 -0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3242 -2.7985 0.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0535 -3.5233 -0.2146 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3745 -3.7412 1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2123 -1.3374 1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7648 -1.0376 0.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4533 -2.5181 2.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8937 -2.0202 0.5642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8018 -0.4742 2.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1506 -0.0093 2.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6595 0.7672 0.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3336 0.3595 -0.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9542 3.1071 -0.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -1.9184 -3.8218 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4892 -0.9028 -3.9982 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7403 -0.0047 -2.9075 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8895 0.5634 -2.3928 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 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 11 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 10 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 5 35 1 0 6 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 12 40 1 0 12 41 1 0 13 42 1 0 13 43 1 0 14 44 1 0 14 45 1 0 15 46 1 0 15 47 1 0 16 48 1 0 16 49 1 0 17 50 1 0 17 51 1 0 20 52 1 0 23 53 1 0 23 54 1 0 24 55 1 0 24 56 1 0 M END