@MOLECULE (1ar,2r,7as,9ar)-5-(hydroxymethyl)-2,9,9-trimethyl-3,4,9,9a-tetrahydro-8h-oxireno[1,7a]indeno[3a,4-b]furan-6(2h)-one 39 42 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2138 1.2328 0.6896 O.3 1 UNL1111111111 -0.0978 2 O 0.3023 -0.9781 -0.8650 O.3 1 UNL1111111111 -0.3454 3 O 2.2809 -1.9756 -1.1976 O.2 1 UNL1111111111 -0.1888 4 O 4.2457 -1.0465 0.7916 O.3 1 UNL1111111111 -0.3241 5 C -1.2243 0.9071 -0.3071 C.3 1 UNL1111111111 -0.1293 6 C -2.5913 0.3027 -0.3263 C.3 1 UNL1111111111 -0.5056 7 C -0.2579 -0.1680 0.1955 C.3 1 UNL1111111111 0.8595 8 C -2.5131 -1.1254 0.2490 C.3 1 UNL1111111111 0.9206 9 C -1.1347 -1.1457 0.9909 C.3 1 UNL1111111111 -1.0845 10 C -0.6188 2.1424 -0.9051 C.3 1 UNL1111111111 0.1891 11 C 0.9530 0.5182 0.7964 C.2 1 UNL1111111111 -0.2915 12 C 0.3465 2.7789 0.1443 C.3 1 UNL1111111111 -0.5439 13 C 0.7174 1.8632 1.3475 C.3 1 UNL1111111111 -0.2753 14 C -2.5427 -2.1417 -0.8875 C.3 1 UNL1111111111 -1.0999 15 C -3.6582 -1.3587 1.2281 C.3 1 UNL1111111111 -1.0129 16 C 0.0967 1.8209 -2.2158 C.3 1 UNL1111111111 -0.9728 17 C 2.0664 -0.1141 0.3880 C.2 1 UNL1111111111 0.1393 18 C 1.6566 -1.1439 -0.6044 C.2 1 UNL1111111111 0.0946 19 C 3.4953 0.1426 0.6857 C.3 1 UNL1111111111 -0.5863 20 H -3.4058 0.5816 -0.9770 H 1 UNL1111111111 0.2663 21 H -0.7027 -2.1594 1.0104 H 1 UNL1111111111 0.3337 22 H -1.2434 -0.8171 2.0373 H 1 UNL1111111111 0.3073 23 H -1.4346 2.8814 -1.1151 H 1 UNL1111111111 0.1239 24 H -0.1186 3.6991 0.5439 H 1 UNL1111111111 0.1891 25 H 1.2743 3.0988 -0.3640 H 1 UNL1111111111 0.2317 26 H -0.1155 1.8610 2.0853 H 1 UNL1111111111 0.2075 27 H 1.5957 2.2750 1.8821 H 1 UNL1111111111 0.1863 28 H -1.6994 -1.9955 -1.5798 H 1 UNL1111111111 0.3101 29 H -3.4654 -2.0713 -1.4724 H 1 UNL1111111111 0.2729 30 H -2.4683 -3.1682 -0.5091 H 1 UNL1111111111 0.3022 31 H -3.5517 -2.3186 1.7468 H 1 UNL1111111111 0.2907 32 H -4.6281 -1.3676 0.7179 H 1 UNL1111111111 0.2584 33 H -3.6997 -0.5699 1.9911 H 1 UNL1111111111 0.2798 34 H 0.9441 1.1407 -2.0635 H 1 UNL1111111111 0.3176 35 H 0.4778 2.7265 -2.6996 H 1 UNL1111111111 0.2430 36 H -0.5797 1.3259 -2.9248 H 1 UNL1111111111 0.2715 37 H 3.6431 0.6187 1.6785 H 1 UNL1111111111 0.3232 38 H 3.9636 0.7806 -0.0952 H 1 UNL1111111111 0.2302 39 H 4.0289 -1.6599 0.0510 H 1 UNL1111111111 0.3100 @BOND 1 1 5 1 2 1 6 1 3 2 7 1 4 2 18 1 5 3 18 2 6 4 19 1 7 4 39 1 8 5 6 1 9 5 7 1 10 5 10 1 11 6 8 1 12 6 20 1 13 7 9 1 14 7 11 1 15 8 9 1 16 8 14 1 17 8 15 1 18 9 21 1 19 9 22 1 20 10 12 1 21 10 16 1 22 10 23 1 23 11 13 1 24 11 17 2 25 12 13 1 26 12 24 1 27 12 25 1 28 13 26 1 29 13 27 1 30 14 28 1 31 14 29 1 32 14 30 1 33 15 31 1 34 15 32 1 35 15 33 1 36 16 34 1 37 16 35 1 38 16 36 1 39 17 18 1 40 17 19 1 41 19 37 1 42 19 38 1