@MOLECULE (6s,9as)-6-(hydroxymethyl)-3-[(1z,4e,6e,8e)-1-hydroxy-3-oxo-1,4,6,8-decatetraen-1-yl]-9a-methyl-5,6-dihydro-2h-furo[3,2-g]isochromene-2,9(9ah)-dione 52 54 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.1808 -2.9209 0.4548 O.3 1 UNL1111111111 -0.3683 2 O 4.4484 3.0113 0.8096 O.2 1 UNL1111111111 -0.3182 3 O 4.7108 -1.0103 1.7686 O.2 1 UNL1111111111 -0.3928 4 O 1.5598 -4.4484 0.6480 O.2 1 UNL1111111111 -0.3720 5 O 3.7610 5.5353 -1.3572 O.3 1 UNL1111111111 -0.5174 6 O -0.7301 -3.3486 -1.1104 O.2 1 UNL1111111111 -0.4492 7 O -3.1043 -2.3709 -0.9418 O.2 1 UNL1111111111 -0.5713 8 C 3.3279 -1.6174 -0.1080 C.3 1 UNL1111111111 0.1384 9 C 1.9056 -1.1581 -0.4157 C.2 1 UNL1111111111 0.1010 10 C 2.5446 1.1376 -0.1939 C.2 1 UNL1111111111 0.1495 11 C 3.7010 0.7645 0.5960 C.2 1 UNL1111111111 -0.4126 12 C 3.9815 -0.6539 0.8834 C.2 1 UNL1111111111 0.4628 13 C 2.2995 2.6108 -0.3131 C.3 1 UNL1111111111 -0.3615 14 C 1.6798 0.2287 -0.6980 C.2 1 UNL1111111111 -0.2834 15 C 3.6162 3.3796 -0.3126 C.3 1 UNL1111111111 0.0622 16 C 1.0692 -2.2010 -0.2288 C.2 1 UNL1111111111 -0.2701 17 C 4.1969 -1.7416 -1.3497 C.3 1 UNL1111111111 -0.4605 18 C 1.8543 -3.3463 0.3073 C.2 1 UNL1111111111 0.5894 19 C 4.5195 1.7168 1.1114 C.2 1 UNL1111111111 0.2593 20 C 3.4533 4.8986 -0.1398 C.3 1 UNL1111111111 -0.0417 21 C -0.3640 -2.2553 -0.4468 C.2 1 UNL1111111111 0.4609 22 C -1.2404 -1.2916 -0.0431 C.2 1 UNL1111111111 -0.5600 23 C -2.6556 -1.4070 -0.3183 C.2 1 UNL1111111111 0.5377 24 C -3.5598 -0.3482 0.1550 C.2 1 UNL1111111111 -0.3223 25 C -4.8741 -0.4004 -0.1233 C.2 1 UNL1111111111 -0.0192 26 C -5.8138 0.6103 0.3262 C.2 1 UNL1111111111 -0.2180 27 C -7.1258 0.5410 0.0332 C.2 1 UNL1111111111 -0.0874 28 C -8.0804 1.5371 0.4879 C.2 1 UNL1111111111 -0.2222 29 C -9.3867 1.4623 0.1909 C.2 1 UNL1111111111 -0.0747 30 C -10.3818 2.4651 0.6518 C.3 1 UNL1111111111 -0.4570 31 H 1.7193 2.8543 -1.2275 H 1 UNL1111111111 0.1730 32 H 1.6533 2.9303 0.5381 H 1 UNL1111111111 0.1813 33 H 0.7868 0.5004 -1.2578 H 1 UNL1111111111 0.1853 34 H 4.2268 3.1521 -1.2207 H 1 UNL1111111111 0.1632 35 H 4.3632 -0.7744 -1.8370 H 1 UNL1111111111 0.1599 36 H 5.1776 -2.1733 -1.0938 H 1 UNL1111111111 0.1798 37 H 3.7409 -2.4181 -2.0876 H 1 UNL1111111111 0.1751 38 H 5.3332 1.5659 1.8296 H 1 UNL1111111111 0.1901 39 H 4.2194 5.3050 0.5585 H 1 UNL1111111111 0.1746 40 H 2.4540 5.1951 0.2161 H 1 UNL1111111111 0.1286 41 H -0.8966 -0.4278 0.5112 H 1 UNL1111111111 0.1858 42 H 3.0273 5.4441 -1.9994 H 1 UNL1111111111 0.3109 43 H -1.7618 -3.3602 -1.2441 H 1 UNL1111111111 0.3945 44 H -3.1127 0.4535 0.7340 H 1 UNL1111111111 0.1621 45 H -5.2832 -1.2348 -0.7108 H 1 UNL1111111111 0.1706 46 H -5.4064 1.4290 0.9199 H 1 UNL1111111111 0.1559 47 H -7.5296 -0.2820 -0.5635 H 1 UNL1111111111 0.1514 48 H -7.6814 2.3538 1.0901 H 1 UNL1111111111 0.1546 49 H -9.7961 0.6501 -0.4113 H 1 UNL1111111111 0.1441 50 H -10.8876 2.9454 -0.1999 H 1 UNL1111111111 0.1605 51 H -11.1655 1.9937 1.2652 H 1 UNL1111111111 0.1617 52 H -9.9391 3.2673 1.2579 H 1 UNL1111111111 0.1551 @BOND 1 1 8 1 2 1 18 1 3 2 15 1 4 2 19 1 5 3 12 2 6 4 18 2 7 5 20 1 8 5 42 1 9 6 21 1 10 6 43 1 11 7 23 2 12 8 9 1 13 8 12 1 14 8 17 1 15 9 14 1 16 9 16 2 17 10 11 1 18 10 13 1 19 10 14 2 20 11 12 1 21 11 19 2 22 13 15 1 23 13 31 1 24 13 32 1 25 14 33 1 26 15 20 1 27 15 34 1 28 16 18 1 29 16 21 1 30 17 35 1 31 17 36 1 32 17 37 1 33 19 38 1 34 20 39 1 35 20 40 1 36 21 22 2 37 22 23 1 38 22 41 1 39 23 24 1 40 24 25 2 41 24 44 1 42 25 26 1 43 25 45 1 44 26 27 2 45 26 46 1 46 27 28 1 47 27 47 1 48 28 29 2 49 28 48 1 50 29 30 1 51 29 49 1 52 30 50 1 53 30 51 1 54 30 52 1