@MOLECULE (4ar,4bs,6as,7s,9as,9bs,11ar)-4a,6a-dimethyl-7-(3-methylbutanoyl)-1,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-2h-indeno[5,4-f]quinolin-2-one 61 64 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.6806 -1.1131 -0.7299 O.2 1 UNL1111111111 -0.4622 2 O 6.7324 1.2775 -0.1687 O.2 1 UNL1111111111 -0.5298 3 N 5.1080 -0.2730 -0.1027 N.am 1 UNL1111111111 -0.6287 4 C -0.4615 -1.5286 0.4711 C.3 1 UNL1111111111 -0.1398 5 C -1.5288 -0.4513 0.1153 C.3 1 UNL1111111111 0.0928 6 C 0.8910 -1.1907 -0.1552 C.3 1 UNL1111111111 -0.1212 7 C 1.3587 0.1553 0.4663 C.3 1 UNL1111111111 -0.1325 8 C 2.7512 0.5540 -0.0866 C.3 1 UNL1111111111 0.0097 9 C -2.8004 -1.1056 0.7340 C.3 1 UNL1111111111 -0.2613 10 C -1.0842 0.8675 0.7588 C.3 1 UNL1111111111 -0.3028 11 C 0.3081 1.2590 0.2313 C.3 1 UNL1111111111 -0.2710 12 C -1.1412 -2.8489 0.0838 C.3 1 UNL1111111111 -0.2805 13 C 1.9070 -2.3109 0.1146 C.3 1 UNL1111111111 -0.2824 14 C -2.6296 -2.6191 0.4393 C.3 1 UNL1111111111 -0.2586 15 C 3.7284 -0.6226 0.2596 C.3 1 UNL1111111111 0.0851 16 C 3.2914 -1.9289 -0.4172 C.3 1 UNL1111111111 -0.3028 17 C -1.7374 -0.2611 -1.3904 C.3 1 UNL1111111111 -0.4694 18 C 2.7148 0.8555 -1.5899 C.3 1 UNL1111111111 -0.4475 19 C 3.3014 1.7825 0.5985 C.2 1 UNL1111111111 -0.1023 20 C -4.0848 -0.5542 0.1560 C.2 1 UNL1111111111 0.4775 21 C -4.6047 0.7118 0.7909 C.3 1 UNL1111111111 -0.4086 22 C 4.6199 1.9800 0.6934 C.2 1 UNL1111111111 -0.2716 23 C 5.5827 1.0087 0.1200 C.2 1 UNL1111111111 0.5912 24 C -5.5708 1.4674 -0.1393 C.3 1 UNL1111111111 -0.0331 25 C -4.8222 2.0478 -1.3434 C.3 1 UNL1111111111 -0.4579 26 C -6.2670 2.5875 0.6422 C.3 1 UNL1111111111 -0.4598 27 H -0.3284 -1.5344 1.5835 H 1 UNL1111111111 0.1373 28 H 0.7799 -1.0714 -1.2578 H 1 UNL1111111111 0.1472 29 H 1.4590 0.0089 1.5700 H 1 UNL1111111111 0.1382 30 H -2.7977 -0.9434 1.8361 H 1 UNL1111111111 0.1507 31 H -1.0595 0.7746 1.8594 H 1 UNL1111111111 0.1384 32 H -1.8046 1.6753 0.5347 H 1 UNL1111111111 0.1397 33 H 0.2414 1.4932 -0.8483 H 1 UNL1111111111 0.1480 34 H 0.6279 2.1965 0.7230 H 1 UNL1111111111 0.1341 35 H -0.7197 -3.7069 0.6260 H 1 UNL1111111111 0.1336 36 H -1.0183 -3.0649 -0.9899 H 1 UNL1111111111 0.1426 37 H 1.5643 -3.2479 -0.3645 H 1 UNL1111111111 0.1455 38 H 1.9588 -2.5303 1.1975 H 1 UNL1111111111 0.1414 39 H -3.2818 -2.9342 -0.3965 H 1 UNL1111111111 0.1645 40 H -2.9315 -3.2208 1.3089 H 1 UNL1111111111 0.1335 41 H 3.7008 -0.7685 1.3779 H 1 UNL1111111111 0.1383 42 H 4.0170 -2.7373 -0.2079 H 1 UNL1111111111 0.1457 43 H 3.2703 -1.8158 -1.5172 H 1 UNL1111111111 0.1543 44 H -2.4190 0.5730 -1.5948 H 1 UNL1111111111 0.1491 45 H -0.8012 -0.0530 -1.9172 H 1 UNL1111111111 0.1496 46 H -2.1779 -1.1561 -1.8505 H 1 UNL1111111111 0.1646 47 H 2.2042 1.8028 -1.7978 H 1 UNL1111111111 0.1495 48 H 3.7300 0.9386 -2.0022 H 1 UNL1111111111 0.1638 49 H 2.1988 0.0713 -2.1537 H 1 UNL1111111111 0.1517 50 H 2.5765 2.4970 0.9800 H 1 UNL1111111111 0.1527 51 H 5.6977 -0.9705 -0.5229 H 1 UNL1111111111 0.3216 52 H -5.1276 0.4398 1.7317 H 1 UNL1111111111 0.1682 53 H -3.7723 1.3743 1.0935 H 1 UNL1111111111 0.1617 54 H 5.0750 2.8533 1.1551 H 1 UNL1111111111 0.1813 55 H -6.3417 0.7452 -0.5118 H 1 UNL1111111111 0.1516 56 H -5.4940 2.6318 -1.9821 H 1 UNL1111111111 0.1464 57 H -4.0030 2.7052 -1.0381 H 1 UNL1111111111 0.1388 58 H -4.4051 1.2456 -1.9663 H 1 UNL1111111111 0.1538 59 H -6.9696 3.1343 0.0030 H 1 UNL1111111111 0.1463 60 H -5.5480 3.3146 1.0331 H 1 UNL1111111111 0.1428 61 H -6.8385 2.1931 1.4888 H 1 UNL1111111111 0.1412 @BOND 1 1 20 2 2 2 23 2 3 3 15 1 4 3 23 am 5 3 51 1 6 4 5 1 7 4 6 1 8 4 12 1 9 4 27 1 10 5 9 1 11 5 10 1 12 5 17 1 13 6 7 1 14 6 13 1 15 6 28 1 16 7 8 1 17 7 11 1 18 7 29 1 19 8 15 1 20 8 18 1 21 8 19 1 22 9 14 1 23 9 20 1 24 9 30 1 25 10 11 1 26 10 31 1 27 10 32 1 28 11 33 1 29 11 34 1 30 12 14 1 31 12 35 1 32 12 36 1 33 13 16 1 34 13 37 1 35 13 38 1 36 14 39 1 37 14 40 1 38 15 16 1 39 15 41 1 40 16 42 1 41 16 43 1 42 17 44 1 43 17 45 1 44 17 46 1 45 18 47 1 46 18 48 1 47 18 49 1 48 19 22 2 49 19 50 1 50 20 21 1 51 21 24 1 52 21 52 1 53 21 53 1 54 22 23 1 55 22 54 1 56 24 25 1 57 24 26 1 58 24 55 1 59 25 56 1 60 25 57 1 61 25 58 1 62 26 59 1 63 26 60 1 64 26 61 1