@MOLECULE (8r,9s,10r,12r,13r,14r,17s)-17-[(2s)-4-hydroxy-5-(2-hydroxy-2-propanyl)-2-methyltetrahydro-2-furanyl]-4,4,10,14-tetramethylhexadecahydro-1h-cyclopenta[a]phenanthrene-3,12-diol 34 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.6742 1.0278 -2.5523 O.2 1 UNL1 -0.3529 2 O 0.6716 -0.7967 0.9149 O.2 1 UNL1 -0.5281 3 O -5.6817 -3.0629 0.5327 O.2 1 UNL1 -0.2887 4 O 5.0058 -1.0499 -2.1737 O.3 1 UNL1 -0.2313 5 O 5.5285 -3.7217 0.5225 O.2 2 UNL2 -0.1762 6 C -0.2375 2.5285 -0.1662 C.2 1 UNL1 -0.5678 7 C -1.4300 1.7605 -0.3946 C.2 1 UNL1 0.2647 8 C -1.3385 0.4500 -1.1106 C.3 1 UNL1 -0.2340 9 C 1.0496 1.8777 -0.4067 C.3 1 UNL1 -0.1255 10 C -2.4488 -0.3060 -1.3390 C.3 1 UNL1 0.0287 11 C -4.4719 0.3203 -0.1363 C.3 1 UNL1 -0.3737 12 C 2.1552 1.9999 0.3274 C.2 1 UNL1 0.0878 13 C -0.0346 -0.0915 -1.3060 C.3 1 UNL1 0.1314 14 C 0.9836 0.9309 -1.5718 C.2 1 UNL1 0.3259 15 C 2.0430 3.5480 2.4538 C.2 1 UNL1 0.5442 16 C -2.6541 1.9451 0.1130 C.2 1 UNL1 -0.2821 17 C -3.7740 1.3690 0.3044 C.3 1 UNL1 0.1645 18 C 2.5170 2.7411 1.5380 C.2 1 UNL1 -0.8333 19 C -5.3478 -0.6586 0.4596 C.3 1 UNL1 0.2614 20 C -2.7956 -1.6570 -1.0975 C.2 1 UNL1 -0.0125 21 C 3.5074 1.3783 0.2470 C.2 1 UNL1 -0.0322 22 C -0.2661 3.8082 0.2247 C.2 1 UNL1 0.5670 23 C -3.9162 0.1125 -1.5170 C.3 1 UNL1 0.3561 24 C -4.9793 -2.1633 0.1774 C.2 1 UNL1 0.4041 25 C -3.7413 -2.2192 -0.5441 C.2 1 UNL1 -0.1301 26 C 4.0684 0.5418 -0.5645 C.1 1 UNL1 -0.3888 27 C -6.3568 -0.4266 1.2620 C.1 1 UNL1 -0.6346 28 C -7.3584 -0.2143 2.0453 C.1 1 UNL1 0.4021 29 C 3.9121 2.1421 1.5222 C.3 1 UNL1 0.4365 30 C 4.5321 -0.2890 -1.4334 C.1 1 UNL1 0.5133 31 C 0.7318 -1.7542 0.2826 C.2 1 UNL1 0.5281 32 C 5.5009 -2.6425 1.4713 C.2 2 UNL2 -0.7519 33 C 4.5827 -2.8640 0.3282 C.3 2 UNL2 0.4796 34 C 5.9785 -2.0398 2.5014 C.2 2 UNL2 0.4482 @BOND 1 1 14 2 2 4 30 1 3 14 13 1 4 14 9 1 5 23 10 1 6 23 11 1 7 30 26 3 8 10 8 1 9 10 20 1 10 13 8 1 11 8 7 1 12 20 25 2 13 26 21 1 14 25 24 1 15 9 6 1 16 9 12 1 17 7 6 1 18 7 16 2 19 6 22 2 20 11 17 1 21 11 19 1 22 16 17 1 23 24 19 1 24 24 3 2 25 21 12 2 26 21 29 1 27 31 2 2 28 12 18 1 29 33 5 1 30 33 32 1 31 19 27 1 32 5 32 1 33 27 28 3 34 32 34 2 35 29 18 1 36 18 15 2