@MOLECULE (2s)-2-[(4ar,4bs,6as,7r,9as,9bs,11ar)-1,4a,6a-trimethyl-2-oxohexadecahydro-1h-indeno[5,4-f]quinolin-7-yl]propanoic acid 61 64 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.5870 -0.5969 0.2866 O.2 1 UNL1111111111 -0.5658 2 O 6.8372 -0.1011 -0.4949 O.3 1 UNL1111111111 -0.5721 3 O 5.9211 0.5148 1.4356 O.2 1 UNL1111111111 -0.5120 4 N -4.6866 0.5930 0.0617 N.am 1 UNL1111111111 -0.5000 5 C 1.9219 -0.2861 -0.2261 C.3 1 UNL1111111111 0.0762 6 C 1.0659 0.9343 0.2346 C.3 1 UNL1111111111 -0.1411 7 C -0.3667 0.8377 -0.2890 C.3 1 UNL1111111111 -0.1234 8 C -1.0042 -0.4234 0.3518 C.3 1 UNL1111111111 -0.1370 9 C -2.4859 -0.5847 -0.0910 C.3 1 UNL1111111111 0.0444 10 C 3.3162 0.1432 0.3171 C.3 1 UNL1111111111 -0.1382 11 C 1.3092 -1.5281 0.4345 C.3 1 UNL1111111111 -0.2987 12 C -0.1682 -1.6775 0.0275 C.3 1 UNL1111111111 -0.2760 13 C 1.9119 2.1469 -0.1747 C.3 1 UNL1111111111 -0.2779 14 C -3.2442 0.7135 0.3460 C.3 1 UNL1111111111 0.0760 15 C -1.1682 2.0911 0.0841 C.3 1 UNL1111111111 -0.2856 16 C 3.3687 1.6733 0.0327 C.3 1 UNL1111111111 -0.2842 17 C -2.6308 1.9481 -0.3442 C.3 1 UNL1111111111 -0.2985 18 C -3.1321 -1.7484 0.6912 C.3 1 UNL1111111111 -0.2923 19 C 1.9669 -0.4591 -1.7480 C.3 1 UNL1111111111 -0.4600 20 C 4.5376 -0.5729 -0.2765 C.3 1 UNL1111111111 -0.1648 21 C -2.6045 -0.8344 -1.5960 C.3 1 UNL1111111111 -0.4556 22 C -4.6074 -1.8979 0.3380 C.3 1 UNL1111111111 -0.3498 23 C -5.3679 -0.5952 0.2609 C.2 1 UNL1111111111 0.5847 24 C 4.5570 -2.0725 0.0252 C.3 1 UNL1111111111 -0.4409 25 C 5.7782 0.0128 0.3528 C.2 1 UNL1111111111 0.6342 26 C -5.4743 1.8317 0.1029 C.3 1 UNL1111111111 -0.2349 27 H 1.0188 0.9219 1.3550 H 1 UNL1111111111 0.1404 28 H -0.3604 0.7345 -1.3979 H 1 UNL1111111111 0.1436 29 H -0.9927 -0.2851 1.4605 H 1 UNL1111111111 0.1370 30 H 3.3274 -0.0157 1.4229 H 1 UNL1111111111 0.1535 31 H 1.3920 -1.4555 1.5339 H 1 UNL1111111111 0.1403 32 H 1.8623 -2.4399 0.1490 H 1 UNL1111111111 0.1373 33 H -0.2330 -1.9047 -1.0529 H 1 UNL1111111111 0.1428 34 H -0.5935 -2.5566 0.5470 H 1 UNL1111111111 0.1346 35 H 1.6813 3.0337 0.4332 H 1 UNL1111111111 0.1359 36 H 1.7284 2.4296 -1.2232 H 1 UNL1111111111 0.1377 37 H -3.1181 0.8349 1.4579 H 1 UNL1111111111 0.1266 38 H -0.7207 2.9796 -0.4003 H 1 UNL1111111111 0.1424 39 H -1.1025 2.2786 1.1723 H 1 UNL1111111111 0.1412 40 H 3.9784 1.8970 -0.8555 H 1 UNL1111111111 0.1362 41 H 3.8458 2.1975 0.8768 H 1 UNL1111111111 0.1501 42 H -3.1822 2.8676 -0.0748 H 1 UNL1111111111 0.1442 43 H -2.7142 1.8553 -1.4428 H 1 UNL1111111111 0.1543 44 H -3.0141 -1.5832 1.7794 H 1 UNL1111111111 0.1435 45 H -2.6042 -2.6974 0.4757 H 1 UNL1111111111 0.1485 46 H 0.9643 -0.5746 -2.1754 H 1 UNL1111111111 0.1482 47 H 2.4231 0.4082 -2.2379 H 1 UNL1111111111 0.1493 48 H 2.5408 -1.3475 -2.0312 H 1 UNL1111111111 0.1430 49 H 4.5747 -0.4167 -1.3854 H 1 UNL1111111111 0.1772 50 H -3.6346 -0.6830 -1.9454 H 1 UNL1111111111 0.1625 51 H -1.9733 -0.1525 -2.1759 H 1 UNL1111111111 0.1475 52 H -2.3138 -1.8566 -1.8587 H 1 UNL1111111111 0.1448 53 H -5.1197 -2.5563 1.0732 H 1 UNL1111111111 0.1749 54 H -4.7256 -2.4148 -0.6401 H 1 UNL1111111111 0.1748 55 H 3.7441 -2.5912 -0.4990 H 1 UNL1111111111 0.1566 56 H 4.4421 -2.2754 1.0968 H 1 UNL1111111111 0.1566 57 H 5.4977 -2.5346 -0.3052 H 1 UNL1111111111 0.1590 58 H -5.2841 2.4262 -0.8066 H 1 UNL1111111111 0.1419 59 H -5.2459 2.4346 0.9959 H 1 UNL1111111111 0.1317 60 H -6.5610 1.6043 0.1212 H 1 UNL1111111111 0.1820 61 H 7.6824 0.2494 -0.1245 H 1 UNL1111111111 0.3534 @BOND 1 1 23 2 2 2 25 1 3 2 61 1 4 3 25 2 5 4 14 1 6 4 23 am 7 4 26 1 8 5 6 1 9 5 10 1 10 5 11 1 11 5 19 1 12 6 7 1 13 6 13 1 14 6 27 1 15 7 8 1 16 7 15 1 17 7 28 1 18 8 9 1 19 8 12 1 20 8 29 1 21 9 14 1 22 9 18 1 23 9 21 1 24 10 16 1 25 10 20 1 26 10 30 1 27 11 12 1 28 11 31 1 29 11 32 1 30 12 33 1 31 12 34 1 32 13 16 1 33 13 35 1 34 13 36 1 35 14 17 1 36 14 37 1 37 15 17 1 38 15 38 1 39 15 39 1 40 16 40 1 41 16 41 1 42 17 42 1 43 17 43 1 44 18 22 1 45 18 44 1 46 18 45 1 47 19 46 1 48 19 47 1 49 19 48 1 50 20 24 1 51 20 25 1 52 20 49 1 53 21 50 1 54 21 51 1 55 21 52 1 56 22 23 1 57 22 53 1 58 22 54 1 59 24 55 1 60 24 56 1 61 24 57 1 62 26 58 1 63 26 59 1 64 26 60 1