@MOLECULE (5z)-7-{(1s,2s,3s,5r)-2-[(e)-2-{2-[(3-chlorophenoxy)methyl]-1,3-dioxolan-2-yl}vinyl]-3,5-dihydroxycyclopentyl}-5-heptenoic acid 61 63 0 0 0 SMALL USER_CHARGES @ATOM 1 CL -2.9195 2.5890 1.7026 Cl 1 UNL111111 0.1031 2 O -2.6448 -3.6734 1.0941 O.3 1 UNL111111 -0.5698 3 O 0.3180 -4.3971 1.5011 O.3 1 UNL111111 -0.5911 4 O 4.3624 -0.5673 0.6593 O.3 1 UNL111111 -0.4441 5 O 2.9626 0.6056 -0.6923 O.3 1 UNL111111 -0.3991 6 O 1.9986 1.7497 2.0699 O.3 1 UNL111111 -0.2849 7 O 0.3923 1.4536 -1.7989 O.co2 1 UNL111111 -0.8384 8 O 0.5657 -0.5183 -2.7846 O.co2 1 UNL111111 -0.7084 9 C -1.3606 -1.8265 0.1419 C.3 1 UNL111111 -0.1696 10 C 0.0184 -2.2064 0.7351 C.3 1 UNL111111 -0.1763 11 C -2.0713 -3.1815 -0.0933 C.3 1 UNL111111 0.1770 12 C 0.2796 -3.6698 0.2798 C.3 1 UNL111111 0.1778 13 C -0.9345 -4.1142 -0.5536 C.3 1 UNL111111 -0.4056 14 C -2.1505 -0.8951 1.0628 C.3 1 UNL111111 -0.2764 15 C 1.0984 -1.2944 0.2572 C.2 1 UNL111111 -0.0862 16 C 2.0179 -0.7864 1.0808 C.2 1 UNL111111 -0.3009 17 C -3.4766 -0.5379 0.4684 C.2 1 UNL111111 -0.1462 18 C 3.1126 0.1209 0.6212 C.3 1 UNL111111 0.4258 19 C -3.6826 0.2783 -0.5700 C.2 1 UNL111111 -0.1879 20 C 3.2584 1.3720 1.5165 C.3 1 UNL111111 -0.1059 21 C 4.6499 -1.0204 -0.6654 C.3 1 UNL111111 -0.0630 22 C 3.6770 -0.2548 -1.5790 C.3 1 UNL111111 -0.0709 23 C -2.6095 0.9735 -1.3365 C.3 1 UNL111111 -0.2931 24 C -2.4556 0.3619 -2.7412 C.3 1 UNL111111 -0.2324 25 C -1.2233 0.9125 -3.4592 C.3 1 UNL111111 -0.4130 26 C 1.0450 2.2252 1.2488 C.ar 1 UNL111111 0.2612 27 C -0.2439 2.1588 1.8510 C.ar 1 UNL111111 -0.2175 28 C 1.2607 2.7989 -0.0102 C.ar 1 UNL111111 -0.1752 29 C 0.0281 0.5748 -2.6234 C.2 1 UNL111111 0.7498 30 C -1.3455 2.6601 1.1562 C.ar 1 UNL111111 -0.0847 31 C 0.1778 3.3217 -0.7905 C.ar 1 UNL111111 0.0194 32 C -0.9115 3.1477 -0.0343 C.ar 1 UNL111111 0.3127 33 H -1.2104 -1.3284 -0.8510 H 1 UNL111111 0.1778 34 H -0.0371 -2.2032 1.8540 H 1 UNL111111 0.1689 35 H -2.9310 -3.1161 -0.7838 H 1 UNL111111 0.1386 36 H 1.2458 -3.8045 -0.2397 H 1 UNL111111 0.1248 37 H -1.1932 -5.1711 -0.3905 H 1 UNL111111 0.1574 38 H -0.7410 -3.9937 -1.6332 H 1 UNL111111 0.1687 39 H -1.5438 0.0088 1.2641 H 1 UNL111111 0.1342 40 H -2.3003 -1.3856 2.0484 H 1 UNL111111 0.1531 41 H 1.0817 -1.0437 -0.8203 H 1 UNL111111 0.2205 42 H -1.9357 -3.8979 1.7385 H 1 UNL111111 0.3325 43 H 0.4504 -5.3477 1.3430 H 1 UNL111111 0.3171 44 H 2.0503 -1.0155 2.1439 H 1 UNL111111 0.1635 45 H -4.3204 -1.0302 0.9590 H 1 UNL111111 0.1477 46 H -4.6910 0.4681 -0.9354 H 1 UNL111111 0.1386 47 H 3.7299 2.2123 0.9864 H 1 UNL111111 0.1479 48 H 3.8311 1.1365 2.4366 H 1 UNL111111 0.1742 49 H 4.4961 -2.1112 -0.6762 H 1 UNL111111 0.1380 50 H 5.7101 -0.7779 -0.8299 H 1 UNL111111 0.1331 51 H 4.1590 0.4136 -2.3050 H 1 UNL111111 0.1360 52 H 2.9251 -0.8846 -2.0949 H 1 UNL111111 0.1805 53 H -2.8300 2.0537 -1.4256 H 1 UNL111111 0.1133 54 H -1.6308 0.8884 -0.8125 H 1 UNL111111 0.1701 55 H -3.3627 0.5515 -3.3396 H 1 UNL111111 0.1278 56 H -2.3645 -0.7405 -2.6579 H 1 UNL111111 0.1524 57 H -1.1165 0.4438 -4.4529 H 1 UNL111111 0.1563 58 H -1.2924 1.9982 -3.6093 H 1 UNL111111 0.1323 59 H -0.3589 1.7088 2.8410 H 1 UNL111111 0.2200 60 H 2.2337 2.7361 -0.5122 H 1 UNL111111 0.2384 61 H 0.3106 3.7123 -1.7996 H 1 UNL111111 0.2501 @BOND 1 57 25 1 2 58 25 1 3 25 24 1 4 25 29 1 5 55 24 1 6 8 29 ar 7 24 56 1 8 24 23 1 9 29 7 ar 10 51 22 1 11 52 22 1 12 61 31 1 13 38 13 1 14 22 5 1 15 22 21 1 16 53 23 1 17 23 54 1 18 23 19 1 19 46 19 1 20 33 9 1 21 50 21 1 22 41 15 1 23 31 32 ar 24 31 28 ar 25 35 11 1 26 5 18 1 27 49 21 1 28 21 4 1 29 19 17 2 30 13 37 1 31 13 11 1 32 13 12 1 33 60 28 1 34 36 12 1 35 11 9 1 36 11 2 1 37 32 30 ar 38 28 26 ar 39 9 10 1 40 9 14 1 41 15 10 1 42 15 16 2 43 12 10 1 44 12 3 1 45 17 45 1 46 17 14 1 47 18 4 1 48 18 16 1 49 18 20 1 50 10 34 1 51 47 20 1 52 14 39 1 53 14 40 1 54 16 44 1 55 2 42 1 56 30 1 1 57 30 27 ar 58 26 27 ar 59 26 6 1 60 43 3 1 61 20 6 1 62 20 48 1 63 27 59 1