@MOLECULE (1s,3r,5s,6r,9r,12s,16r)-3-(3-furyl)-6,12,16-trimethyl-2,8,14,17-tetraoxapentacyclo[7.6.1.1~3,9~.0~1,12~.0~5,16~]heptadecane-7,13-dione 49 54 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0332 1.1945 -0.8414 O.3 1 UNL1111111111 -0.4479 2 O 0.8769 0.0278 0.9920 O.3 1 UNL1111111111 -0.4331 3 O 0.4055 -2.1453 1.4672 O.3 1 UNL1111111111 -0.4678 4 O -3.4080 0.7889 -1.3562 O.3 1 UNL1111111111 -0.4012 5 O -4.4311 1.0953 0.5944 O.2 1 UNL1111111111 -0.4333 6 O 1.8346 -3.7451 1.0750 O.2 1 UNL1111111111 -0.4341 7 O 3.5094 3.3550 -0.3953 O.2 1 UNL1111111111 -0.1740 8 C -0.8569 -0.9954 -0.3252 C.3 1 UNL1111111111 -0.1053 9 C -1.1645 0.4917 -0.6333 C.3 1 UNL1111111111 0.2134 10 C -0.1683 -0.9256 1.0527 C.3 1 UNL1111111111 0.4665 11 C 0.2181 -1.5586 -1.2950 C.3 1 UNL1111111111 -0.0977 12 C -1.9650 1.2525 0.4792 C.3 1 UNL1111111111 -0.0699 13 C 1.1675 0.5106 -0.3052 C.3 1 UNL1111111111 0.4874 14 C 1.4594 -0.6470 -1.2652 C.3 1 UNL1111111111 -0.3756 15 C -1.1113 -0.5313 2.1844 C.3 1 UNL1111111111 -0.3105 16 C -1.7102 0.8537 1.9348 C.3 1 UNL1111111111 -0.2609 17 C -2.0756 0.6762 -1.8673 C.3 1 UNL1111111111 -0.0770 18 C 0.5782 -2.9853 -0.8461 C.3 1 UNL1111111111 -0.2086 19 C -2.1084 -1.8579 -0.3107 C.3 1 UNL1111111111 -0.4523 20 C -3.3946 1.0465 0.0016 C.2 1 UNL1111111111 0.5632 21 C -1.7067 2.7634 0.3441 C.3 1 UNL1111111111 -0.4400 22 C 1.0367 -2.9888 0.5951 C.2 1 UNL1111111111 0.6048 23 C 2.2324 1.5195 -0.1523 C.ar 1 UNL1111111111 -0.1780 24 C 1.6392 -3.6276 -1.7350 C.3 1 UNL1111111111 -0.4353 25 C 3.2950 1.4618 0.8227 C.ar 1 UNL1111111111 -0.1890 26 C 2.4027 2.6821 -0.8567 C.ar 1 UNL1111111111 0.0231 27 C 4.0387 2.5914 0.6332 C.ar 1 UNL1111111111 -0.0267 28 H -0.1941 -1.5922 -2.3289 H 1 UNL1111111111 0.1532 29 H 2.3709 -1.1801 -0.9342 H 1 UNL1111111111 0.1765 30 H 1.6911 -0.2546 -2.2717 H 1 UNL1111111111 0.1696 31 H -0.5536 -0.5359 3.1470 H 1 UNL1111111111 0.1798 32 H -1.8982 -1.3025 2.3002 H 1 UNL1111111111 0.1669 33 H -2.6577 0.9534 2.5092 H 1 UNL1111111111 0.1653 34 H -1.0136 1.5995 2.3863 H 1 UNL1111111111 0.1673 35 H -1.8477 1.6003 -2.4256 H 1 UNL1111111111 0.1557 36 H -2.0995 -0.1815 -2.5541 H 1 UNL1111111111 0.1504 37 H -0.3446 -3.6274 -0.8947 H 1 UNL1111111111 0.1759 38 H -1.9492 -2.8026 0.2279 H 1 UNL1111111111 0.1627 39 H -2.9542 -1.3635 0.1898 H 1 UNL1111111111 0.1706 40 H -2.4513 -2.1046 -1.3236 H 1 UNL1111111111 0.1596 41 H -1.9286 3.1387 -0.6616 H 1 UNL1111111111 0.1556 42 H -2.3108 3.3374 1.0574 H 1 UNL1111111111 0.1584 43 H -0.6469 2.9935 0.5360 H 1 UNL1111111111 0.1763 44 H 1.3180 -3.6656 -2.7816 H 1 UNL1111111111 0.1491 45 H 2.5971 -3.0934 -1.6994 H 1 UNL1111111111 0.1577 46 H 1.8515 -4.6582 -1.4120 H 1 UNL1111111111 0.1663 47 H 3.4206 0.6746 1.5407 H 1 UNL1111111111 0.1884 48 H 1.8901 3.1727 -1.6519 H 1 UNL1111111111 0.1796 49 H 4.9072 3.0223 1.0718 H 1 UNL1111111111 0.1750 @BOND 1 1 9 1 2 1 13 1 3 2 10 1 4 2 13 1 5 3 10 1 6 3 22 1 7 4 17 1 8 4 20 1 9 5 20 2 10 6 22 2 11 7 26 ar 12 7 27 ar 13 8 9 1 14 8 10 1 15 8 11 1 16 8 19 1 17 9 12 1 18 9 17 1 19 10 15 1 20 11 14 1 21 11 18 1 22 11 28 1 23 12 16 1 24 12 20 1 25 12 21 1 26 13 14 1 27 13 23 1 28 14 29 1 29 14 30 1 30 15 16 1 31 15 31 1 32 15 32 1 33 16 33 1 34 16 34 1 35 17 35 1 36 17 36 1 37 18 22 1 38 18 24 1 39 18 37 1 40 19 38 1 41 19 39 1 42 19 40 1 43 21 41 1 44 21 42 1 45 21 43 1 46 23 25 ar 47 23 26 ar 48 24 44 1 49 24 45 1 50 24 46 1 51 25 27 ar 52 25 47 1 53 26 48 1 54 27 49 1