@MOLECULE (1ar,1bs,4ar,7as,7br,8r,9as)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9ah-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl 2-methylpropanoate 64 67 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.1467 0.1323 -0.3960 O.3 1 UNL1111111111 -0.4172 2 O 0.0698 -0.5512 -2.0087 O.3 1 UNL1111111111 -0.5624 3 O 2.1155 -0.2352 1.6895 O.3 1 UNL1111111111 -0.5426 4 O -4.3641 -0.3854 1.4347 O.2 1 UNL1111111111 -0.5012 5 O 5.0089 -1.1850 1.1986 O.2 1 UNL1111111111 -0.3895 6 O 4.5878 3.3880 -0.7387 O.3 1 UNL1111111111 -0.5343 7 C -1.0835 1.4067 -0.3315 C.3 1 UNL1111111111 -0.2287 8 C -2.0156 0.4332 0.3731 C.3 1 UNL1111111111 0.1901 9 C -1.9089 1.8736 0.8733 C.3 1 UNL1111111111 0.0088 10 C 0.3714 1.0292 -0.1853 C.3 1 UNL1111111111 -0.1753 11 C 0.5165 -0.4471 -0.6694 C.3 1 UNL1111111111 0.3116 12 C -1.3935 -0.7498 1.0580 C.3 1 UNL1111111111 -0.3098 13 C -0.3637 -1.4467 0.1399 C.3 1 UNL1111111111 -0.1004 14 C -1.2720 2.1753 2.2020 C.3 1 UNL1111111111 -0.4394 15 C -3.0654 2.7960 0.5720 C.3 1 UNL1111111111 -0.4390 16 C 2.0151 -0.8307 -0.7011 C.3 1 UNL1111111111 -0.2666 17 C 1.2956 1.9458 -0.9138 C.2 1 UNL1111111111 -0.2005 18 C 2.8461 -0.2621 0.4834 C.3 1 UNL1111111111 0.2055 19 C -1.1036 -2.3999 -0.8052 C.3 1 UNL1111111111 -0.4319 20 C 2.6174 1.9861 -0.6935 C.2 1 UNL1111111111 -0.0475 21 C 3.3680 1.1553 0.2960 C.3 1 UNL1111111111 -0.3079 22 C 2.3320 -2.3011 -0.6991 C.2 1 UNL1111111111 -0.1081 23 C -4.2763 -0.2747 0.2421 C.2 1 UNL1111111111 0.5939 24 C 3.9492 -1.3510 0.6723 C.2 1 UNL1111111111 0.3894 25 C 3.4140 -2.5917 0.0444 C.2 1 UNL1111111111 -0.1399 26 C 3.4766 2.9362 -1.4849 C.3 1 UNL1111111111 -0.0195 27 C -5.3297 -0.5695 -0.8045 C.3 1 UNL1111111111 -0.1374 28 C 4.0617 -3.8935 0.2677 C.3 1 UNL1111111111 -0.4267 29 C -5.4299 -2.0901 -0.9370 C.3 1 UNL1111111111 -0.4407 30 C -6.6487 0.0516 -0.3508 C.3 1 UNL1111111111 -0.4401 31 H -1.3608 1.7954 -1.3126 H 1 UNL1111111111 0.1674 32 H 0.6500 1.0634 0.9103 H 1 UNL1111111111 0.2005 33 H -2.1753 -1.4740 1.3702 H 1 UNL1111111111 0.1749 34 H -0.9114 -0.4378 2.0066 H 1 UNL1111111111 0.1576 35 H 0.3101 -2.0548 0.7918 H 1 UNL1111111111 0.1278 36 H -0.9817 3.2324 2.2699 H 1 UNL1111111111 0.1539 37 H -1.9728 1.9681 3.0241 H 1 UNL1111111111 0.1614 38 H -0.3649 1.5866 2.3952 H 1 UNL1111111111 0.1531 39 H -3.5338 2.5787 -0.3964 H 1 UNL1111111111 0.1513 40 H -3.8480 2.7015 1.3381 H 1 UNL1111111111 0.1579 41 H -2.7405 3.8436 0.5508 H 1 UNL1111111111 0.1510 42 H 2.4303 -0.4063 -1.6583 H 1 UNL1111111111 0.1867 43 H 0.8211 2.6132 -1.6316 H 1 UNL1111111111 0.1492 44 H -1.8587 -1.8519 -1.3901 H 1 UNL1111111111 0.1694 45 H -0.4270 -2.8605 -1.5337 H 1 UNL1111111111 0.1498 46 H -1.6106 -3.1968 -0.2546 H 1 UNL1111111111 0.1345 47 H 0.2383 0.2686 -2.5090 H 1 UNL1111111111 0.3171 48 H 4.4544 1.1202 0.0373 H 1 UNL1111111111 0.1899 49 H 3.3494 1.6688 1.2916 H 1 UNL1111111111 0.1897 50 H 1.7323 -2.9792 -1.2845 H 1 UNL1111111111 0.1691 51 H 1.6843 -1.0987 1.8674 H 1 UNL1111111111 0.3203 52 H 2.9193 3.8172 -1.8544 H 1 UNL1111111111 0.1236 53 H 3.9544 2.4241 -2.3467 H 1 UNL1111111111 0.1523 54 H -5.0240 -0.1304 -1.7890 H 1 UNL1111111111 0.1673 55 H 5.1563 -3.8233 0.1411 H 1 UNL1111111111 0.1701 56 H 3.7014 -4.6730 -0.4175 H 1 UNL1111111111 0.1540 57 H 3.8946 -4.2563 1.2953 H 1 UNL1111111111 0.1623 58 H -6.1956 -2.3722 -1.6690 H 1 UNL1111111111 0.1535 59 H -5.6982 -2.5617 0.0179 H 1 UNL1111111111 0.1597 60 H -4.4795 -2.5281 -1.2685 H 1 UNL1111111111 0.1535 61 H -7.4630 -0.1957 -1.0412 H 1 UNL1111111111 0.1507 62 H -6.5838 1.1446 -0.2922 H 1 UNL1111111111 0.1491 63 H -6.9394 -0.3097 0.6466 H 1 UNL1111111111 0.1651 64 H 4.2935 3.8225 0.0873 H 1 UNL1111111111 0.3135 @BOND 1 1 8 1 2 1 23 1 3 2 11 1 4 2 47 1 5 3 18 1 6 3 51 1 7 4 23 2 8 5 24 2 9 6 26 1 10 6 64 1 11 7 8 1 12 7 9 1 13 7 10 1 14 7 31 1 15 8 9 1 16 8 12 1 17 9 14 1 18 9 15 1 19 10 11 1 20 10 17 1 21 10 32 1 22 11 13 1 23 11 16 1 24 12 13 1 25 12 33 1 26 12 34 1 27 13 19 1 28 13 35 1 29 14 36 1 30 14 37 1 31 14 38 1 32 15 39 1 33 15 40 1 34 15 41 1 35 16 18 1 36 16 22 1 37 16 42 1 38 17 20 2 39 17 43 1 40 18 21 1 41 18 24 1 42 19 44 1 43 19 45 1 44 19 46 1 45 20 21 1 46 20 26 1 47 21 48 1 48 21 49 1 49 22 25 2 50 22 50 1 51 23 27 1 52 24 25 1 53 25 28 1 54 26 52 1 55 26 53 1 56 27 29 1 57 27 30 1 58 27 54 1 59 28 55 1 60 28 56 1 61 28 57 1 62 29 58 1 63 29 59 1 64 29 60 1 65 30 61 1 66 30 62 1 67 30 63 1