@MOLECULE (7z)-9-{(2r)-3,5-dihydroxy-2-[(1e)-3-hydroxy-1-octen-1-yl]cyclopentyl}-7-nonenoic acid 65 65 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.5195 1.2886 1.1851 O.3 1 UNL1111111111 -0.5585 2 O 1.0324 4.2538 0.2749 O.3 1 UNL1111111111 -0.5549 3 O 6.0847 1.3331 0.7258 O.3 1 UNL1111111111 -0.5691 4 O -4.1154 1.6841 -1.4724 O.3 1 UNL1111111111 -0.5720 5 O -4.5524 1.5919 0.7043 O.2 1 UNL1111111111 -0.5280 6 C 0.3646 0.7583 -0.1637 C.3 1 UNL1111111111 -0.1184 7 C 1.3323 1.9245 0.1484 C.3 1 UNL1111111111 -0.1559 8 C -1.0425 1.4062 -0.1354 C.3 1 UNL1111111111 0.1531 9 C 0.6763 3.1487 -0.5276 C.3 1 UNL1111111111 0.1673 10 C -0.8469 2.8978 -0.4920 C.3 1 UNL1111111111 -0.4139 11 C 0.5220 -0.3998 0.8244 C.3 1 UNL1111111111 -0.2782 12 C 2.6941 1.6181 -0.3717 C.2 1 UNL1111111111 -0.1480 13 C -0.2734 -1.5811 0.3721 C.2 1 UNL1111111111 -0.1692 14 C 3.7030 1.2872 0.4373 C.2 1 UNL1111111111 -0.2299 15 C 5.0302 0.8168 -0.0773 C.3 1 UNL1111111111 0.1555 16 C -1.1963 -2.1616 1.1426 C.2 1 UNL1111111111 -0.1551 17 C 5.1478 -0.7119 0.0747 C.3 1 UNL1111111111 -0.3003 18 C -2.0378 -3.3090 0.6818 C.3 1 UNL1111111111 -0.2821 19 C 4.2168 -1.4411 -0.9003 C.3 1 UNL1111111111 -0.2748 20 C -3.5293 -2.9418 0.7741 C.3 1 UNL1111111111 -0.2585 21 C 3.6360 -2.7114 -0.2654 C.3 1 UNL1111111111 -0.2682 22 C -3.8479 -1.7596 -0.1500 C.3 1 UNL1111111111 -0.2773 23 C 2.6542 -3.3980 -1.2250 C.3 1 UNL1111111111 -0.2508 24 C -5.2670 -1.2357 0.0946 C.3 1 UNL1111111111 -0.2581 25 C -5.5736 -0.0322 -0.8058 C.3 1 UNL1111111111 -0.3456 26 C 1.9166 -4.5382 -0.5227 C.3 1 UNL1111111111 -0.4434 27 C -4.7283 1.1270 -0.3924 C.2 1 UNL1111111111 0.6630 28 H 0.5554 0.3844 -1.1973 H 1 UNL1111111111 0.1360 29 H 1.3485 2.1165 1.2533 H 1 UNL1111111111 0.1853 30 H -1.7477 0.8894 -0.8163 H 1 UNL1111111111 0.1083 31 H 1.0499 3.3280 -1.5547 H 1 UNL1111111111 0.1088 32 H -1.3224 3.1596 -1.4441 H 1 UNL1111111111 0.1330 33 H -1.3051 3.5293 0.2942 H 1 UNL1111111111 0.1772 34 H 1.5962 -0.6759 0.9065 H 1 UNL1111111111 0.1536 35 H 0.2184 -0.0700 1.8424 H 1 UNL1111111111 0.1732 36 H 2.7995 1.6386 -1.4551 H 1 UNL1111111111 0.1407 37 H -2.4616 1.5558 1.2445 H 1 UNL1111111111 0.3295 38 H 0.6545 5.0807 -0.0765 H 1 UNL1111111111 0.3107 39 H -0.0524 -1.9305 -0.6337 H 1 UNL1111111111 0.1374 40 H 3.6147 1.2929 1.5230 H 1 UNL1111111111 0.1650 41 H 5.2365 1.1411 -1.1215 H 1 UNL1111111111 0.1182 42 H -1.4137 -1.8077 2.1498 H 1 UNL1111111111 0.1533 43 H 6.2014 -1.0108 -0.0857 H 1 UNL1111111111 0.1540 44 H 4.9309 -0.9888 1.1242 H 1 UNL1111111111 0.1561 45 H -1.8315 -4.2017 1.3072 H 1 UNL1111111111 0.1433 46 H -1.7876 -3.6100 -0.3539 H 1 UNL1111111111 0.1400 47 H 4.7594 -1.6935 -1.8291 H 1 UNL1111111111 0.1329 48 H 3.3837 -0.7791 -1.2105 H 1 UNL1111111111 0.1432 49 H -3.7852 -2.6855 1.8203 H 1 UNL1111111111 0.1421 50 H -4.1513 -3.8153 0.5106 H 1 UNL1111111111 0.1301 51 H 3.1184 -2.4577 0.6802 H 1 UNL1111111111 0.1425 52 H 4.4480 -3.4078 0.0109 H 1 UNL1111111111 0.1363 53 H 5.9292 2.2740 0.9320 H 1 UNL1111111111 0.3187 54 H -3.7199 -2.0586 -1.2060 H 1 UNL1111111111 0.1370 55 H -3.1090 -0.9482 0.0253 H 1 UNL1111111111 0.1574 56 H 1.9229 -2.6618 -1.6101 H 1 UNL1111111111 0.1324 57 H 3.1947 -3.7809 -2.1099 H 1 UNL1111111111 0.1302 58 H -6.0071 -2.0372 -0.0889 H 1 UNL1111111111 0.1439 59 H -5.3868 -0.9497 1.1610 H 1 UNL1111111111 0.1601 60 H -5.4091 -0.2892 -1.8751 H 1 UNL1111111111 0.1822 61 H -6.6456 0.2518 -0.7249 H 1 UNL1111111111 0.1778 62 H 2.6156 -5.2743 -0.1110 H 1 UNL1111111111 0.1426 63 H 1.3042 -4.1639 0.3074 H 1 UNL1111111111 0.1493 64 H 1.2498 -5.0662 -1.2119 H 1 UNL1111111111 0.1366 65 H -3.5759 2.4841 -1.2586 H 1 UNL1111111111 0.3520 @BOND 1 1 8 1 2 1 37 1 3 2 9 1 4 2 38 1 5 3 15 1 6 3 53 1 7 4 27 1 8 4 65 1 9 5 27 2 10 6 7 1 11 6 8 1 12 6 11 1 13 6 28 1 14 7 9 1 15 7 12 1 16 7 29 1 17 8 10 1 18 8 30 1 19 9 10 1 20 9 31 1 21 10 32 1 22 10 33 1 23 11 13 1 24 11 34 1 25 11 35 1 26 12 14 2 27 12 36 1 28 13 16 2 29 13 39 1 30 14 15 1 31 14 40 1 32 15 17 1 33 15 41 1 34 16 18 1 35 16 42 1 36 17 19 1 37 17 43 1 38 17 44 1 39 18 20 1 40 18 45 1 41 18 46 1 42 19 21 1 43 19 47 1 44 19 48 1 45 20 22 1 46 20 49 1 47 20 50 1 48 21 23 1 49 21 51 1 50 21 52 1 51 22 24 1 52 22 54 1 53 22 55 1 54 23 26 1 55 23 56 1 56 23 57 1 57 24 25 1 58 24 58 1 59 24 59 1 60 25 27 1 61 25 60 1 62 25 61 1 63 26 62 1 64 26 63 1 65 26 64 1