@MOLECULE 1-[(3as,4as,4bs,6s,10as,11s,12as,12bs)-6,10b-difluoro-11-hydroxy-2,2,10a,12a-tetramethyl-8,10-disulfanyl-3a,4,4a,4b,5,6,7a,8,9,10a,10b,11,12,12a-tetradecahydro-12bh-cyclobuta[6',7']naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-12b-yl]-2-hydroxyethanone 35 41 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -3.9818 2.2813 -1.0912 O.2 1 UNL1 -0.3842 2 C -3.0564 2.0698 -0.3369 C.2 1 UNL1 0.2971 3 C -5.7963 0.9774 -2.1210 C.2 1 UNL1 0.5109 4 O -6.1196 0.3943 -1.1900 O.2 1 UNL1 -0.5169 5 C -3.5281 -0.4918 0.5914 C.3 1 UNL1 -0.0046 6 O -4.3440 -0.4958 1.7186 O.2 1 UNL1 -0.1635 7 C -5.6076 -1.0070 1.3985 C.2 1 UNL1 -0.6013 8 O -4.5980 -2.6724 0.0650 O.2 1 UNL1 -0.1984 9 C -3.5001 -1.9056 -0.0136 C.2 1 UNL1 0.1967 10 C -2.2129 -2.1832 -0.3112 C.2 1 UNL1 -0.0633 11 C -1.2280 -1.3198 0.0647 C.3 1 UNL1 0.0381 12 C -2.0052 -0.2103 0.6172 C.3 1 UNL1 0.0235 13 C -2.8293 0.7624 0.2184 C.3 1 UNL1 -0.2116 14 C -2.1695 3.2365 0.0689 C.3 1 UNL1 0.3192 15 C -0.0993 2.2046 -0.4175 C.3 1 UNL1 0.2377 16 O -0.9178 3.2618 -0.0477 O.3 1 UNL1 -0.1995 17 C 1.3271 -0.4921 -0.1861 C.2 1 UNL1 0.0241 18 C 0.1502 -1.2959 -0.1737 C.2 1 UNL1 0.0811 19 C 1.3432 -1.9284 -0.3443 C.2 1 UNL1 0.0005 20 C 2.3074 -2.9351 -0.5029 C.2 1 UNL1 0.1672 21 C 3.5624 -2.4834 -0.4379 C.1 1 UNL1 -0.0508 22 C 4.4720 -1.6287 -0.2711 C.1 1 UNL1 -0.0482 23 C 5.1085 -0.5043 -0.0138 C.2 1 UNL1 0.0812 24 C 4.4694 0.7871 0.2570 C.2 1 UNL1 -0.3881 25 C 3.2059 1.2220 0.2397 C.3 1 UNL1 0.1243 26 C 1.8920 0.7140 -0.0658 C.3 1 UNL1 -0.1411 27 C 1.1209 1.9610 0.0362 C.3 1 UNL1 -0.1985 28 S 2.5297 2.8538 0.6891 S.3 1 UNL1 0.2051 29 C 5.7959 1.4226 0.5576 C.3 1 UNL1 0.3733 30 C 6.4499 0.0537 0.2171 C.2 1 UNL1 -0.3216 31 S 7.9067 -0.4806 0.1430 S.2 1 UNL1 0.1176 32 F 1.9528 -4.1902 -0.6825 F 1 UNL1 -0.0997 33 F -0.7186 1.3880 -1.2462 F 1 UNL1 -0.1596 34 C -5.6887 -2.2446 0.6519 C.2 1 UNL1 0.3570 35 C -6.7031 -0.3720 1.8335 C.3 1 UNL1 0.5962 @BOND 1 3 4 2 2 33 15 1 3 1 2 2 4 32 20 1 5 20 21 1 6 20 19 2 7 21 22 3 8 15 16 1 9 15 27 1 10 19 17 1 11 19 18 1 12 2 14 1 13 2 13 1 14 10 9 2 15 10 11 1 16 22 23 1 17 17 18 2 18 17 26 1 19 18 11 1 20 26 27 1 21 26 25 1 22 16 14 1 23 23 30 1 24 23 24 2 25 9 8 1 26 9 5 1 27 27 28 1 28 11 12 1 29 8 34 1 30 31 30 2 31 30 29 1 32 13 5 1 33 13 12 1 34 25 24 1 35 25 28 1 36 24 29 1 37 5 12 1 38 5 6 1 39 34 7 2 40 7 6 1 41 7 35 1