@MOLECULE (5beta,9beta,10alpha)-kaurane-16,17-diol 56 59 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.2582 -0.7288 1.4212 O.3 1 UNL1111111111 -0.5695 2 O 5.3845 0.6175 0.2993 O.3 1 UNL1111111111 -0.5419 3 C 0.8160 0.6011 -0.6738 C.3 1 UNL1111111111 0.0867 4 C 0.0356 -0.7384 -0.6085 C.3 1 UNL1111111111 -0.1510 5 C -1.3228 -0.6972 0.1667 C.3 1 UNL1111111111 0.0746 6 C -2.1444 0.5027 -0.3805 C.3 1 UNL1111111111 -0.1455 7 C 1.9497 0.3950 -1.7217 C.3 1 UNL1111111111 -0.3166 8 C 2.9315 -0.4875 -0.9309 C.3 1 UNL1111111111 -0.1200 9 C 1.6095 0.9124 0.6239 C.3 1 UNL1111111111 -0.3631 10 C -0.0927 1.7558 -1.0966 C.3 1 UNL1111111111 -0.3046 11 C 2.9904 0.2465 0.4345 C.3 1 UNL1111111111 0.2452 12 C 0.9578 -1.8612 -0.0905 C.3 1 UNL1111111111 -0.2740 13 C -1.3549 1.8124 -0.2335 C.3 1 UNL1111111111 -0.2760 14 C 2.3235 -1.8910 -0.7992 C.3 1 UNL1111111111 -0.2589 15 C -3.5844 0.6309 0.1969 C.3 1 UNL1111111111 0.1061 16 C -2.0764 -2.0229 -0.1577 C.3 1 UNL1111111111 -0.3008 17 C -1.1293 -0.6105 1.6855 C.3 1 UNL1111111111 -0.4632 18 C -4.1566 -0.7671 0.5278 C.3 1 UNL1111111111 -0.2936 19 C -3.5783 -1.8318 -0.4036 C.3 1 UNL1111111111 -0.2606 20 C 4.1460 1.2661 0.4914 C.3 1 UNL1111111111 -0.0710 21 C -3.6636 1.5044 1.4602 C.3 1 UNL1111111111 -0.4697 22 C -4.4752 1.2865 -0.8823 C.3 1 UNL1111111111 -0.4708 23 H -0.2304 -0.9842 -1.6705 H 1 UNL1111111111 0.1347 24 H -2.2640 0.3083 -1.4799 H 1 UNL1111111111 0.1397 25 H 2.4042 1.3504 -2.0208 H 1 UNL1111111111 0.1368 26 H 1.5968 -0.0847 -2.6434 H 1 UNL1111111111 0.1436 27 H 3.9335 -0.5423 -1.4002 H 1 UNL1111111111 0.1505 28 H 1.6927 1.9974 0.7811 H 1 UNL1111111111 0.1422 29 H 1.0993 0.5100 1.5121 H 1 UNL1111111111 0.1606 30 H -0.3753 1.6358 -2.1608 H 1 UNL1111111111 0.1410 31 H 0.4501 2.7167 -1.0405 H 1 UNL1111111111 0.1380 32 H 0.4626 -2.8412 -0.2073 H 1 UNL1111111111 0.1288 33 H 1.1309 -1.7381 0.9971 H 1 UNL1111111111 0.1529 34 H -1.0867 1.9924 0.8230 H 1 UNL1111111111 0.1410 35 H -1.9801 2.6708 -0.5408 H 1 UNL1111111111 0.1340 36 H 3.0131 -2.5435 -0.2282 H 1 UNL1111111111 0.1470 37 H 2.2239 -2.3433 -1.8021 H 1 UNL1111111111 0.1295 38 H -1.9248 -2.7397 0.6698 H 1 UNL1111111111 0.1397 39 H -1.6355 -2.5089 -1.0481 H 1 UNL1111111111 0.1352 40 H -0.4565 -1.3919 2.0553 H 1 UNL1111111111 0.1448 41 H -0.7169 0.3580 1.9860 H 1 UNL1111111111 0.1429 42 H -2.0827 -0.7379 2.2120 H 1 UNL1111111111 0.1503 43 H -5.2587 -0.7514 0.4578 H 1 UNL1111111111 0.1325 44 H -3.9340 -1.0353 1.5778 H 1 UNL1111111111 0.1403 45 H -3.7601 -1.5490 -1.4578 H 1 UNL1111111111 0.1338 46 H -4.1055 -2.7929 -0.2575 H 1 UNL1111111111 0.1292 47 H 4.1856 1.7939 1.4596 H 1 UNL1111111111 0.1188 48 H 4.0970 2.0014 -0.3308 H 1 UNL1111111111 0.1464 49 H -2.9447 1.1863 2.2206 H 1 UNL1111111111 0.1475 50 H -3.4623 2.5573 1.2382 H 1 UNL1111111111 0.1440 51 H -4.6621 1.4554 1.9074 H 1 UNL1111111111 0.1418 52 H -4.0637 2.2455 -1.2112 H 1 UNL1111111111 0.1426 53 H -4.5702 0.6455 -1.7643 H 1 UNL1111111111 0.1431 54 H -5.4840 1.4749 -0.5025 H 1 UNL1111111111 0.1426 55 H 3.1541 -0.3607 2.3190 H 1 UNL1111111111 0.3138 56 H 5.3655 -0.2632 0.7403 H 1 UNL1111111111 0.3285 @BOND 1 1 11 1 2 1 55 1 3 2 20 1 4 2 56 1 5 3 4 1 6 3 7 1 7 3 9 1 8 3 10 1 9 4 5 1 10 4 12 1 11 4 23 1 12 5 6 1 13 5 16 1 14 5 17 1 15 6 13 1 16 6 15 1 17 6 24 1 18 7 8 1 19 7 25 1 20 7 26 1 21 8 11 1 22 8 14 1 23 8 27 1 24 9 11 1 25 9 28 1 26 9 29 1 27 10 13 1 28 10 30 1 29 10 31 1 30 11 20 1 31 12 14 1 32 12 32 1 33 12 33 1 34 13 34 1 35 13 35 1 36 14 36 1 37 14 37 1 38 15 18 1 39 15 21 1 40 15 22 1 41 16 19 1 42 16 38 1 43 16 39 1 44 17 40 1 45 17 41 1 46 17 42 1 47 18 19 1 48 18 43 1 49 18 44 1 50 19 45 1 51 19 46 1 52 20 47 1 53 20 48 1 54 21 49 1 55 21 50 1 56 21 51 1 57 22 52 1 58 22 53 1 59 22 54 1