@MOLECULE methyl (5z)-7-[(1r,2r,5s)-5-(benzyloxy)-2-(4-morpholinyl)-3-oxocyclopentyl]-5-heptenoate 63 65 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5189 -1.6628 0.1503 O.3 1 UNL1111111111 -0.3928 2 O 6.1262 1.1246 -0.2326 O.3 1 UNL1111111111 -0.3853 3 O 3.0972 -2.0079 -1.8374 O.2 1 UNL1111111111 -0.4534 4 O -1.2734 2.4206 -0.5011 O.3 1 UNL1111111111 -0.4002 5 O -3.1087 2.3038 -1.7832 O.2 1 UNL1111111111 -0.5282 6 N 3.4151 0.3552 -0.0052 N.3 1 UNL1111111111 -0.4054 7 C 1.4385 -0.7196 1.0809 C.3 1 UNL1111111111 -0.1332 8 C 2.1923 -0.4208 -0.2433 C.3 1 UNL1111111111 -0.0764 9 C 0.6757 -2.0439 0.8033 C.3 1 UNL1111111111 0.1107 10 C 1.5461 -2.8321 -0.1954 C.3 1 UNL1111111111 -0.4471 11 C 2.3825 -1.7971 -0.8978 C.2 1 UNL1111111111 0.4474 12 C 0.5200 0.4388 1.4736 C.3 1 UNL1111111111 -0.2797 13 C 4.4918 -0.4381 0.6389 C.3 1 UNL1111111111 -0.1654 14 C 3.9323 0.9497 -1.2658 C.3 1 UNL1111111111 -0.1589 15 C 5.6488 0.5269 0.9578 C.3 1 UNL1111111111 -0.0419 16 C 5.1195 1.8602 -0.9019 C.3 1 UNL1111111111 -0.0448 17 C -0.1440 0.1945 2.7885 C.2 1 UNL1111111111 -0.1521 18 C -1.5819 -2.6031 0.2903 C.3 1 UNL1111111111 -0.0545 19 C -1.4566 0.3228 3.0111 C.2 1 UNL1111111111 -0.1677 20 C -2.7748 -1.8961 -0.2817 C.ar 1 UNL1111111111 -0.0223 21 C -2.4570 0.6941 1.9652 C.3 1 UNL1111111111 -0.2911 22 C -2.5565 2.2214 1.8404 C.3 1 UNL1111111111 -0.2428 23 C -4.0050 -1.9541 0.3733 C.ar 1 UNL1111111111 -0.1833 24 C -2.6383 -1.1633 -1.4612 C.ar 1 UNL1111111111 -0.1531 25 C -3.3548 2.6307 0.5992 C.3 1 UNL1111111111 -0.3531 26 C -5.1005 -1.2736 -0.1533 C.ar 1 UNL1111111111 -0.1445 27 C -3.7345 -0.4755 -1.9776 C.ar 1 UNL1111111111 -0.1228 28 C -4.9657 -0.5309 -1.3253 C.ar 1 UNL1111111111 -0.1553 29 C -2.6179 2.4235 -0.6887 C.2 1 UNL1111111111 0.6102 30 C -0.4808 2.2003 -1.6632 C.3 1 UNL1111111111 -0.1760 31 H 2.1667 -0.8974 1.9046 H 1 UNL1111111111 0.1473 32 H 1.5170 0.1783 -0.9154 H 1 UNL1111111111 0.1736 33 H 0.4646 -2.5996 1.7343 H 1 UNL1111111111 0.1249 34 H 2.1827 -3.5832 0.3016 H 1 UNL1111111111 0.1749 35 H 0.9271 -3.3947 -0.9204 H 1 UNL1111111111 0.1909 36 H -0.2277 0.6232 0.6696 H 1 UNL1111111111 0.1775 37 H 1.1184 1.3774 1.5300 H 1 UNL1111111111 0.1643 38 H 4.1082 -0.8899 1.5758 H 1 UNL1111111111 0.1381 39 H 4.8600 -1.2641 -0.0091 H 1 UNL1111111111 0.1406 40 H 4.2520 0.1763 -2.0001 H 1 UNL1111111111 0.1522 41 H 3.1284 1.5491 -1.7400 H 1 UNL1111111111 0.1391 42 H 5.3379 1.3125 1.6688 H 1 UNL1111111111 0.1291 43 H 6.5365 -0.0046 1.3422 H 1 UNL1111111111 0.1360 44 H 4.8019 2.7077 -0.2694 H 1 UNL1111111111 0.1278 45 H 5.6434 2.2323 -1.7997 H 1 UNL1111111111 0.1370 46 H 0.5348 -0.0870 3.5928 H 1 UNL1111111111 0.1344 47 H -1.7155 -2.8629 1.3570 H 1 UNL1111111111 0.1273 48 H -1.3363 -3.5187 -0.2815 H 1 UNL1111111111 0.1315 49 H -1.8756 0.1582 4.0018 H 1 UNL1111111111 0.1351 50 H -2.1723 0.2478 0.9834 H 1 UNL1111111111 0.1728 51 H -3.4499 0.2601 2.1955 H 1 UNL1111111111 0.1402 52 H -3.0345 2.6381 2.7477 H 1 UNL1111111111 0.1402 53 H -1.5385 2.6613 1.8078 H 1 UNL1111111111 0.1625 54 H -4.1108 -2.5241 1.2922 H 1 UNL1111111111 0.1486 55 H -1.6744 -1.1233 -1.9666 H 1 UNL1111111111 0.1634 56 H -4.3133 2.0652 0.5529 H 1 UNL1111111111 0.1812 57 H -3.6449 3.7024 0.6669 H 1 UNL1111111111 0.1756 58 H -6.0624 -1.3206 0.3531 H 1 UNL1111111111 0.1468 59 H -3.6265 0.1220 -2.8847 H 1 UNL1111111111 0.1672 60 H -5.8181 0.0102 -1.7315 H 1 UNL1111111111 0.1530 61 H -0.6313 1.1766 -2.0228 H 1 UNL1111111111 0.1383 62 H -0.7351 2.9205 -2.4483 H 1 UNL1111111111 0.1450 63 H 0.5407 2.3532 -1.2948 H 1 UNL1111111111 0.1467 @BOND 1 1 9 1 2 1 18 1 3 2 15 1 4 2 16 1 5 3 11 2 6 4 29 1 7 4 30 1 8 5 29 2 9 6 8 1 10 6 13 1 11 6 14 1 12 7 8 1 13 7 9 1 14 7 12 1 15 7 31 1 16 8 11 1 17 8 32 1 18 9 10 1 19 9 33 1 20 10 11 1 21 10 34 1 22 10 35 1 23 12 17 1 24 12 36 1 25 12 37 1 26 13 15 1 27 13 38 1 28 13 39 1 29 14 16 1 30 14 40 1 31 14 41 1 32 15 42 1 33 15 43 1 34 16 44 1 35 16 45 1 36 17 19 2 37 17 46 1 38 18 20 1 39 18 47 1 40 18 48 1 41 19 21 1 42 19 49 1 43 20 23 ar 44 20 24 ar 45 21 22 1 46 21 50 1 47 21 51 1 48 22 25 1 49 22 52 1 50 22 53 1 51 23 26 ar 52 23 54 1 53 24 27 ar 54 24 55 1 55 25 29 1 56 25 56 1 57 25 57 1 58 26 28 ar 59 26 58 1 60 27 28 ar 61 27 59 1 62 28 60 1 63 30 61 1 64 30 62 1 65 30 63 1