@MOLECULE 4-{2-[(2-chloro-4-fluorophenyl)amino]-5-methyl-4-pyrimidinyl}-n-[(1s)-1-(3-chlorophenyl)-2-hydroxyethyl]-1h-pyrrole-2-carboxamide 54 57 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.7932 -1.2071 1.3809 O.2 1 UNL11111 -0.4958 2 C 2.8298 -0.1257 0.8328 C.2 1 UNL11111 0.5956 3 N 3.9864 0.6384 0.8399 N.am 1 UNL11111 -0.6080 4 CA 5.1769 0.1721 1.5543 C.3 1 UNL11111 0.0641 5 C 6.3020 -0.0199 0.5599 C.ar 1 UNL11111 -0.0175 6 C 6.7240 -1.3188 0.2670 C.ar 1 UNL11111 -0.1783 7 C 7.7442 -1.4860 -0.6589 C.ar 1 UNL11111 0.0271 8 CL 8.2703 -3.0753 -1.0161 Cl 1 UNL11111 -0.0866 9 C 8.3555 -0.4220 -1.3084 C.ar 1 UNL11111 -0.1726 10 C 7.9190 0.8676 -1.0084 C.ar 1 UNL11111 -0.1337 11 C 6.8979 1.0677 -0.0809 C.ar 1 UNL11111 -0.1521 12 C 5.5540 1.1893 2.6616 C.3 1 UNL11111 -0.0285 13 O 5.5300 2.4686 2.0471 O.3 1 UNL11111 -0.5691 14 CA 1.7001 0.4638 0.0995 C.ar 1 UNL11111 -0.1158 15 C 0.3587 0.5047 0.4718 C.ar 1 UNL11111 -0.0743 16 N 1.8345 1.0934 -1.1424 N.ar 1 UNL11111 -0.2717 17 C 0.5951 1.5343 -1.5500 C.ar 1 UNL11111 -0.0324 18 C -0.3403 1.2012 -0.5569 C.ar 1 UNL11111 -0.1530 19 C -1.7651 1.4727 -0.5698 C.ar 1 UNL11111 0.3061 20 C -2.3277 2.6764 -1.0563 C.ar 1 UNL11111 -0.2238 21 C -1.5087 3.7993 -1.5746 C.3 1 UNL11111 -0.4175 22 N -2.5492 0.4916 -0.0767 N.ar 1 UNL11111 -0.5106 23 C -3.9044 0.6934 -0.0700 C.ar 1 UNL11111 0.5033 24 N -4.5222 1.8176 -0.5379 N.ar 1 UNL11111 -0.5028 25 C -3.7238 2.7859 -1.0195 C.ar 1 UNL11111 0.1285 26 N -4.6303 -0.3442 0.4938 N.pl3 1 UNL11111 -0.4621 27 C -6.0329 -0.4570 0.3843 C.ar 1 UNL11111 0.1531 28 C -6.6188 -1.6992 0.0936 C.ar 1 UNL11111 -0.0352 29 CL -5.6349 -3.0530 -0.2365 Cl 1 UNL11111 -0.0532 30 C -7.9940 -1.8780 0.0522 C.ar 1 UNL11111 -0.2094 31 C -8.7903 -0.7623 0.2997 C.ar 1 UNL11111 0.1808 32 F -10.1062 -0.9024 0.2627 F 1 UNL11111 -0.1647 33 C -8.2565 0.4953 0.5847 C.ar 1 UNL11111 -0.1927 34 C -6.8761 0.6413 0.6300 C.ar 1 UNL11111 -0.1144 35 H 4.0060 1.6034 0.5465 H 1 UNL11111 0.3249 36 HA 4.9417 -0.8139 2.0602 H 1 UNL11111 0.1859 37 H 6.2537 -2.1791 0.7466 H 1 UNL11111 0.1814 38 H 9.1532 -0.5822 -2.0325 H 1 UNL11111 0.1714 39 H 8.3796 1.7233 -1.5004 H 1 UNL11111 0.1559 40 H 6.5690 2.0838 0.1486 H 1 UNL11111 0.1777 41 H1 4.8174 1.1664 3.4841 H 1 UNL11111 0.1290 42 H2 6.5700 0.9997 3.0494 H 1 UNL11111 0.1310 43 H 5.5830 3.1722 2.7214 H 1 UNL11111 0.3240 44 H -0.0837 0.0868 1.3573 H 1 UNL11111 0.1870 45 H 2.6794 1.1375 -1.6687 H 1 UNL11111 0.3144 46 H 0.4388 2.0238 -2.4932 H 1 UNL11111 0.1741 47 H -1.2715 3.6660 -2.6411 H 1 UNL11111 0.1550 48 H -2.0219 4.7676 -1.4805 H 1 UNL11111 0.1547 49 H -0.5561 3.8992 -1.0305 H 1 UNL11111 0.1620 50 H -4.2442 3.6809 -1.3863 H 1 UNL11111 0.1764 51 H -4.0930 -1.1890 0.7170 H 1 UNL11111 0.3447 52 H -8.4352 -2.8504 -0.1725 H 1 UNL11111 0.1909 53 H -8.9062 1.3510 0.7698 H 1 UNL11111 0.1792 54 H -6.4377 1.6204 0.8512 H 1 UNL11111 0.1979 @BOND 1 2 1 2 2 3 4 1 3 3 2 am 4 3 35 1 5 4 36 1 6 5 4 1 7 5 6 ar 8 6 37 1 9 7 6 ar 10 7 8 1 11 9 7 ar 12 9 38 1 13 10 11 ar 14 10 9 ar 15 10 39 1 16 11 5 ar 17 11 40 1 18 12 13 1 19 12 4 1 20 12 41 1 21 12 42 1 22 13 43 1 23 14 2 1 24 14 15 ar 25 15 44 1 26 16 14 ar 27 16 45 1 28 17 16 ar 29 17 18 ar 30 17 46 1 31 18 19 1 32 18 15 ar 33 19 20 ar 34 20 25 ar 35 20 21 1 36 21 47 1 37 21 48 1 38 21 49 1 39 22 23 ar 40 22 19 ar 41 23 24 ar 42 24 25 ar 43 25 50 1 44 26 23 1 45 26 51 1 46 27 26 1 47 28 29 1 48 28 27 ar 49 30 28 ar 50 30 52 1 51 31 30 ar 52 31 33 ar 53 32 31 1 54 33 34 ar 55 33 53 1 56 34 27 ar 57 34 54 1