@MOLECULE (1s,4as,6s,8ar)-6-isopropyl-8a-methyl-4-methyleneoctahydro-1,4a(2h)-naphthalenediol 43 44 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.3527 0.5619 1.6283 O.3 1 UNL111111111 -0.5708 2 O 2.7759 -2.1904 -0.0049 O.3 1 UNL111111111 -0.5713 3 C 0.9264 -0.7434 -0.2451 C.3 1 UNL111111111 0.0392 4 C 0.3835 0.6441 0.2051 C.3 1 UNL111111111 0.2636 5 C -0.0553 -1.8320 0.2206 C.3 1 UNL111111111 -0.2784 6 C -1.0409 0.8965 -0.3056 C.3 1 UNL111111111 -0.3460 7 C -1.9940 -0.2043 0.1969 C.3 1 UNL111111111 -0.0989 8 C 2.2845 -0.9481 0.4758 C.3 1 UNL111111111 0.1435 9 C -1.4817 -1.5763 -0.2794 C.3 1 UNL111111111 -0.2790 10 C 1.3819 1.7300 -0.1496 C.2 1 UNL111111111 -0.0088 11 C 3.2959 0.1640 0.1530 C.3 1 UNL111111111 -0.3265 12 C 1.1155 -0.7940 -1.7630 C.3 1 UNL111111111 -0.4554 13 C 2.7109 1.5345 0.5181 C.3 1 UNL111111111 -0.2759 14 C -3.4346 0.0542 -0.3096 C.3 1 UNL111111111 -0.0784 15 C -4.3945 -1.0338 0.1925 C.3 1 UNL111111111 -0.4549 16 C -3.9502 1.4204 0.1657 C.3 1 UNL111111111 -0.4559 17 C 1.1317 2.7527 -0.9655 C.2 1 UNL111111111 -0.3679 18 H -0.0566 -1.8771 1.3285 H 1 UNL111111111 0.1518 19 H 0.3046 -2.8202 -0.1256 H 1 UNL111111111 0.1524 20 H -1.0466 0.9279 -1.4106 H 1 UNL111111111 0.1554 21 H -1.3872 1.8891 0.0351 H 1 UNL111111111 0.1433 22 H -1.9965 -0.1953 1.3131 H 1 UNL111111111 0.1453 23 H 2.1304 -1.0415 1.5750 H 1 UNL111111111 0.1321 24 H -1.5226 -1.6382 -1.3817 H 1 UNL111111111 0.1363 25 H -2.1419 -2.3807 0.0952 H 1 UNL111111111 0.1363 26 H 3.5586 0.1291 -0.9215 H 1 UNL111111111 0.1569 27 H 4.2389 -0.0065 0.7009 H 1 UNL111111111 0.1368 28 H 0.1590 -0.8029 -2.2947 H 1 UNL111111111 0.1448 29 H 1.6927 0.0595 -2.1341 H 1 UNL111111111 0.1468 30 H 1.6591 -1.7072 -2.0463 H 1 UNL111111111 0.1681 31 H 3.4255 2.3350 0.2474 H 1 UNL111111111 0.1431 32 H 2.5794 1.6044 1.6210 H 1 UNL111111111 0.1625 33 H -3.4281 0.0406 -1.4251 H 1 UNL111111111 0.1291 34 H -0.1097 1.3318 2.0070 H 1 UNL111111111 0.3152 35 H 3.6286 -2.4080 0.4129 H 1 UNL111111111 0.3105 36 H -4.3469 -1.1364 1.2818 H 1 UNL111111111 0.1456 37 H -5.4314 -0.7996 -0.0711 H 1 UNL111111111 0.1408 38 H -4.1654 -2.0107 -0.2455 H 1 UNL111111111 0.1427 39 H -3.8618 1.5243 1.2521 H 1 UNL111111111 0.1442 40 H -5.0070 1.5539 -0.0909 H 1 UNL111111111 0.1425 41 H -3.4027 2.2466 -0.2984 H 1 UNL111111111 0.1400 42 H 0.1908 2.9224 -1.4615 H 1 UNL111111111 0.1494 43 H 1.8617 3.5083 -1.2103 H 1 UNL111111111 0.1497 @BOND 1 1 4 1 2 1 34 1 3 2 8 1 4 2 35 1 5 3 4 1 6 3 5 1 7 3 8 1 8 3 12 1 9 4 6 1 10 4 10 1 11 5 9 1 12 5 18 1 13 5 19 1 14 6 7 1 15 6 20 1 16 6 21 1 17 7 9 1 18 7 14 1 19 7 22 1 20 8 11 1 21 8 23 1 22 9 24 1 23 9 25 1 24 10 13 1 25 10 17 2 26 11 13 1 27 11 26 1 28 11 27 1 29 12 28 1 30 12 29 1 31 12 30 1 32 13 31 1 33 13 32 1 34 14 15 1 35 14 16 1 36 14 33 1 37 15 36 1 38 15 37 1 39 15 38 1 40 16 39 1 41 16 40 1 42 16 41 1 43 17 42 1 44 17 43 1