@MOLECULE ethyl (4r)-4-(2-chloro-4-fluorophenyl)-2-(4,5-dihydro-1,3-thiazol-2-yl)-6-methyl-1,4-dihydro-5-pyrimidinecarboxylate 42 44 0 0 0 SMALL GASTEIGER @ATOM 1 CL -2.3223 1.0818 2.2792 Cl 1 UNL11111111 -0.0626 2 S 3.9055 1.6218 0.6461 S.3 1 UNL11111111 0.1157 3 F -3.1684 3.4697 -2.0053 F 1 UNL11111111 -0.1682 4 O -2.4422 -1.5550 0.8555 O.3 1 UNL11111111 -0.4275 5 O -2.0428 -3.2377 -0.5846 O.2 1 UNL11111111 -0.5509 6 N 1.9770 -1.7433 -0.6866 N.pl3 1 UNL11111111 -0.5235 7 N 1.2842 0.0728 0.7122 N.2 1 UNL11111111 -0.4166 8 N 4.5922 -0.7308 -0.3345 N.2 1 UNL11111111 -0.3851 9 C -0.1059 -0.3800 0.6997 C.3 1 UNL11111111 0.1212 10 C -0.3061 -1.7005 -0.0065 C.2 1 UNL11111111 -0.4139 11 C 0.7160 -2.3254 -0.6597 C.2 1 UNL11111111 0.3642 12 C -0.9314 0.6863 0.0031 C.ar 1 UNL11111111 -0.0558 13 C 2.1969 -0.5624 0.0669 C.2 1 UNL11111111 0.3426 14 C 3.5824 -0.0475 0.0690 C.2 1 UNL11111111 0.0865 15 C 0.5740 -3.6143 -1.3850 C.3 1 UNL11111111 -0.4805 16 C -1.6438 -2.2679 0.0203 C.2 1 UNL11111111 0.6481 17 C -1.9586 1.3775 0.6377 C.ar 1 UNL11111111 0.0705 18 C -0.6712 0.9702 -1.3428 C.ar 1 UNL11111111 -0.0809 19 C 5.7039 1.3924 0.3033 C.3 1 UNL11111111 -0.3813 20 C 5.8746 -0.0380 -0.2524 C.3 1 UNL11111111 -0.1122 21 C -2.7400 2.3264 -0.0149 C.ar 1 UNL11111111 -0.2611 22 C -1.4227 1.9127 -2.0358 C.ar 1 UNL11111111 -0.2322 23 C -2.4454 2.5719 -1.3534 C.ar 1 UNL11111111 0.2150 24 C -3.8348 -1.8692 0.8711 C.3 1 UNL11111111 0.0132 25 C -4.5191 -1.1282 -0.2667 C.3 1 UNL11111111 -0.4812 26 H -0.4008 -0.4895 1.7865 H 1 UNL11111111 0.1919 27 H 2.7760 -2.2277 -1.0838 H 1 UNL11111111 0.3433 28 H 0.1729 -4.4032 -0.7184 H 1 UNL11111111 0.2004 29 H 1.4994 -3.9933 -1.8338 H 1 UNL11111111 0.1617 30 H -0.1834 -3.5294 -2.1909 H 1 UNL11111111 0.2038 31 H 0.1335 0.4388 -1.8553 H 1 UNL11111111 0.1655 32 H 6.2765 1.5417 1.2327 H 1 UNL11111111 0.1683 33 H 6.0460 2.1548 -0.4142 H 1 UNL11111111 0.1673 34 H 6.3295 -0.0314 -1.2701 H 1 UNL11111111 0.1653 35 H 6.5547 -0.6481 0.3875 H 1 UNL11111111 0.1673 36 H -3.5423 2.8568 0.4975 H 1 UNL11111111 0.1898 37 H -1.2152 2.1281 -3.0824 H 1 UNL11111111 0.1783 38 H -3.9813 -2.9623 0.8148 H 1 UNL11111111 0.1392 39 H -4.1340 -1.4948 1.8689 H 1 UNL11111111 0.1408 40 H -5.6075 -1.2337 -0.2172 H 1 UNL11111111 0.1514 41 H -4.2796 -0.0561 -0.2438 H 1 UNL11111111 0.1593 42 H -4.1896 -1.5123 -1.2418 H 1 UNL11111111 0.1631 @BOND 1 1 17 1 2 2 14 1 3 2 19 1 4 3 23 1 5 4 16 1 6 4 24 1 7 5 16 2 8 6 11 1 9 6 13 1 10 6 27 1 11 7 9 1 12 7 13 2 13 8 14 2 14 8 20 1 15 9 10 1 16 9 12 1 17 9 26 1 18 10 11 2 19 10 16 1 20 11 15 1 21 12 17 ar 22 12 18 ar 23 13 14 1 24 15 28 1 25 15 29 1 26 15 30 1 27 17 21 ar 28 18 22 ar 29 18 31 1 30 19 20 1 31 19 32 1 32 19 33 1 33 20 34 1 34 20 35 1 35 21 23 ar 36 21 36 1 37 22 23 ar 38 22 37 1 39 24 25 1 40 24 38 1 41 24 39 1 42 25 40 1 43 25 41 1 44 25 42 1