@MOLECULE (4r,5r)-4-hydroxy-4-(2-hydroxyethyl)-1-[(2e,4e,6e,8e)-2,6,8-trimethyl-9-(2-oxo-2,5-dihydro-3-furanyl)-2,4,6,8-nonatetraenoyl]-6-oxa-3-azabicyclo[3.1.0]hexan-2-one 55 57 0 0 0 SMALL GASTEIGER @ATOM 1 O 5.2569 -1.5948 1.0880 O.3 1 UNL1111111111 -0.2559 2 O 7.0488 0.5798 1.2447 O.3 1 UNL1111111111 -0.5557 3 O 5.4407 -1.3635 -2.3081 O.2 1 UNL1111111111 -0.4322 4 O 3.1673 -3.1606 -0.2262 O.2 1 UNL1111111111 -0.3576 5 O 6.1595 4.4739 0.3696 O.3 1 UNL1111111111 -0.5423 6 O -8.8650 1.9372 -0.3956 O.3 1 UNL1111111111 -0.3850 7 O -6.7650 2.6434 -0.7088 O.2 1 UNL1111111111 -0.4201 8 N 6.0617 0.3052 -0.8597 N.am 1 UNL1111111111 -0.6714 9 C 4.7696 -0.2522 1.0530 C.3 1 UNL1111111111 -0.0839 10 C 4.4762 -1.2197 -0.0491 C.3 1 UNL1111111111 -0.0677 11 C 5.8561 0.7306 0.5391 C.3 1 UNL1111111111 0.4649 12 C 5.3586 -0.8398 -1.2323 C.2 1 UNL1111111111 0.5739 13 C 5.4567 2.1971 0.6774 C.3 1 UNL1111111111 -0.3646 14 C 3.1934 -1.9585 -0.2780 C.2 1 UNL1111111111 0.4420 15 C 6.5534 3.1365 0.1564 C.3 1 UNL1111111111 0.0196 16 C 1.9874 -1.1253 -0.5040 C.2 1 UNL1111111111 -0.1123 17 C 2.1760 0.1663 -1.2104 C.3 1 UNL1111111111 -0.4391 18 C 0.8172 -1.6047 -0.0435 C.2 1 UNL1111111111 -0.0988 19 C -0.4475 -0.8925 -0.0680 C.2 1 UNL1111111111 -0.1662 20 C -1.5919 -1.4966 0.2953 C.2 1 UNL1111111111 -0.1466 21 C -2.8986 -0.8416 0.3633 C.2 1 UNL1111111111 0.0509 22 C -4.0017 -1.6056 0.4773 C.2 1 UNL1111111111 -0.2300 23 C -2.9267 0.6479 0.3393 C.3 1 UNL1111111111 -0.4580 24 C -5.3749 -1.1176 0.5900 C.2 1 UNL1111111111 0.0919 25 C -5.8918 -0.2414 -0.2905 C.2 1 UNL1111111111 -0.2292 26 C -7.2359 0.2691 -0.2551 C.2 1 UNL1111111111 -0.1025 27 C -6.1372 -1.6946 1.7359 C.3 1 UNL1111111111 -0.4608 28 C -8.4189 -0.3385 -0.0535 C.2 1 UNL1111111111 -0.1636 29 C -9.5195 0.6825 -0.1359 C.3 1 UNL1111111111 -0.0584 30 C -7.4960 1.7257 -0.4863 C.2 1 UNL1111111111 0.5717 31 H 4.1030 0.0535 1.8469 H 1 UNL1111111111 0.1834 32 H 6.7836 0.7141 -1.4250 H 1 UNL1111111111 0.3357 33 H 5.2539 2.4240 1.7444 H 1 UNL1111111111 0.1681 34 H 4.5105 2.3951 0.1347 H 1 UNL1111111111 0.1732 35 H 7.3166 -0.3673 1.3185 H 1 UNL1111111111 0.3484 36 H 7.5290 2.9425 0.6380 H 1 UNL1111111111 0.1341 37 H 6.6609 3.0862 -0.9436 H 1 UNL1111111111 0.1419 38 H 2.9194 0.0894 -2.0217 H 1 UNL1111111111 0.1702 39 H 1.2504 0.5217 -1.6887 H 1 UNL1111111111 0.1648 40 H 2.5112 0.9610 -0.5279 H 1 UNL1111111111 0.1566 41 H 0.7875 -2.6046 0.4147 H 1 UNL1111111111 0.1688 42 H 6.2330 4.7147 1.3132 H 1 UNL1111111111 0.3124 43 H -0.4198 0.1547 -0.3745 H 1 UNL1111111111 0.1599 44 H -1.5912 -2.5573 0.5722 H 1 UNL1111111111 0.1551 45 H -3.9230 -2.6963 0.5105 H 1 UNL1111111111 0.1610 46 H -2.1271 1.0850 0.9533 H 1 UNL1111111111 0.1565 47 H -3.8737 1.0611 0.7235 H 1 UNL1111111111 0.1742 48 H -2.8080 1.0336 -0.6851 H 1 UNL1111111111 0.1672 49 H -5.2744 0.1564 -1.1056 H 1 UNL1111111111 0.1805 50 H -6.9293 -1.0208 2.0929 H 1 UNL1111111111 0.1624 51 H -5.4862 -1.9032 2.5979 H 1 UNL1111111111 0.1619 52 H -6.6143 -2.6447 1.4541 H 1 UNL1111111111 0.1613 53 H -8.6224 -1.3766 0.1273 H 1 UNL1111111111 0.1707 54 H -10.0789 0.8158 0.8065 H 1 UNL1111111111 0.1585 55 H -10.2183 0.5204 -0.9755 H 1 UNL1111111111 0.1603 @BOND 1 1 9 1 2 1 10 1 3 2 11 1 4 2 35 1 5 3 12 2 6 4 14 2 7 5 15 1 8 5 42 1 9 6 29 1 10 6 30 1 11 7 30 2 12 8 11 1 13 8 12 am 14 8 32 1 15 9 10 1 16 9 11 1 17 9 31 1 18 10 12 1 19 10 14 1 20 11 13 1 21 13 15 1 22 13 33 1 23 13 34 1 24 14 16 1 25 15 36 1 26 15 37 1 27 16 17 1 28 16 18 2 29 17 38 1 30 17 39 1 31 17 40 1 32 18 19 1 33 18 41 1 34 19 20 2 35 19 43 1 36 20 21 1 37 20 44 1 38 21 22 2 39 21 23 1 40 22 24 1 41 22 45 1 42 23 46 1 43 23 47 1 44 23 48 1 45 24 25 2 46 24 27 1 47 25 26 1 48 25 49 1 49 26 28 2 50 26 30 1 51 27 50 1 52 27 51 1 53 27 52 1 54 28 29 1 55 28 53 1 56 29 54 1 57 29 55 1