@MOLECULE (7r,8r,9s,10r,13s,14s,17r)-10,13-dimethyl-7-(methylsulfanyl)-1,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-3'h-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-3,5'(2h,4'h)-dione 59 63 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.5958 2.2887 0.7117 S.3 1 UNL1111111111 -0.0412 2 O 4.4102 -0.4452 -0.4262 O.3 1 UNL1111111111 -0.4162 3 O 6.5404 -0.8694 0.0373 O.2 1 UNL1111111111 -0.4503 4 O -5.8965 -0.8134 1.4519 O.2 1 UNL1111111111 -0.4635 5 C 1.9855 -0.4949 -0.3204 C.3 1 UNL1111111111 0.0411 6 C 0.9835 0.6928 -0.2181 C.3 1 UNL1111111111 -0.1438 7 C -0.3580 0.3257 -0.8517 C.3 1 UNL1111111111 -0.1324 8 C 3.2831 0.2003 0.1843 C.3 1 UNL1111111111 0.2468 9 C -0.9601 -0.8618 -0.0511 C.3 1 UNL1111111111 -0.1240 10 C 1.4185 -1.6477 0.5127 C.3 1 UNL1111111111 -0.2921 11 C 1.7519 1.8823 -0.8150 C.3 1 UNL1111111111 -0.2745 12 C -2.3413 -1.2831 -0.6362 C.3 1 UNL1111111111 0.0389 13 C 0.0302 -2.0447 -0.0206 C.3 1 UNL1111111111 -0.2737 14 C 3.2173 1.6352 -0.4031 C.3 1 UNL1111111111 -0.3222 15 C -1.3160 1.5251 -0.9550 C.3 1 UNL1111111111 -0.1536 16 C 2.2502 -0.9734 -1.7543 C.3 1 UNL1111111111 -0.4477 17 C 3.5577 0.1868 1.7045 C.3 1 UNL1111111111 -0.3268 18 C -3.1936 -0.0333 -0.7105 C.2 1 UNL1111111111 0.1016 19 C -2.6416 1.0636 -1.5705 C.3 1 UNL1111111111 -0.3177 20 C -3.0136 -2.3638 0.2490 C.3 1 UNL1111111111 -0.2790 21 C -2.2124 -1.8799 -2.0501 C.3 1 UNL1111111111 -0.4583 22 C 5.0652 -0.0557 1.8166 C.3 1 UNL1111111111 -0.3774 23 C 5.4728 -0.5026 0.4346 C.2 1 UNL1111111111 0.5988 24 C -3.7220 -1.7850 1.4712 C.3 1 UNL1111111111 -0.3836 25 C -4.3228 0.1482 -0.0147 C.2 1 UNL1111111111 -0.3498 26 C -4.7780 -0.8140 0.9981 C.2 1 UNL1111111111 0.4969 27 C -2.4644 3.8328 0.2851 C.3 1 UNL1111111111 -0.4812 28 H 0.8205 0.9012 0.8701 H 1 UNL1111111111 0.1528 29 H -0.1717 -0.0202 -1.9031 H 1 UNL1111111111 0.1523 30 H -1.1306 -0.5355 1.0044 H 1 UNL1111111111 0.1522 31 H 1.3325 -1.3627 1.5779 H 1 UNL1111111111 0.1377 32 H 2.0988 -2.5192 0.4797 H 1 UNL1111111111 0.1478 33 H 1.3809 2.8443 -0.4289 H 1 UNL1111111111 0.1446 34 H 1.6457 1.9217 -1.9109 H 1 UNL1111111111 0.1405 35 H 0.1351 -2.4811 -1.0319 H 1 UNL1111111111 0.1456 36 H -0.3761 -2.8547 0.6160 H 1 UNL1111111111 0.1378 37 H 3.8939 1.7096 -1.2750 H 1 UNL1111111111 0.1635 38 H 3.5675 2.3882 0.3166 H 1 UNL1111111111 0.1441 39 H -0.8531 2.3020 -1.6035 H 1 UNL1111111111 0.1509 40 H 2.6683 -0.1759 -2.3793 H 1 UNL1111111111 0.1547 41 H 2.9837 -1.7922 -1.7594 H 1 UNL1111111111 0.1634 42 H 1.3449 -1.3395 -2.2460 H 1 UNL1111111111 0.1427 43 H 2.9893 -0.6097 2.2150 H 1 UNL1111111111 0.1583 44 H 3.2415 1.1281 2.1830 H 1 UNL1111111111 0.1614 45 H -2.4777 0.7093 -2.6106 H 1 UNL1111111111 0.1611 46 H -3.3555 1.9054 -1.6779 H 1 UNL1111111111 0.1575 47 H -2.2682 -3.1163 0.5662 H 1 UNL1111111111 0.1459 48 H -3.7536 -2.9250 -0.3593 H 1 UNL1111111111 0.1511 49 H -1.5632 -1.2810 -2.6966 H 1 UNL1111111111 0.1477 50 H -1.7911 -2.8912 -2.0200 H 1 UNL1111111111 0.1514 51 H -3.1918 -1.9493 -2.5396 H 1 UNL1111111111 0.1540 52 H 5.3214 -0.8241 2.5690 H 1 UNL1111111111 0.1791 53 H 5.6226 0.8533 2.1111 H 1 UNL1111111111 0.1780 54 H -3.0128 -1.2580 2.1402 H 1 UNL1111111111 0.1707 55 H -4.1755 -2.5884 2.0852 H 1 UNL1111111111 0.1693 56 H -4.9415 1.0378 -0.1133 H 1 UNL1111111111 0.1773 57 H -3.4662 3.6429 -0.1133 H 1 UNL1111111111 0.1625 58 H -1.9063 4.4376 -0.4324 H 1 UNL1111111111 0.1561 59 H -2.5765 4.4174 1.2089 H 1 UNL1111111111 0.1729 @BOND 1 1 15 1 2 1 27 1 3 2 8 1 4 2 23 1 5 3 23 2 6 4 26 2 7 5 6 1 8 5 8 1 9 5 10 1 10 5 16 1 11 6 7 1 12 6 11 1 13 6 28 1 14 7 9 1 15 7 15 1 16 7 29 1 17 8 14 1 18 8 17 1 19 9 12 1 20 9 13 1 21 9 30 1 22 10 13 1 23 10 31 1 24 10 32 1 25 11 14 1 26 11 33 1 27 11 34 1 28 12 18 1 29 12 20 1 30 12 21 1 31 13 35 1 32 13 36 1 33 14 37 1 34 14 38 1 35 15 19 1 36 15 39 1 37 16 40 1 38 16 41 1 39 16 42 1 40 17 22 1 41 17 43 1 42 17 44 1 43 18 19 1 44 18 25 2 45 19 45 1 46 19 46 1 47 20 24 1 48 20 47 1 49 20 48 1 50 21 49 1 51 21 50 1 52 21 51 1 53 22 23 1 54 22 52 1 55 22 53 1 56 24 26 1 57 24 54 1 58 24 55 1 59 25 26 1 60 25 56 1 61 27 57 1 62 27 58 1 63 27 59 1