@MOLECULE (8s,9s,10r,13s,14s,17s)-17-(2-hydroxy-3,7-octadiyn-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-3-ol 67 70 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.8568 -2.4515 0.3068 O.3 1 UNL1111111111 -0.5484 2 O 6.7132 -0.0160 -1.2019 O.3 1 UNL1111111111 -0.5628 3 C -0.7228 -0.6147 -0.1716 C.3 1 UNL1111111111 0.0933 4 C 0.0921 0.4921 -0.9067 C.3 1 UNL1111111111 -0.1425 5 C 1.3915 0.8385 -0.1836 C.3 1 UNL1111111111 -0.1148 6 C 2.2641 -0.4398 -0.1419 C.3 1 UNL1111111111 -0.1356 7 C -1.9899 -0.6401 -1.0775 C.3 1 UNL1111111111 -0.1945 8 C 0.1361 -1.8892 -0.1998 C.3 1 UNL1111111111 -0.2943 9 C 3.6143 -0.1668 0.5913 C.3 1 UNL1111111111 0.0618 10 C -0.9315 1.6142 -1.1186 C.3 1 UNL1111111111 -0.2797 11 C 1.4918 -1.6205 0.4815 C.3 1 UNL1111111111 -0.2732 12 C -2.2483 0.8551 -1.4153 C.3 1 UNL1111111111 -0.2717 13 C 2.1210 1.9481 -0.9607 C.3 1 UNL1111111111 -0.2837 14 C -1.0930 -0.2564 1.2667 C.3 1 UNL1111111111 -0.4619 15 C 4.2224 1.1325 0.1131 C.2 1 UNL1111111111 0.0096 16 C -3.2440 -1.3549 -0.5142 C.3 1 UNL1111111111 0.3498 17 C 4.5684 -1.3338 0.2365 C.3 1 UNL1111111111 -0.2763 18 C 3.5517 2.0678 -0.5689 C.2 1 UNL1111111111 -0.2170 19 C 3.4053 -0.0614 2.1119 C.3 1 UNL1111111111 -0.4531 20 C 5.6494 1.3870 0.5031 C.3 1 UNL1111111111 -0.3516 21 C 6.0056 -1.1175 0.7233 C.3 1 UNL1111111111 -0.2937 22 C 6.5720 0.2022 0.1918 C.3 1 UNL1111111111 0.1720 23 C -4.0993 -1.9082 -1.6742 C.3 1 UNL1111111111 -0.5006 24 C -4.0846 -0.5172 0.3136 C.1 1 UNL1111111111 -0.1164 25 C -4.7887 0.2132 0.9758 C.1 1 UNL1111111111 -0.0813 26 C -5.6155 1.0717 1.7702 C.3 1 UNL1111111111 -0.2193 27 C -6.5814 1.9005 0.8951 C.3 1 UNL1111111111 -0.2309 28 C -7.5126 1.0653 0.1919 C.1 1 UNL1111111111 -0.0552 29 C -8.2975 0.3733 -0.4171 C.1 1 UNL1111111111 -0.2316 30 H 0.3708 0.0956 -1.9198 H 1 UNL1111111111 0.1363 31 H 1.1869 1.1859 0.8514 H 1 UNL1111111111 0.1427 32 H 2.5157 -0.7076 -1.1973 H 1 UNL1111111111 0.1407 33 H -1.7135 -1.1634 -2.0242 H 1 UNL1111111111 0.1382 34 H 0.2984 -2.2275 -1.2428 H 1 UNL1111111111 0.1316 35 H -0.3729 -2.7219 0.3196 H 1 UNL1111111111 0.1387 36 H -0.6451 2.2893 -1.9380 H 1 UNL1111111111 0.1313 37 H -1.0218 2.2451 -0.2215 H 1 UNL1111111111 0.1383 38 H 1.3154 -1.4320 1.5574 H 1 UNL1111111111 0.1451 39 H 2.1093 -2.5362 0.4341 H 1 UNL1111111111 0.1325 40 H -3.0702 1.2790 -0.8172 H 1 UNL1111111111 0.1449 41 H -2.5469 0.9656 -2.4671 H 1 UNL1111111111 0.1312 42 H 1.6002 2.9150 -0.8067 H 1 UNL1111111111 0.1435 43 H 2.0617 1.7467 -2.0535 H 1 UNL1111111111 0.1494 44 H -1.7428 0.6236 1.3108 H 1 UNL1111111111 0.1466 45 H -1.6457 -1.0828 1.7420 H 1 UNL1111111111 0.1686 46 H -0.2149 -0.0480 1.8854 H 1 UNL1111111111 0.1421 47 H 4.5948 -1.4479 -0.8691 H 1 UNL1111111111 0.1579 48 H 4.1785 -2.2825 0.6398 H 1 UNL1111111111 0.1341 49 H 4.0284 2.9879 -0.8954 H 1 UNL1111111111 0.1404 50 H 3.0846 -1.0153 2.5425 H 1 UNL1111111111 0.1461 51 H 4.3307 0.2266 2.6269 H 1 UNL1111111111 0.1420 52 H 2.6455 0.6910 2.3509 H 1 UNL1111111111 0.1484 53 H 6.0420 2.3008 0.0165 H 1 UNL1111111111 0.1437 54 H 5.6924 1.6021 1.5934 H 1 UNL1111111111 0.1576 55 H 6.0569 -1.1430 1.8250 H 1 UNL1111111111 0.1390 56 H 6.6507 -1.9427 0.3590 H 1 UNL1111111111 0.1520 57 H 7.5943 0.3926 0.5944 H 1 UNL1111111111 0.1039 58 H -3.5355 -2.5943 -2.3055 H 1 UNL1111111111 0.1490 59 H -4.9648 -2.4556 -1.2761 H 1 UNL1111111111 0.1678 60 H -4.4829 -1.0947 -2.2999 H 1 UNL1111111111 0.1588 61 H -2.3126 -3.0805 -0.2037 H 1 UNL1111111111 0.3123 62 H 6.9331 0.8041 -1.6757 H 1 UNL1111111111 0.3109 63 H -6.2016 0.4750 2.5101 H 1 UNL1111111111 0.1688 64 H -4.9839 1.7597 2.3816 H 1 UNL1111111111 0.1599 65 H -5.9943 2.5205 0.1760 H 1 UNL1111111111 0.1659 66 H -7.1254 2.6319 1.5381 H 1 UNL1111111111 0.1587 67 H -8.9635 -0.2169 -0.9330 H 1 UNL1111111111 0.1845 @BOND 1 1 16 1 2 1 61 1 3 2 22 1 4 2 62 1 5 3 4 1 6 3 7 1 7 3 8 1 8 3 14 1 9 4 5 1 10 4 10 1 11 4 30 1 12 5 6 1 13 5 13 1 14 5 31 1 15 6 9 1 16 6 11 1 17 6 32 1 18 7 12 1 19 7 16 1 20 7 33 1 21 8 11 1 22 8 34 1 23 8 35 1 24 9 15 1 25 9 17 1 26 9 19 1 27 10 12 1 28 10 36 1 29 10 37 1 30 11 38 1 31 11 39 1 32 12 40 1 33 12 41 1 34 13 18 1 35 13 42 1 36 13 43 1 37 14 44 1 38 14 45 1 39 14 46 1 40 15 18 2 41 15 20 1 42 16 23 1 43 16 24 1 44 17 21 1 45 17 47 1 46 17 48 1 47 18 49 1 48 19 50 1 49 19 51 1 50 19 52 1 51 20 22 1 52 20 53 1 53 20 54 1 54 21 22 1 55 21 55 1 56 21 56 1 57 22 57 1 58 23 58 1 59 23 59 1 60 23 60 1 61 24 25 3 62 25 26 1 63 26 27 1 64 26 63 1 65 26 64 1 66 27 28 1 67 27 65 1 68 27 66 1 69 28 29 3 70 29 67 1