@MOLECULE (4r,6s)-4-hydroxy-6-{2-[(1s,2s,8s,8ar)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydro-1-naphthalenyl]ethyl}tetrahydro-2h-pyran-2-one 48 50 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.7791 1.5274 -0.1115 O.3 1 UNL1111111111 -0.5592 2 C -3.6987 -1.5318 -0.3697 C.2 1 UNL1111111111 0.6135 3 O -3.6977 -2.7043 -0.6519 O.2 1 UNL1111111111 -0.4663 4 O -2.4778 -0.9585 -0.2519 O.3 1 UNL1111111111 -0.4186 5 O 1.5367 -1.6146 1.8187 O.3 1 UNL1111111111 -0.5714 6 C -2.3100 0.3681 0.2544 C.3 1 UNL1111111111 0.1424 7 C -3.4617 1.2772 -0.1583 C.3 1 UNL1111111111 -0.3761 8 C -4.7611 0.6687 0.3676 C.3 1 UNL1111111111 0.1814 9 C -4.9609 -0.7333 -0.2135 C.3 1 UNL1111111111 -0.4608 10 C 1.4243 2.9056 0.9961 C.3 1 UNL1111111111 -0.4411 11 C -0.9756 0.8241 -0.3456 C.3 1 UNL1111111111 -0.3056 12 C 0.1982 0.2462 0.4532 C.3 1 UNL1111111111 -0.2785 13 C 1.5493 0.6086 -0.1685 C.3 1 UNL1111111111 -0.0980 14 C 1.7567 2.1481 -0.2987 C.3 1 UNL1111111111 -0.1097 15 C 3.1694 2.4970 -0.6813 C.2 1 UNL1111111111 -0.1464 16 C 4.1800 1.6178 -0.6658 C.2 1 UNL1111111111 -0.1929 17 C 3.9279 0.2188 -0.3296 C.2 1 UNL1111111111 -0.0167 18 C 2.7622 0.0361 0.6123 C.3 1 UNL1111111111 -0.1589 19 C 2.7227 -1.4331 1.0702 C.3 1 UNL1111111111 0.1564 20 C 2.8156 -2.3931 -0.1195 C.3 1 UNL1111111111 -0.3311 21 C 4.2089 -2.2297 -0.7446 C.3 1 UNL1111111111 -0.2591 22 C 4.5727 -0.7916 -0.9289 C.2 1 UNL1111111111 -0.1915 23 H -6.6531 1.2683 0.2361 H 1 UNL1111111111 0.3175 24 H 1.3436 -2.5623 1.9441 H 1 UNL1111111111 0.3174 25 H -2.2510 0.2532 1.3619 H 1 UNL1111111111 0.1344 26 H -3.3278 2.3035 0.2328 H 1 UNL1111111111 0.1707 27 H -3.5137 1.3928 -1.2600 H 1 UNL1111111111 0.1776 28 H -4.7984 0.6649 1.4797 H 1 UNL1111111111 0.1184 29 H -5.6887 -1.3175 0.3870 H 1 UNL1111111111 0.1810 30 H -5.4339 -0.6460 -1.2225 H 1 UNL1111111111 0.2019 31 H 1.7038 3.9619 0.9239 H 1 UNL1111111111 0.1408 32 H 0.3546 2.8609 1.2264 H 1 UNL1111111111 0.1461 33 H 1.9602 2.4829 1.8545 H 1 UNL1111111111 0.1505 34 H -0.9309 1.9281 -0.3692 H 1 UNL1111111111 0.1473 35 H -0.9112 0.4888 -1.4017 H 1 UNL1111111111 0.1627 36 H 0.0920 -0.8625 0.4798 H 1 UNL1111111111 0.1776 37 H 0.1627 0.5618 1.5113 H 1 UNL1111111111 0.1494 38 H 1.5732 0.1793 -1.2023 H 1 UNL1111111111 0.1405 39 H 1.0747 2.5102 -1.1094 H 1 UNL1111111111 0.1395 40 H 3.3197 3.5371 -0.9621 H 1 UNL1111111111 0.1414 41 H 5.1984 1.8911 -0.9285 H 1 UNL1111111111 0.1519 42 H 2.9051 0.6574 1.5329 H 1 UNL1111111111 0.1594 43 H 3.5643 -1.6166 1.7839 H 1 UNL1111111111 0.1177 44 H 2.0248 -2.1617 -0.8588 H 1 UNL1111111111 0.1615 45 H 2.6450 -3.4371 0.1924 H 1 UNL1111111111 0.1404 46 H 4.2440 -2.7565 -1.7202 H 1 UNL1111111111 0.1480 47 H 4.9728 -2.7281 -0.1107 H 1 UNL1111111111 0.1472 48 H 5.3972 -0.6113 -1.6159 H 1 UNL1111111111 0.1474 @BOND 1 1 8 1 2 1 23 1 3 2 3 2 4 2 4 1 5 2 9 1 6 4 6 1 7 5 19 1 8 5 24 1 9 6 7 1 10 6 11 1 11 6 25 1 12 7 8 1 13 7 26 1 14 7 27 1 15 8 9 1 16 8 28 1 17 9 29 1 18 9 30 1 19 10 14 1 20 10 31 1 21 10 32 1 22 10 33 1 23 11 12 1 24 11 34 1 25 11 35 1 26 12 13 1 27 12 36 1 28 12 37 1 29 13 14 1 30 13 18 1 31 13 38 1 32 14 15 1 33 14 39 1 34 15 16 2 35 15 40 1 36 16 17 1 37 16 41 1 38 17 18 1 39 17 22 2 40 18 19 1 41 18 42 1 42 19 20 1 43 19 43 1 44 20 21 1 45 20 44 1 46 20 45 1 47 21 22 1 48 21 46 1 49 21 47 1 50 22 48 1