@MOLECULE (5beta,6beta,9beta,11beta)-6,9,11-trihydroxy-6,20-epoxypimara-8(14),15-diene-7,20-dione 52 55 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.0344 -1.0818 1.5429 O.3 1 UNL1111111111 -0.4587 2 O 0.4513 0.6435 -1.9441 O.3 1 UNL1111111111 -0.5320 3 O -2.1208 -2.6348 0.2600 O.3 1 UNL1111111111 -0.4888 4 O 1.2339 2.7998 -0.6338 O.3 1 UNL1111111111 -0.5851 5 O -0.5113 0.8500 2.5323 O.2 1 UNL1111111111 -0.4392 6 O 0.2732 -3.0364 -0.8771 O.2 1 UNL1111111111 -0.3539 7 C -0.8614 0.7654 0.0792 C.3 1 UNL1111111111 -0.1101 8 C -1.8164 -0.2824 -0.5579 C.3 1 UNL1111111111 -0.2238 9 C 0.5681 0.5379 -0.5444 C.3 1 UNL1111111111 0.2704 10 C -3.3274 -0.0037 -0.4059 C.3 1 UNL1111111111 0.1187 11 C -1.3052 -1.5401 0.1910 C.3 1 UNL1111111111 0.3695 12 C -1.2983 2.2135 -0.0458 C.3 1 UNL1111111111 -0.2601 13 C -3.5887 1.4775 -0.7580 C.3 1 UNL1111111111 -0.2915 14 C 1.0582 -0.8706 -0.3051 C.2 1 UNL1111111111 -0.2280 15 C -2.8008 2.4079 0.1650 C.3 1 UNL1111111111 -0.2677 16 C -0.7809 0.2730 1.5217 C.2 1 UNL1111111111 0.5827 17 C 1.6017 1.5755 -0.0156 C.3 1 UNL1111111111 0.1026 18 C 0.0564 -1.9590 -0.4026 C.2 1 UNL1111111111 0.4216 19 C -3.8769 -0.2856 1.0011 C.3 1 UNL1111111111 -0.4613 20 C -4.0816 -0.8883 -1.4149 C.3 1 UNL1111111111 -0.4780 21 C 3.0192 1.1935 -0.4394 C.3 1 UNL1111111111 -0.3471 22 C 3.4276 -0.1712 0.1519 C.3 1 UNL1111111111 0.0588 23 C 2.3300 -1.1841 -0.0344 C.2 1 UNL1111111111 -0.0375 24 C 3.6750 -0.0614 1.6647 C.3 1 UNL1111111111 -0.4543 25 C 4.6501 -0.6346 -0.6027 C.2 1 UNL1111111111 -0.1490 26 C 5.9053 -0.3803 -0.2393 C.2 1 UNL1111111111 -0.3094 27 H -1.5982 -0.3675 -1.6528 H 1 UNL1111111111 0.1939 28 H -1.0228 2.6037 -1.0494 H 1 UNL1111111111 0.1585 29 H -0.7357 2.8436 0.6779 H 1 UNL1111111111 0.1658 30 H -4.6699 1.6949 -0.6914 H 1 UNL1111111111 0.1373 31 H -3.3101 1.6685 -1.8118 H 1 UNL1111111111 0.1434 32 H -3.0698 2.2321 1.2239 H 1 UNL1111111111 0.1460 33 H -3.0713 3.4622 -0.0347 H 1 UNL1111111111 0.1357 34 H 1.5071 1.7146 1.0851 H 1 UNL1111111111 0.1500 35 H 3.0667 1.1489 -1.5492 H 1 UNL1111111111 0.1717 36 H 3.7442 1.9691 -0.1352 H 1 UNL1111111111 0.1479 37 H -4.8833 0.1350 1.1182 H 1 UNL1111111111 0.1511 38 H -3.2538 0.1559 1.7882 H 1 UNL1111111111 0.1599 39 H -3.9655 -1.3584 1.2137 H 1 UNL1111111111 0.1342 40 H -5.1655 -0.7845 -1.3062 H 1 UNL1111111111 0.1461 41 H -3.8356 -1.9503 -1.2840 H 1 UNL1111111111 0.1648 42 H -3.8312 -0.6295 -2.4495 H 1 UNL1111111111 0.1489 43 H 2.6384 -2.2268 0.1045 H 1 UNL1111111111 0.1710 44 H 0.4566 1.5946 -2.2085 H 1 UNL1111111111 0.3384 45 H -2.8741 -2.4804 0.8944 H 1 UNL1111111111 0.3387 46 H 1.9631 3.4470 -0.5984 H 1 UNL1111111111 0.3302 47 H 4.3703 0.7497 1.9037 H 1 UNL1111111111 0.1501 48 H 2.7452 0.1321 2.2160 H 1 UNL1111111111 0.1627 49 H 4.1024 -0.9890 2.0660 H 1 UNL1111111111 0.1585 50 H 4.4248 -1.1889 -1.5166 H 1 UNL1111111111 0.1533 51 H 6.7629 -0.7066 -0.8098 H 1 UNL1111111111 0.1469 52 H 6.1854 0.1646 0.6483 H 1 UNL1111111111 0.1463 @BOND 1 1 11 1 2 1 16 1 3 2 9 1 4 2 44 1 5 3 11 1 6 3 45 1 7 4 17 1 8 4 46 1 9 5 16 2 10 6 18 2 11 7 8 1 12 7 9 1 13 7 12 1 14 7 16 1 15 8 10 1 16 8 11 1 17 8 27 1 18 9 14 1 19 9 17 1 20 10 13 1 21 10 19 1 22 10 20 1 23 11 18 1 24 12 15 1 25 12 28 1 26 12 29 1 27 13 15 1 28 13 30 1 29 13 31 1 30 14 18 1 31 14 23 2 32 15 32 1 33 15 33 1 34 17 21 1 35 17 34 1 36 19 37 1 37 19 38 1 38 19 39 1 39 20 40 1 40 20 41 1 41 20 42 1 42 21 22 1 43 21 35 1 44 21 36 1 45 22 23 1 46 22 24 1 47 22 25 1 48 23 43 1 49 24 47 1 50 24 48 1 51 24 49 1 52 25 26 2 53 25 50 1 54 26 51 1 55 26 52 1