@MOLECULE methyl (1s,6r)-4-[(4-chlorophenyl)amino]-6-methyl-2-oxo-3-cyclohexene-1-carboxylate 36 37 0 0 0 SMALL GASTEIGER @ATOM 1 CL -6.0320 1.2774 -0.2246 Cl 1 UNL111111111 -0.0778 2 O 5.2604 0.3336 0.4709 O.3 1 UNL111111111 -0.4169 3 O 2.1277 1.6527 1.3799 O.2 1 UNL111111111 -0.4506 4 O 4.0122 1.2860 -1.1363 O.2 1 UNL111111111 -0.4863 5 N -1.0027 -1.7325 0.1667 N.pl3 1 UNL111111111 -0.5181 6 C 2.5812 -1.4174 -0.5593 C.3 1 UNL111111111 -0.0422 7 C 3.0261 -0.3183 0.4235 C.3 1 UNL111111111 -0.3329 8 C 1.3875 -2.1735 0.0631 C.3 1 UNL111111111 -0.3378 9 C 0.2671 -1.2072 0.3532 C.2 1 UNL111111111 0.3335 10 C 2.1982 -0.8644 -1.9318 C.3 1 UNL111111111 -0.4629 11 C 1.8732 0.5767 0.8955 C.2 1 UNL111111111 0.5197 12 C 0.5239 0.0519 0.7831 C.2 1 UNL111111111 -0.4878 13 C 4.0936 0.5435 -0.1960 C.2 1 UNL111111111 0.6190 14 C -2.1860 -0.9619 0.1068 C.ar 1 UNL111111111 0.2011 15 C -3.3664 -1.5236 0.6235 C.ar 1 UNL111111111 -0.2277 16 C -2.2068 0.2950 -0.5177 C.ar 1 UNL111111111 -0.2015 17 C 6.3672 1.1276 0.0567 C.3 1 UNL111111111 -0.1693 18 C -4.5640 -0.8247 0.5193 C.ar 1 UNL111111111 -0.1172 19 C -3.4044 0.9948 -0.6144 C.ar 1 UNL111111111 -0.1134 20 C -4.5589 0.4210 -0.0959 C.ar 1 UNL111111111 -0.0229 21 H 3.4275 -2.1388 -0.6884 H 1 UNL111111111 0.1428 22 H 3.4367 -0.8085 1.3513 H 1 UNL111111111 0.1959 23 H 1.0747 -2.9867 -0.6216 H 1 UNL111111111 0.1603 24 H 1.7006 -2.6745 1.0037 H 1 UNL111111111 0.1675 25 H 1.7552 -1.6333 -2.5720 H 1 UNL111111111 0.1460 26 H 3.0689 -0.4574 -2.4649 H 1 UNL111111111 0.1680 27 H 1.4782 -0.0386 -1.8524 H 1 UNL111111111 0.1677 28 H -0.2598 0.7453 1.0858 H 1 UNL111111111 0.2005 29 H -1.1156 -2.7389 0.1519 H 1 UNL111111111 0.3146 30 H -3.3474 -2.4958 1.1102 H 1 UNL111111111 0.1634 31 H -1.2922 0.7175 -0.9393 H 1 UNL111111111 0.1866 32 H 6.1381 2.1904 0.1972 H 1 UNL111111111 0.1462 33 H 6.6096 0.9240 -0.9910 H 1 UNL111111111 0.1366 34 H 7.1706 0.8012 0.7266 H 1 UNL111111111 0.1447 35 H -5.4851 -1.2525 0.9183 H 1 UNL111111111 0.1730 36 H -3.4284 1.9750 -1.0957 H 1 UNL111111111 0.1781 @BOND 1 1 20 1 2 2 13 1 3 2 17 1 4 3 11 2 5 4 13 2 6 5 9 1 7 5 14 1 8 5 29 1 9 6 7 1 10 6 8 1 11 6 10 1 12 6 21 1 13 7 11 1 14 7 13 1 15 7 22 1 16 8 9 1 17 8 23 1 18 8 24 1 19 9 12 2 20 10 25 1 21 10 26 1 22 10 27 1 23 11 12 1 24 12 28 1 25 14 15 ar 26 14 16 ar 27 15 18 ar 28 15 30 1 29 16 19 ar 30 16 31 1 31 17 32 1 32 17 33 1 33 17 34 1 34 18 20 ar 35 18 35 1 36 19 20 ar 37 19 36 1