@MOLECULE (1r,4r,5s,8s)-8-(hydroxymethyl)-4-isopropyl-1,7-dimethylbicyclo[3.2.1]oct-6-ene-6-carbaldehyde 41 42 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.3762 -2.5927 1.8349 O.3 1 UNL1111111111 -0.5421 2 O 1.2367 -2.0000 -1.9577 O.2 1 UNL1111111111 -0.4461 3 C -1.6624 0.8759 0.2679 C.3 1 UNL1111111111 0.0492 4 C 0.2489 -0.5379 0.3711 C.3 1 UNL1111111111 -0.0952 5 C -1.0935 -0.2999 1.1268 C.3 1 UNL1111111111 -0.1921 6 C 1.2230 0.5879 0.8006 C.3 1 UNL1111111111 -0.1221 7 C -0.8535 2.1325 0.6664 C.3 1 UNL1111111111 -0.2858 8 C 0.6531 1.9679 0.3937 C.3 1 UNL1111111111 -0.2824 9 C -1.2430 0.4616 -1.1450 C.2 1 UNL1111111111 0.0896 10 C -0.1705 -0.3543 -1.0737 C.2 1 UNL1111111111 -0.2486 11 C 2.6275 0.3842 0.1834 C.3 1 UNL1111111111 -0.0723 12 C -3.1529 1.1084 0.4374 C.3 1 UNL1111111111 -0.4651 13 C -1.9842 -1.5448 1.1099 C.3 1 UNL1111111111 -0.0106 14 C -1.9598 0.9398 -2.3390 C.3 1 UNL1111111111 -0.4631 15 C 3.5885 1.4883 0.6460 C.3 1 UNL1111111111 -0.4539 16 C 3.2077 -0.9811 0.5741 C.3 1 UNL1111111111 -0.4578 17 C 0.5374 -1.0307 -2.1531 C.2 1 UNL1111111111 0.3517 18 H 0.6829 -1.5356 0.5660 H 1 UNL1111111111 0.1542 19 H -0.9232 0.0025 2.1784 H 1 UNL1111111111 0.1568 20 H 1.3187 0.5525 1.9111 H 1 UNL1111111111 0.1403 21 H -1.0217 2.3463 1.7381 H 1 UNL1111111111 0.1440 22 H -1.2304 3.0142 0.1181 H 1 UNL1111111111 0.1358 23 H 0.8473 2.1365 -0.6826 H 1 UNL1111111111 0.1407 24 H 1.2035 2.7640 0.9286 H 1 UNL1111111111 0.1377 25 H 2.5373 0.4257 -0.9287 H 1 UNL1111111111 0.1314 26 H -3.7445 0.2653 0.0615 H 1 UNL1111111111 0.1511 27 H -3.4147 1.2477 1.4942 H 1 UNL1111111111 0.1552 28 H -3.4871 2.0032 -0.1008 H 1 UNL1111111111 0.1484 29 H -2.2057 -1.8899 0.0848 H 1 UNL1111111111 0.1192 30 H -2.9294 -1.3841 1.6614 H 1 UNL1111111111 0.1398 31 H -2.1110 2.0312 -2.3062 H 1 UNL1111111111 0.1668 32 H -2.9622 0.4855 -2.4123 H 1 UNL1111111111 0.1704 33 H -1.4345 0.7145 -3.2778 H 1 UNL1111111111 0.1584 34 H 3.6426 1.5385 1.7385 H 1 UNL1111111111 0.1447 35 H 4.6034 1.3050 0.2752 H 1 UNL1111111111 0.1444 36 H 3.2861 2.4731 0.2781 H 1 UNL1111111111 0.1373 37 H 3.1437 -1.1572 1.6516 H 1 UNL1111111111 0.1425 38 H 4.2616 -1.0611 0.2862 H 1 UNL1111111111 0.1452 39 H 2.6822 -1.7988 0.0605 H 1 UNL1111111111 0.1621 40 H 0.4174 -0.6407 -3.1742 H 1 UNL1111111111 0.1054 41 H -0.5473 -2.8741 1.3938 H 1 UNL1111111111 0.3149 @BOND 1 1 13 1 2 1 41 1 3 2 17 2 4 3 5 1 5 3 7 1 6 3 9 1 7 3 12 1 8 4 5 1 9 4 6 1 10 4 10 1 11 4 18 1 12 5 13 1 13 5 19 1 14 6 8 1 15 6 11 1 16 6 20 1 17 7 8 1 18 7 21 1 19 7 22 1 20 8 23 1 21 8 24 1 22 9 10 2 23 9 14 1 24 10 17 1 25 11 15 1 26 11 16 1 27 11 25 1 28 12 26 1 29 12 27 1 30 12 28 1 31 13 29 1 32 13 30 1 33 14 31 1 34 14 32 1 35 14 33 1 36 15 34 1 37 15 35 1 38 15 36 1 39 16 37 1 40 16 38 1 41 16 39 1 42 17 40 1