HMDB0001335 RDKit 3D Prostaglandin I2 57 58 0 0 0 0 0 0 0 0999 V2000 -7.6138 -0.3843 1.3345 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0215 0.2175 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8245 -0.5175 -0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6858 -0.5997 0.5176 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0997 0.6778 0.9886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5363 1.5420 -0.1040 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4509 1.9349 -1.0593 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3257 0.9159 -0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 0.6709 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0248 0.0537 -0.4581 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0124 0.0269 -1.9760 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7278 -1.0069 -2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4926 -0.1157 -2.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1185 0.7819 -1.2359 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1346 0.1393 -0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1392 0.5204 0.8216 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1145 0.6619 1.6902 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5369 0.3992 1.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7317 -0.0243 -0.0816 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1878 -0.2718 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6877 -1.3859 0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9068 -2.0719 1.1643 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 -1.7210 0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 0.7818 1.1555 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0886 1.0691 -0.1747 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6669 0.4348 2.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6572 -0.7302 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0439 -1.1967 1.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8112 0.1549 -0.7056 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 1.2814 0.2124 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1341 -1.5630 -0.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5169 -0.0659 -1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8957 -1.3011 1.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -1.1408 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2289 0.4096 1.6515 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7891 1.2863 1.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1832 2.4842 0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2333 2.8181 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2755 0.6636 -1.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3446 0.9258 1.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1841 -0.9303 -0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3313 1.0075 -2.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2411 -1.8684 -2.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7191 0.2092 -3.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8194 -1.1698 -2.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5423 1.7035 -1.6764 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.9841 2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9482 -0.3046 2.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0955 1.3580 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1562 -0.9689 -0.2709 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3386 0.7860 -0.7395 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2845 -0.4702 -1.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7267 0.6631 -0.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4379 -1.8673 1.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2254 -0.0940 1.6191 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6229 1.6943 1.7905 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7123 2.0871 -0.3001 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 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 3 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 16 24 1 0 24 25 1 0 25 10 1 0 25 14 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 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 1 7 38 1 0 8 39 1 0 9 40 1 0 10 41 1 1 11 42 1 6 12 43 1 0 13 44 1 0 13 45 1 0 14 46 1 6 17 47 1 0 18 48 1 0 18 49 1 0 19 50 1 0 19 51 1 0 20 52 1 0 20 53 1 0 23 54 1 0 24 55 1 0 24 56 1 0 25 57 1 1 M END