@MOLECULE methyl (2e)-8,9-dihydroxy-2,4,6,8-tetramethyl-2-decenoate 47 46 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.3671 -1.5850 0.9536 O.3 1 UNL1111111111 -0.5770 2 O 4.0453 -1.7416 -1.1477 O.3 1 UNL1111111111 -0.5845 3 O -4.0016 -1.4823 0.3158 O.3 1 UNL1111111111 -0.4131 4 O -5.4970 0.1477 -0.0588 O.2 1 UNL1111111111 -0.5061 5 C 1.4694 1.3585 0.4259 C.3 1 UNL1111111111 -0.0710 6 C 2.5870 0.7273 1.2786 C.3 1 UNL1111111111 -0.3326 7 C 3.2684 -0.5215 0.6918 C.3 1 UNL1111111111 0.3090 8 C 0.2508 0.4259 0.3487 C.3 1 UNL1111111111 -0.2980 9 C 3.4813 -0.4693 -0.8478 C.3 1 UNL1111111111 0.1072 10 C -0.7026 0.8001 -0.8039 C.3 1 UNL1111111111 -0.0979 11 C 1.0777 2.7062 1.0521 C.3 1 UNL1111111111 -0.4577 12 C 4.5800 -0.8183 1.4273 C.3 1 UNL1111111111 -0.5012 13 C 4.4194 0.6409 -1.3015 C.3 1 UNL1111111111 -0.5037 14 C -0.1256 0.4060 -2.1706 C.3 1 UNL1111111111 -0.4478 15 C -1.9878 0.0600 -0.5859 C.2 1 UNL1111111111 -0.0870 16 C -3.1332 0.6245 -0.1793 C.2 1 UNL1111111111 -0.1283 17 C -3.3275 2.0716 0.1090 C.3 1 UNL1111111111 -0.4312 18 C -4.3450 -0.1980 0.0152 C.2 1 UNL1111111111 0.5951 19 C -5.0814 -2.3848 0.5243 C.3 1 UNL1111111111 -0.1694 20 H 1.8523 1.5507 -0.6034 H 1 UNL1111111111 0.1275 21 H 3.3587 1.4906 1.4915 H 1 UNL1111111111 0.1441 22 H 2.1645 0.4398 2.2666 H 1 UNL1111111111 0.1690 23 H 0.5815 -0.6275 0.2314 H 1 UNL1111111111 0.1761 24 H -0.2940 0.4428 1.3121 H 1 UNL1111111111 0.1493 25 H 2.4963 -0.4248 -1.3672 H 1 UNL1111111111 0.1328 26 H -0.8712 1.9048 -0.7934 H 1 UNL1111111111 0.1441 27 H 0.7112 2.5805 2.0767 H 1 UNL1111111111 0.1481 28 H 0.2829 3.1943 0.4782 H 1 UNL1111111111 0.1433 29 H 1.9277 3.3949 1.0852 H 1 UNL1111111111 0.1382 30 H 5.0798 -1.6962 0.9952 H 1 UNL1111111111 0.1690 31 H 5.2807 0.0182 1.3756 H 1 UNL1111111111 0.1477 32 H 4.3861 -1.0403 2.4836 H 1 UNL1111111111 0.1595 33 H 4.4442 0.7301 -2.3927 H 1 UNL1111111111 0.1483 34 H 4.1189 1.6154 -0.8986 H 1 UNL1111111111 0.1615 35 H 5.4468 0.4501 -0.9631 H 1 UNL1111111111 0.1654 36 H 0.1604 -0.6518 -2.1982 H 1 UNL1111111111 0.1498 37 H 0.7629 0.9979 -2.4119 H 1 UNL1111111111 0.1397 38 H -0.8571 0.5720 -2.9700 H 1 UNL1111111111 0.1479 39 H 2.6933 -2.4126 0.5400 H 1 UNL1111111111 0.3341 40 H -1.9227 -1.0171 -0.7712 H 1 UNL1111111111 0.1657 41 H 4.3249 -1.7855 -2.0790 H 1 UNL1111111111 0.3220 42 H -2.9081 2.7086 -0.6829 H 1 UNL1111111111 0.1559 43 H -4.3931 2.3415 0.1944 H 1 UNL1111111111 0.1745 44 H -2.8465 2.3577 1.0564 H 1 UNL1111111111 0.1590 45 H -4.5728 -3.3329 0.7325 H 1 UNL1111111111 0.1452 46 H -5.7024 -2.4499 -0.3750 H 1 UNL1111111111 0.1386 47 H -5.6846 -2.0584 1.3783 H 1 UNL1111111111 0.1393 @BOND 1 1 7 1 2 1 39 1 3 2 9 1 4 2 41 1 5 3 18 1 6 3 19 1 7 4 18 2 8 5 6 1 9 5 8 1 10 5 11 1 11 5 20 1 12 6 7 1 13 6 21 1 14 6 22 1 15 7 9 1 16 7 12 1 17 8 10 1 18 8 23 1 19 8 24 1 20 9 13 1 21 9 25 1 22 10 14 1 23 10 15 1 24 10 26 1 25 11 27 1 26 11 28 1 27 11 29 1 28 12 30 1 29 12 31 1 30 12 32 1 31 13 33 1 32 13 34 1 33 13 35 1 34 14 36 1 35 14 37 1 36 14 38 1 37 15 16 2 38 15 40 1 39 16 17 1 40 16 18 1 41 17 42 1 42 17 43 1 43 17 44 1 44 19 45 1 45 19 46 1 46 19 47 1