@MOLECULE (1s,2s)-2-ethyl-1-({[(3as,6r,7as)-6-ethyl-1-oxo-2,3,3a,6,7,7a-hexahydro-1h-inden-4-yl]carbonyl}amino)cyclopropanecarboxylic acid 48 50 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.3267 1.3371 -1.6028 O.3 1 UNL1111111111 -0.5682 2 O 4.1462 1.8834 -0.4413 O.2 1 UNL1111111111 -0.4928 3 O 0.8432 0.5127 2.1988 O.2 1 UNL1111111111 -0.5022 4 O -4.9232 2.0498 -0.5628 O.2 1 UNL1111111111 -0.4566 5 N 1.4051 -0.3537 0.1708 N.am 1 UNL1111111111 -0.5778 6 C 2.7918 -0.0052 0.2761 C.3 1 UNL1111111111 0.0441 7 C 3.8083 -1.1548 0.4673 C.3 1 UNL1111111111 -0.1307 8 C 3.5379 -0.1938 1.5905 C.3 1 UNL1111111111 -0.2839 9 C -1.8006 0.9433 0.8057 C.3 1 UNL1111111111 -0.0966 10 C 5.1308 -1.1357 -0.2555 C.3 1 UNL1111111111 -0.2633 11 C -3.2819 0.6334 0.4910 C.3 1 UNL1111111111 -0.2255 12 C -0.9296 -0.2677 0.8060 C.2 1 UNL1111111111 -0.1489 13 C -3.4552 -0.6090 -0.3868 C.3 1 UNL1111111111 -0.2688 14 C 3.1956 1.1593 -0.5701 C.2 1 UNL1111111111 0.6327 15 C -1.3530 1.9839 -0.2534 C.3 1 UNL1111111111 -0.2669 16 C -2.7903 -1.8255 0.2784 C.3 1 UNL1111111111 -0.1074 17 C 0.4903 0.0210 1.1505 C.2 1 UNL1111111111 0.5855 18 C -2.6208 2.7442 -0.6574 C.3 1 UNL1111111111 -0.3815 19 C -3.7743 1.8455 -0.2843 C.2 1 UNL1111111111 0.4798 20 C -1.3569 -1.5148 0.5855 C.2 1 UNL1111111111 -0.1208 21 C 4.9829 -1.6940 -1.6702 C.3 1 UNL1111111111 -0.4356 22 C -2.8884 -3.0678 -0.6274 C.3 1 UNL1111111111 -0.2614 23 C -4.3237 -3.5796 -0.7348 C.3 1 UNL1111111111 -0.4393 24 H 3.3774 -2.1644 0.5372 H 1 UNL1111111111 0.1683 25 H 2.9795 -0.5119 2.4737 H 1 UNL1111111111 0.1917 26 H 4.2851 0.5483 1.8765 H 1 UNL1111111111 0.1809 27 H -1.7388 1.4145 1.8237 H 1 UNL1111111111 0.1685 28 H 5.8709 -1.7335 0.3166 H 1 UNL1111111111 0.1508 29 H 5.5582 -0.1106 -0.2937 H 1 UNL1111111111 0.1630 30 H -3.8653 0.5115 1.4308 H 1 UNL1111111111 0.1672 31 H 1.0903 -0.6318 -0.7513 H 1 UNL1111111111 0.3259 32 H -3.0127 -0.4398 -1.3875 H 1 UNL1111111111 0.1481 33 H -4.5325 -0.7998 -0.5587 H 1 UNL1111111111 0.1551 34 H -0.8992 1.4821 -1.1257 H 1 UNL1111111111 0.1476 35 H -0.5779 2.6544 0.1527 H 1 UNL1111111111 0.1532 36 H -3.3139 -2.0432 1.2468 H 1 UNL1111111111 0.1578 37 H -2.6401 2.9930 -1.7331 H 1 UNL1111111111 0.1718 38 H -2.7089 3.7134 -0.1302 H 1 UNL1111111111 0.1756 39 H -0.6850 -2.3711 0.6364 H 1 UNL1111111111 0.1521 40 H 4.6370 -2.7335 -1.6612 H 1 UNL1111111111 0.1431 41 H 4.2627 -1.1122 -2.2577 H 1 UNL1111111111 0.1462 42 H 5.9379 -1.6693 -2.2079 H 1 UNL1111111111 0.1468 43 H -2.2413 -3.8735 -0.2286 H 1 UNL1111111111 0.1367 44 H -2.4918 -2.8345 -1.6337 H 1 UNL1111111111 0.1400 45 H 2.5581 2.1094 -2.1769 H 1 UNL1111111111 0.3595 46 H -4.7479 -3.8037 0.2506 H 1 UNL1111111111 0.1452 47 H -4.9821 -2.8482 -1.2181 H 1 UNL1111111111 0.1481 48 H -4.3718 -4.4998 -1.3285 H 1 UNL1111111111 0.1429 @BOND 1 1 14 1 2 1 45 1 3 2 14 2 4 3 17 2 5 4 19 2 6 5 6 1 7 5 17 am 8 5 31 1 9 6 7 1 10 6 8 1 11 6 14 1 12 7 8 1 13 7 10 1 14 7 24 1 15 8 25 1 16 8 26 1 17 9 11 1 18 9 12 1 19 9 15 1 20 9 27 1 21 10 21 1 22 10 28 1 23 10 29 1 24 11 13 1 25 11 19 1 26 11 30 1 27 12 17 1 28 12 20 2 29 13 16 1 30 13 32 1 31 13 33 1 32 15 18 1 33 15 34 1 34 15 35 1 35 16 20 1 36 16 22 1 37 16 36 1 38 18 19 1 39 18 37 1 40 18 38 1 41 20 39 1 42 21 40 1 43 21 41 1 44 21 42 1 45 22 23 1 46 22 43 1 47 22 44 1 48 23 46 1 49 23 47 1 50 23 48 1