@MOLECULE (1ar,3s,3ar,4r,5r,5ar,5br,8as,10ar,10br,11ar,11br)-10a-acetoxy-3-(3-furyl)-5-hydroxy-3a,5b,8a,11a-tetramethyl-8,11-dioxo-2,3,3a,4,5,5a,5b,8,8a,9,10a,10b,11,11a-tetradecahydro-1ah-oxireno[2',3']cyclopenta[1',2':7,8]phenanthro[10,1-bc]furan-4-yl 2-methylpropanoate 63 69 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.1581 -1.8190 2.4562 O.3 1 UNL111111 -0.3845 2 O 2.3353 1.6241 -0.1901 O.3 1 UNL111111 -0.4410 3 O -3.9289 -0.9692 0.5158 O.3 1 UNL111111 -0.3659 4 O 0.4955 1.2750 2.7703 O.3 1 UNL111111 -0.5363 5 O -3.1551 -1.3273 -1.6326 O.3 1 UNL111111 -0.5286 6 O -1.2977 -2.6470 -0.3263 O.2 1 UNL111111 -0.3804 7 O 5.7313 -1.5116 -1.8055 O.2 1 UNL111111 -0.5421 8 O -5.3977 3.1145 -0.0842 O.2 1 UNL111111 -0.3759 9 O 4.2871 2.1933 0.7976 O.2 1 UNL111111 -0.4618 10 O -3.8961 -3.3305 -0.8340 O.2 1 UNL111111 -0.4130 11 C 0.7567 -1.3832 1.1429 C.3 1 UNL111111 0.1086 12 C 1.8899 -0.6429 0.4138 C.3 1 UNL111111 0.0151 13 C -0.6634 -0.8331 1.1057 C.3 1 UNL111111 -0.0238 14 C 1.2188 -2.7881 1.3998 C.3 1 UNL111111 0.0642 15 C -0.5472 0.6484 0.6377 C.3 1 UNL111111 -0.2100 16 C 3.1597 -1.4634 0.8574 C.3 1 UNL111111 -0.0994 17 C 1.9612 0.8078 0.9165 C.3 1 UNL111111 0.0168 18 C 2.6505 -2.9323 0.9121 C.3 1 UNL111111 -0.3053 19 C -1.8907 1.3844 0.5972 C.3 1 UNL111111 0.0958 20 C 0.5865 1.3756 1.3793 C.3 1 UNL111111 0.1514 21 C -2.6839 0.6863 -0.5641 C.3 1 UNL111111 -0.1974 22 C -1.5637 -1.5687 0.1244 C.2 1 UNL111111 0.3950 23 C -2.8343 -0.8260 -0.3424 C.3 1 UNL111111 0.3474 24 C 1.7118 -0.7616 -1.0975 C.3 1 UNL111111 -0.4379 25 C -1.3279 -1.1280 2.4622 C.3 1 UNL111111 -0.4422 26 C -4.1646 1.1339 -0.6602 C.3 1 UNL111111 -0.3704 27 C 4.3226 -1.2579 0.0004 C.ar 1 UNL111111 -0.3264 28 C -2.5693 1.4410 1.9684 C.3 1 UNL111111 -0.4734 29 C -1.8379 2.8461 0.1206 C.2 1 UNL111111 -0.1385 30 C -4.8685 0.0950 0.2486 C.3 1 UNL111111 -0.0211 31 C -4.3226 2.6201 -0.2825 C.2 1 UNL111111 0.4622 32 C -4.6397 0.9899 -2.0502 C.3 1 UNL111111 0.2007 33 C -3.0372 3.2525 -0.2128 C.2 1 UNL111111 -0.1198 34 C 5.3870 -0.4900 0.0972 C.ar 1 UNL111111 -0.1941 35 C 4.5584 -2.0119 -1.3635 C.ar 1 UNL111111 0.4937 36 C 3.5414 2.2565 -0.1405 C.2 1 UNL111111 0.6606 37 C -3.5620 -2.6362 -1.7618 C.2 1 UNL111111 0.3514 38 C 6.3776 -0.5918 -1.0224 C.ar 1 UNL111111 0.4732 39 C 3.7396 2.9694 -1.3881 C.3 1 UNL111111 -0.7963 40 C -3.5475 -3.0197 -3.1658 C.3 1 UNL111111 0.3079 41 C 4.1230 2.4657 -2.6189 C.3 1 UNL111111 0.3099 42 C 3.6370 4.2812 -1.7064 C.3 1 UNL111111 0.4581 43 H 0.5785 -3.6551 1.4960 H 1 UNL111111 0.1705 44 H -0.1975 0.6164 -0.4434 H 1 UNL111111 0.1666 45 H 3.4189 -1.1517 1.9085 H 1 UNL111111 0.1756 46 H 2.6943 0.9153 1.7587 H 1 UNL111111 0.1790 47 H 3.2634 -3.5457 1.5986 H 1 UNL111111 0.1609 48 H 2.6888 -3.4197 -0.0777 H 1 UNL111111 0.1646 49 H 0.5518 2.4788 1.2165 H 1 UNL111111 0.1584 50 H -2.1568 0.8910 -1.5265 H 1 UNL111111 0.1762 51 H 2.5747 -0.3610 -1.6412 H 1 UNL111111 0.1440 52 H 1.5873 -1.8076 -1.4028 H 1 UNL111111 0.1699 53 H 0.8392 -0.2121 -1.4711 H 1 UNL111111 0.1514 54 H -1.0156 -0.4270 3.2458 H 1 UNL111111 0.1757 55 H -1.0758 -2.1405 2.8198 H 1 UNL111111 0.1746 56 H -2.4270 -1.1006 2.4145 H 1 UNL111111 0.1671 57 H -3.1305 0.5276 2.2019 H 1 UNL111111 0.1706 58 H -3.2810 2.2663 2.0766 H 1 UNL111111 0.1527 59 H -1.8119 1.5887 2.7588 H 1 UNL111111 0.1919 60 H -0.9137 3.3981 0.1152 H 1 UNL111111 0.1818 61 H -5.7359 -0.3805 -0.2426 H 1 UNL111111 0.1511 62 H -5.1556 0.4831 1.2361 H 1 UNL111111 0.1550 63 H 0.6615 0.3491 3.0743 H 1 UNL111111 0.3357 @BOND 1 61 30 1 2 8 31 2 3 32 26 1 4 62 30 1 5 30 26 1 6 30 3 1 7 31 26 1 8 31 33 1 9 26 21 1 10 40 37 1 11 37 10 2 12 37 5 1 13 3 23 1 14 5 23 1 15 33 29 2 16 21 23 1 17 21 50 1 18 21 19 1 19 23 22 1 20 58 28 1 21 57 28 1 22 28 19 1 23 28 59 1 24 29 19 1 25 29 60 1 26 19 15 1 27 56 25 1 28 22 6 2 29 22 13 1 30 25 13 1 31 25 55 1 32 25 54 1 33 15 44 1 34 15 13 1 35 15 20 1 36 13 11 1 37 53 24 1 38 49 20 1 39 20 4 1 40 20 17 1 41 52 24 1 42 11 14 1 43 11 12 1 44 11 1 1 45 4 63 1 46 43 14 1 47 24 51 1 48 24 12 1 49 14 1 1 50 14 18 1 51 12 17 1 52 12 16 1 53 2 17 1 54 2 36 1 55 17 46 1 56 39 36 1 57 39 42 1 58 39 41 1 59 48 18 1 60 18 16 1 61 18 47 1 62 36 9 2 63 16 45 1 64 16 27 1 65 35 27 ar 66 35 7 ar 67 27 34 ar 68 7 38 ar 69 34 38 ar