@MOLECULE (2e,4e)-5-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-3-methyl-2,4-pentadienal 40 41 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.0900 0.6559 1.4852 O.3 1 UNL1111111111 -0.3876 2 O 3.9043 -0.3006 -1.3511 O.3 1 UNL1111111111 -0.5625 3 O -6.0783 -1.0176 0.2373 O.2 1 UNL1111111111 -0.4420 4 C 0.9010 0.0780 0.1859 C.3 1 UNL1111111111 0.1075 5 C 1.7588 1.2950 0.3893 C.3 1 UNL1111111111 0.1940 6 C 1.5086 -1.3103 0.0060 C.3 1 UNL1111111111 0.1062 7 C 3.2635 1.2055 0.4526 C.3 1 UNL1111111111 -0.3682 8 C 2.9541 -1.3324 0.5441 C.3 1 UNL1111111111 -0.3174 9 C 3.8215 -0.1694 0.0580 C.3 1 UNL1111111111 0.1710 10 C 1.2271 2.6582 0.0366 C.3 1 UNL1111111111 -0.4757 11 C -0.4588 0.2401 -0.3751 C.2 1 UNL1111111111 -0.1528 12 C 1.4776 -1.7017 -1.4764 C.3 1 UNL1111111111 -0.4578 13 C 0.6723 -2.3117 0.8220 C.3 1 UNL1111111111 -0.4642 14 C -1.5299 0.4207 0.4035 C.2 1 UNL1111111111 -0.1876 15 C -2.8899 0.5486 -0.1280 C.2 1 UNL1111111111 0.1354 16 C -3.1131 1.6490 -1.1101 C.3 1 UNL1111111111 -0.4713 17 C -3.8513 -0.2944 0.2834 C.2 1 UNL1111111111 -0.3685 18 C -5.2419 -0.2524 -0.1857 C.2 1 UNL1111111111 0.3491 19 H 3.5791 1.4420 1.4932 H 1 UNL1111111111 0.1705 20 H 3.7220 1.9867 -0.1849 H 1 UNL1111111111 0.1536 21 H 3.4333 -2.2885 0.2547 H 1 UNL1111111111 0.1575 22 H 2.9317 -1.3108 1.6534 H 1 UNL1111111111 0.1587 23 H 4.8646 -0.2806 0.4441 H 1 UNL1111111111 0.1115 24 H 0.1509 2.7392 0.2517 H 1 UNL1111111111 0.1687 25 H 1.7219 3.4474 0.6175 H 1 UNL1111111111 0.1604 26 H 1.3701 2.8756 -1.0290 H 1 UNL1111111111 0.1575 27 H -0.5160 0.1852 -1.4622 H 1 UNL1111111111 0.1615 28 H 0.4615 -1.9033 -1.8272 H 1 UNL1111111111 0.1406 29 H 1.9084 -0.9109 -2.1055 H 1 UNL1111111111 0.1671 30 H 2.0761 -2.6014 -1.6596 H 1 UNL1111111111 0.1541 31 H -0.3571 -2.3697 0.4503 H 1 UNL1111111111 0.1534 32 H 1.0989 -3.3182 0.7723 H 1 UNL1111111111 0.1490 33 H 0.6201 -2.0157 1.8770 H 1 UNL1111111111 0.1557 34 H 4.3227 0.4812 -1.7533 H 1 UNL1111111111 0.3082 35 H -1.4416 0.4671 1.4946 H 1 UNL1111111111 0.1819 36 H -2.2023 2.2344 -1.3034 H 1 UNL1111111111 0.1635 37 H -3.8719 2.3614 -0.7522 H 1 UNL1111111111 0.1668 38 H -3.4554 1.2640 -2.0821 H 1 UNL1111111111 0.1657 39 H -3.6433 -1.0826 1.0111 H 1 UNL1111111111 0.1859 40 H -5.5207 0.4963 -0.9394 H 1 UNL1111111111 0.1006 @BOND 1 1 4 1 2 1 5 1 3 2 9 1 4 2 34 1 5 3 18 2 6 4 5 1 7 4 6 1 8 4 11 1 9 5 7 1 10 5 10 1 11 6 8 1 12 6 12 1 13 6 13 1 14 7 9 1 15 7 19 1 16 7 20 1 17 8 9 1 18 8 21 1 19 8 22 1 20 9 23 1 21 10 24 1 22 10 25 1 23 10 26 1 24 11 14 2 25 11 27 1 26 12 28 1 27 12 29 1 28 12 30 1 29 13 31 1 30 13 32 1 31 13 33 1 32 14 15 1 33 14 35 1 34 15 16 1 35 15 17 2 36 16 36 1 37 16 37 1 38 16 38 1 39 17 18 1 40 17 39 1 41 18 40 1