@MOLECULE 5-chlor-n-{2-[4-(2-ethoxyethyl)-2,3-dimethylphenoxy]ethyl}-6-ethylpyrimidin-4-amin 54 55 0 0 0 SMALL GASTEIGER @ATOM 1 CL -0.6778 0.7470 -0.9523 Cl 1 UNL1111111111 -0.0160 2 O 2.2156 -2.6568 0.1694 O.3 1 UNL1111111111 -0.3338 3 O -3.6293 -0.3359 -0.6494 O.3 1 UNL1111111111 -0.3994 4 N 1.9877 -0.4411 -1.7207 N.pl3 1 UNL1111111111 -0.4657 5 N 3.2337 1.1835 -0.5557 N.ar 1 UNL1111111111 -0.5333 6 N 2.1732 3.1317 0.3535 N.ar 1 UNL1111111111 -0.5106 7 C -1.6354 -1.4665 1.1075 C.ar 1 UNL1111111111 -0.0420 8 C -0.5438 -1.0515 1.8828 C.ar 1 UNL1111111111 0.0340 9 C 0.7564 -1.4253 1.5142 C.ar 1 UNL1111111111 -0.0756 10 C -3.0554 -1.1435 1.4648 C.3 1 UNL1111111111 -0.2850 11 C 0.9290 -2.2255 0.3762 C.ar 1 UNL1111111111 0.1913 12 C -1.4243 -2.2226 -0.0484 C.ar 1 UNL1111111111 -0.0958 13 C -3.5466 0.0945 0.7019 C.3 1 UNL1111111111 -0.0359 14 C -0.1446 -2.6166 -0.4209 C.ar 1 UNL1111111111 -0.2941 15 C -0.7293 -0.2245 3.1117 C.3 1 UNL1111111111 -0.4432 16 C 1.9431 -0.9963 2.3053 C.3 1 UNL1111111111 -0.4332 17 C 2.6575 -2.7621 -1.1725 C.3 1 UNL1111111111 -0.0789 18 C 3.1131 -1.3847 -1.6884 C.3 1 UNL1111111111 -0.1175 19 C -3.9586 0.7137 -1.5520 C.3 1 UNL1111111111 -0.0225 20 C 2.0161 0.6925 -0.9469 C.ar 1 UNL1111111111 0.4242 21 C 0.8374 1.4179 -0.6291 C.ar 1 UNL1111111111 -0.3313 22 C 0.9533 2.6537 0.0065 C.ar 1 UNL1111111111 0.2946 23 C -0.2284 3.5130 0.3431 C.3 1 UNL1111111111 -0.2630 24 C -3.6309 0.1407 -2.9270 C.3 1 UNL1111111111 -0.4545 25 C -0.8848 3.0171 1.6313 C.3 1 UNL1111111111 -0.4279 26 C 3.2556 2.3716 0.0749 C.ar 1 UNL1111111111 0.2790 27 H -3.1825 -0.9909 2.5533 H 1 UNL1111111111 0.1478 28 H -3.7135 -2.0047 1.2146 H 1 UNL1111111111 0.1599 29 H -2.2790 -2.5000 -0.6687 H 1 UNL1111111111 0.1657 30 H -2.8439 0.9406 0.7953 H 1 UNL1111111111 0.1246 31 H -4.5481 0.4098 1.0415 H 1 UNL1111111111 0.1051 32 H -0.0012 -3.2385 -1.2974 H 1 UNL1111111111 0.1595 33 H -0.5913 -0.8398 4.0145 H 1 UNL1111111111 0.1628 34 H 0.0047 0.5942 3.1653 H 1 UNL1111111111 0.1591 35 H -1.7211 0.2389 3.1773 H 1 UNL1111111111 0.1512 36 H 1.9214 -1.4190 3.3202 H 1 UNL1111111111 0.1586 37 H 2.8933 -1.3150 1.8479 H 1 UNL1111111111 0.1698 38 H 1.9949 0.0982 2.3976 H 1 UNL1111111111 0.1525 39 H 3.5193 -3.4518 -1.0737 H 1 UNL1111111111 0.1535 40 H 1.9013 -3.2298 -1.8236 H 1 UNL1111111111 0.1332 41 H 3.5246 -1.4692 -2.7205 H 1 UNL1111111111 0.1546 42 H 3.9446 -0.9931 -1.0503 H 1 UNL1111111111 0.1909 43 H 1.0776 -0.8635 -1.9032 H 1 UNL1111111111 0.3201 44 H -3.3681 1.6204 -1.3342 H 1 UNL1111111111 0.1177 45 H -5.0325 0.9425 -1.4406 H 1 UNL1111111111 0.1058 46 H -0.9579 3.5192 -0.4930 H 1 UNL1111111111 0.1604 47 H 0.0955 4.5716 0.4691 H 1 UNL1111111111 0.1725 48 H -2.5721 -0.1442 -2.9917 H 1 UNL1111111111 0.1634 49 H -4.2161 -0.7655 -3.1249 H 1 UNL1111111111 0.1515 50 H -3.8379 0.8649 -3.7200 H 1 UNL1111111111 0.1438 51 H -0.1903 3.0863 2.4788 H 1 UNL1111111111 0.1535 52 H -1.7684 3.6156 1.8780 H 1 UNL1111111111 0.1453 53 H -1.2012 1.9689 1.5503 H 1 UNL1111111111 0.1579 54 H 4.2410 2.7578 0.3855 H 1 UNL1111111111 0.1958 @BOND 1 1 21 1 2 2 11 1 3 2 17 1 4 3 13 1 5 3 19 1 6 4 18 1 7 4 20 1 8 4 43 1 9 5 20 ar 10 5 26 ar 11 6 22 ar 12 6 26 ar 13 7 8 ar 14 7 10 1 15 7 12 ar 16 8 9 ar 17 8 15 1 18 9 11 ar 19 9 16 1 20 10 13 1 21 10 27 1 22 10 28 1 23 11 14 ar 24 12 14 ar 25 12 29 1 26 13 30 1 27 13 31 1 28 14 32 1 29 15 33 1 30 15 34 1 31 15 35 1 32 16 36 1 33 16 37 1 34 16 38 1 35 17 18 1 36 17 39 1 37 17 40 1 38 18 41 1 39 18 42 1 40 19 24 1 41 19 44 1 42 19 45 1 43 20 21 ar 44 21 22 ar 45 22 23 1 46 23 25 1 47 23 46 1 48 23 47 1 49 24 48 1 50 24 49 1 51 24 50 1 52 25 51 1 53 25 52 1 54 25 53 1 55 26 54 1