@MOLECULE 2-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)amino-5-acetyl-4,6-dimethylpyrimidine 57 59 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.1691 -1.5204 0.9509 O.3 1 UNL1111111111 -0.3505 2 O 8.2942 0.5941 -0.3726 O.2 1 UNL1111111111 -0.4635 3 N -1.2960 -0.5488 -0.3466 N.3 1 UNL1111111111 -0.4197 4 N -4.0557 0.1346 0.0329 N.pl3 1 UNL1111111111 -0.4186 5 N 2.3045 -1.0897 -0.8693 N.pl3 1 UNL1111111111 -0.4830 6 N 4.5737 -1.5010 -0.6477 N.ar 1 UNL1111111111 -0.5751 7 N 3.6704 0.6994 -0.1214 N.ar 1 UNL1111111111 -0.5719 8 C -1.6909 0.7139 0.3235 C.3 1 UNL1111111111 -0.1179 9 C -2.3128 -1.5974 -0.0858 C.3 1 UNL1111111111 -0.1202 10 C -3.0506 1.1849 -0.2482 C.3 1 UNL1111111111 -0.1143 11 C -3.6741 -1.1286 -0.6478 C.3 1 UNL1111111111 -0.1080 12 C 0.0476 -0.9883 0.0974 C.3 1 UNL1111111111 -0.1443 13 C -5.4112 0.5014 -0.1881 C.ar 1 UNL1111111111 0.1070 14 C 1.0815 -0.2871 -0.8241 C.3 1 UNL1111111111 -0.0712 15 C -6.4307 -0.3036 0.3701 C.ar 1 UNL1111111111 0.1469 16 C -5.7985 1.6679 -0.8600 C.ar 1 UNL1111111111 -0.2259 17 C -7.7750 0.0397 0.2571 C.ar 1 UNL1111111111 -0.1766 18 C -7.1438 2.0163 -0.9649 C.ar 1 UNL1111111111 -0.1333 19 C 3.5286 -0.6046 -0.5321 C.ar 1 UNL1111111111 0.5443 20 C -8.1325 1.2060 -0.4153 C.ar 1 UNL1111111111 -0.1646 21 C 5.8023 -1.0618 -0.3416 C.ar 1 UNL1111111111 0.3879 22 C 4.9114 1.1170 0.1886 C.ar 1 UNL1111111111 0.3729 23 C 6.0238 0.2607 0.1090 C.ar 1 UNL1111111111 -0.4892 24 C -5.5649 -1.4156 2.2381 C.3 1 UNL1111111111 -0.1959 25 C 6.9123 -2.0436 -0.4908 C.3 1 UNL1111111111 -0.4668 26 C 5.0214 2.5489 0.5951 C.3 1 UNL1111111111 -0.4647 27 C 7.3937 0.6962 0.4258 C.2 1 UNL1111111111 0.5449 28 C 7.6494 1.2396 1.8042 C.3 1 UNL1111111111 -0.5461 29 H -0.9183 1.4836 0.1111 H 1 UNL1111111111 0.1424 30 H -1.7680 0.6093 1.4272 H 1 UNL1111111111 0.1275 31 H -2.4166 -1.8369 0.9939 H 1 UNL1111111111 0.1260 32 H -2.0068 -2.5269 -0.6123 H 1 UNL1111111111 0.1400 33 H -3.3561 2.1245 0.2600 H 1 UNL1111111111 0.1419 34 H -2.9447 1.3965 -1.3348 H 1 UNL1111111111 0.1361 35 H -3.6056 -0.9985 -1.7499 H 1 UNL1111111111 0.1358 36 H -4.4473 -1.9045 -0.4499 H 1 UNL1111111111 0.1638 37 H 0.2629 -0.7609 1.1612 H 1 UNL1111111111 0.1313 38 H 0.1390 -2.0909 -0.0082 H 1 UNL1111111111 0.1425 39 H 1.2936 0.7463 -0.4654 H 1 UNL1111111111 0.1762 40 H 0.6670 -0.1894 -1.8572 H 1 UNL1111111111 0.1658 41 H -5.0524 2.3105 -1.3208 H 1 UNL1111111111 0.1571 42 H 2.2371 -2.0425 -1.2084 H 1 UNL1111111111 0.3307 43 H -8.5298 -0.6106 0.6959 H 1 UNL1111111111 0.1678 44 H -7.4206 2.9295 -1.4894 H 1 UNL1111111111 0.1516 45 H -9.1808 1.4804 -0.5073 H 1 UNL1111111111 0.1541 46 H -6.2372 -0.8990 2.9285 H 1 UNL1111111111 0.1276 47 H -5.4338 -2.4648 2.5257 H 1 UNL1111111111 0.1434 48 H -4.5989 -0.9009 2.1783 H 1 UNL1111111111 0.1486 49 H 6.5662 -3.0048 -0.9060 H 1 UNL1111111111 0.1830 50 H 7.6929 -1.6508 -1.1692 H 1 UNL1111111111 0.1967 51 H 7.3971 -2.2544 0.4736 H 1 UNL1111111111 0.1724 52 H 4.1010 3.1120 0.3590 H 1 UNL1111111111 0.1849 53 H 5.1801 2.6415 1.6801 H 1 UNL1111111111 0.1726 54 H 5.8533 3.0534 0.0820 H 1 UNL1111111111 0.1734 55 H 6.8442 1.0084 2.5096 H 1 UNL1111111111 0.1668 56 H 8.5846 0.8255 2.2117 H 1 UNL1111111111 0.1807 57 H 7.7812 2.3298 1.7739 H 1 UNL1111111111 0.1767 @BOND 1 1 15 1 2 1 24 1 3 2 27 2 4 3 8 1 5 3 9 1 6 3 12 1 7 4 10 1 8 4 11 1 9 4 13 1 10 5 14 1 11 5 19 1 12 5 42 1 13 6 19 ar 14 6 21 ar 15 7 19 ar 16 7 22 ar 17 8 10 1 18 8 29 1 19 8 30 1 20 9 11 1 21 9 31 1 22 9 32 1 23 10 33 1 24 10 34 1 25 11 35 1 26 11 36 1 27 12 14 1 28 12 37 1 29 12 38 1 30 13 15 ar 31 13 16 ar 32 14 39 1 33 14 40 1 34 15 17 ar 35 16 18 ar 36 16 41 1 37 17 20 ar 38 17 43 1 39 18 20 ar 40 18 44 1 41 20 45 1 42 21 23 ar 43 21 25 1 44 22 23 ar 45 22 26 1 46 23 27 1 47 24 46 1 48 24 47 1 49 24 48 1 50 25 49 1 51 25 50 1 52 25 51 1 53 26 52 1 54 26 53 1 55 26 54 1 56 27 28 1 57 28 55 1 58 28 56 1 59 28 57 1