@MOLECULE 2-(3-chloro-6-{[2,2-difluoro-2-(1-oxido-2-pyridinyl)ethyl]amino}-1-oxido-2-pyridinyl)-n-[1-(3-chlorophenyl)ethyl]acetamide 53 55 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -3.0900 1.2089 -1.4075 C.ar 1 UNL1 -0.0152 2 C -3.4875 0.2975 -0.4310 C.ar 1 UNL1 -0.2063 3 N -3.6306 0.7032 0.8797 N.ar 1 UNL1 0.3985 4 C -3.3815 2.0084 1.2293 C.ar 1 UNL1 -0.2180 5 C -2.9859 2.9282 0.2666 C.ar 1 UNL1 -0.0574 6 C -2.8359 2.5335 -1.0612 C.ar 1 UNL1 -0.2355 7 C -3.7831 -1.1588 -0.7128 C.3 1 UNL1 0.3904 8 C -2.7713 -2.1681 -0.0853 C.3 1 UNL1 -0.1487 9 N -1.3760 -1.9198 -0.4531 N.pl3 1 UNL1 -0.4558 10 C -0.7598 -0.8493 0.2267 C.ar 1 UNL1 0.1608 11 N -0.2407 0.1876 -0.5474 N.ar 1 UNL1 0.2456 12 C 0.4223 1.2455 0.0209 C.ar 1 UNL1 -0.0110 13 C 0.6245 1.2218 1.4035 C.ar 1 UNL1 -0.0273 14 C 0.1363 0.2041 2.2082 C.ar 1 UNL1 -0.1629 15 C -0.5693 -0.8356 1.6100 C.ar 1 UNL1 -0.1393 16 O -0.3717 0.1214 -1.8042 O.2 1 UNL1 -0.5570 17 CL 1.5357 2.4641 2.1030 Cl 1 UNL1 -0.0037 18 C 0.9045 2.3412 -0.8709 C.3 1 UNL1 -0.3611 19 C 2.3462 2.0210 -1.2526 C.2 1 UNL1 0.5876 20 N 2.4808 0.9430 -2.1218 N.am 1 UNL1 -0.6020 21 O 3.2945 2.6291 -0.8139 O.2 1 UNL1 -0.5022 22 C 3.7277 0.1569 -2.0196 C.3 1 UNL1 0.1049 23 C 3.6454 -0.5942 -0.7003 C.ar 1 UNL1 -0.0407 24 C 2.7209 -1.6270 -0.5382 C.ar 1 UNL1 -0.1952 25 C 2.5292 -2.1459 0.7335 C.ar 1 UNL1 0.0187 26 C 3.2506 -1.7153 1.8389 C.ar 1 UNL1 -0.1800 27 C 4.3834 -0.1410 0.3940 C.ar 1 UNL1 -0.1527 28 C 4.1941 -0.7056 1.6545 C.ar 1 UNL1 -0.1206 29 F -5.0262 -1.4545 -0.3013 F 1 UNL1 -0.1857 30 F -3.8777 -1.3725 -2.0359 F 1 UNL1 -0.2114 31 CL 1.3053 -3.3200 0.9460 Cl 1 UNL1 -0.0803 32 O -3.9554 -0.1274 1.7477 O.2 1 UNL1 -0.4717 33 C 3.8571 -0.7780 -3.2218 C.3 1 UNL1 -0.4599 34 H -2.9513 0.8852 -2.4456 H 1 UNL1 0.1918 35 H -3.5129 2.2702 2.2821 H 1 UNL1 0.2022 36 H -2.7901 3.9609 0.5643 H 1 UNL1 0.1712 37 H -2.5228 3.2481 -1.8200 H 1 UNL1 0.1772 38 H -3.0157 -3.2121 -0.4076 H 1 UNL1 0.1867 39 H -2.8938 -2.1531 1.0274 H 1 UNL1 0.1943 40 H -1.2196 -1.8927 -1.4707 H 1 UNL1 0.3168 41 H 0.3024 0.2049 3.2875 H 1 UNL1 0.1902 42 H -0.9666 -1.6601 2.2112 H 1 UNL1 0.2024 43 H 0.8596 3.3365 -0.3765 H 1 UNL1 0.1992 44 H 0.2683 2.4378 -1.7832 H 1 UNL1 0.2042 45 H 1.6355 0.4161 -2.3441 H 1 UNL1 0.3278 46 H 4.5935 0.8783 -2.0101 H 1 UNL1 0.1731 47 H 2.1452 -1.9975 -1.3867 H 1 UNL1 0.1765 48 H 3.0844 -2.1445 2.8252 H 1 UNL1 0.1701 49 H 5.0881 0.6842 0.2703 H 1 UNL1 0.1740 50 H 4.7726 -0.3417 2.5031 H 1 UNL1 0.1592 51 H 2.9952 -1.4464 -3.3321 H 1 UNL1 0.1543 52 H 4.7517 -1.4063 -3.1289 H 1 UNL1 0.1597 53 H 3.9422 -0.2038 -4.1545 H 1 UNL1 0.1642 @BOND 1 53 33 1 2 51 33 1 3 33 52 1 4 33 22 1 5 34 1 1 6 45 20 1 7 20 22 1 8 20 19 am 9 30 7 1 10 22 46 1 11 22 23 1 12 37 6 1 13 16 11 2 14 44 18 1 15 40 9 1 16 1 6 ar 17 1 2 ar 18 47 24 1 19 19 18 1 20 19 21 2 21 6 5 ar 22 18 43 1 23 18 12 1 24 7 2 1 25 7 29 1 26 7 8 1 27 23 24 ar 28 23 27 ar 29 11 12 ar 30 11 10 ar 31 24 25 ar 32 9 8 1 33 9 10 1 34 2 3 ar 35 38 8 1 36 8 39 1 37 12 13 ar 38 10 15 ar 39 5 36 1 40 5 4 ar 41 49 27 1 42 27 28 ar 43 25 31 1 44 25 26 ar 45 3 4 ar 46 3 32 2 47 4 35 1 48 13 17 1 49 13 14 ar 50 15 14 ar 51 15 42 1 52 28 26 ar 53 28 50 1 54 26 48 1 55 14 41 1