@MOLECULE 2-({4-[2-(diethylamino)ethoxy]phenyl}amino)-6-(4-fluorophenoxy)-8-methylpyrido[2,3-d]pyrimidin-7(8h)-one 63 66 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -0.1103 -0.0461 -0.7541 N.ar 1 UNL1 -0.5201 2 C -0.0040 -1.1853 0.0291 C.ar 1 UNL1 0.5533 3 N 1.1799 -1.7670 0.3972 N.ar 1 UNL1 -0.6099 4 C 1.0192 0.5086 -1.1802 C.ar 1 UNL1 0.2108 5 C 2.2965 -0.0017 -0.8576 C.ar 1 UNL1 -0.3653 6 C 2.3235 -1.1716 -0.0377 C.ar 1 UNL1 0.4584 7 N 3.5231 -1.7341 0.3423 N.ar 1 UNL1 -0.4041 8 C 4.7715 -1.2046 -0.0929 C.ar 1 UNL1 0.5484 9 C 4.6861 -0.0090 -0.9397 C.ar 1 UNL1 -0.0203 10 C 3.5207 0.5757 -1.3030 C.ar 1 UNL1 -0.0445 11 O 5.8561 0.4376 -1.5028 O.3 1 UNL1 -0.2533 12 C 6.8269 0.8620 -0.6220 C.ar 1 UNL1 0.2056 13 N -1.1212 -1.8082 0.5072 N.pl3 1 UNL1 -0.4395 14 C -2.4577 -1.4421 0.1818 C.ar 1 UNL1 0.0987 15 C -3.3745 -2.4839 -0.0488 C.ar 1 UNL1 -0.1416 16 C -4.7006 -2.1861 -0.3091 C.ar 1 UNL1 -0.2236 17 C -5.1046 -0.8393 -0.3465 C.ar 1 UNL1 0.2528 18 C -4.2003 0.1995 -0.1247 C.ar 1 UNL1 -0.2751 19 C -2.8691 -0.1074 0.1438 C.ar 1 UNL1 -0.0847 20 O -6.4242 -0.6906 -0.6128 O.3 1 UNL1 -0.3588 21 C -6.9424 0.6447 -0.6552 C.3 1 UNL1 -0.0433 22 C -8.4569 0.4229 -0.8468 C.3 1 UNL1 -0.1337 23 N -9.1429 1.3129 0.1176 N.3 1 UNL1 -0.4483 24 C -10.0729 2.2508 -0.5586 C.3 1 UNL1 -0.0876 25 C -10.3271 3.4617 0.3499 C.3 1 UNL1 -0.4462 26 C -9.8117 0.5478 1.1978 C.3 1 UNL1 -0.0857 27 C -8.7563 -0.0641 2.1276 C.3 1 UNL1 -0.4504 28 O 5.7868 -1.7507 0.2655 O.2 1 UNL1 -0.4464 29 C 3.5209 -2.9423 1.1786 C.3 1 UNL1 -0.2238 30 C 8.1175 0.8197 -1.1635 C.ar 1 UNL1 -0.1827 31 C 9.1743 1.3063 -0.4047 C.ar 1 UNL1 -0.1676 32 C 8.8995 1.8103 0.8688 C.ar 1 UNL1 0.1426 33 C 7.6179 1.8468 1.4151 C.ar 1 UNL1 -0.1629 34 C 6.5588 1.3632 0.6507 C.ar 1 UNL1 -0.2120 35 F 9.9087 2.2761 1.5920 F 1 UNL1 -0.1740 36 H 0.9091 1.4057 -1.8091 H 1 UNL1 0.1819 37 H 3.5017 1.4662 -1.9351 H 1 UNL1 0.1807 38 H -0.9862 -2.6796 1.0216 H 1 UNL1 0.3353 39 H -3.0435 -3.5215 -0.0299 H 1 UNL1 0.1600 40 H -5.4319 -2.9701 -0.4910 H 1 UNL1 0.1727 41 H -4.5108 1.2393 -0.1579 H 1 UNL1 0.1684 42 H -2.1495 0.6972 0.3148 H 1 UNL1 0.1822 43 H -6.7275 1.1627 0.2981 H 1 UNL1 0.1548 44 H -6.4816 1.1809 -1.4982 H 1 UNL1 0.1266 45 H -8.7441 0.6291 -1.8966 H 1 UNL1 0.1336 46 H -8.6930 -0.6542 -0.6808 H 1 UNL1 0.1539 47 H -9.5946 2.6056 -1.4995 H 1 UNL1 0.1342 48 H -11.0334 1.7730 -0.8443 H 1 UNL1 0.1114 49 H -10.9913 3.2185 1.1849 H 1 UNL1 0.1425 50 H -9.3837 3.8238 0.7815 H 1 UNL1 0.1627 51 H -10.7794 4.2854 -0.2107 H 1 UNL1 0.1418 52 H -10.4490 1.2482 1.7824 H 1 UNL1 0.1370 53 H -10.4851 -0.2441 0.8055 H 1 UNL1 0.1095 54 H -8.1133 -0.7797 1.6000 H 1 UNL1 0.1562 55 H -8.0986 0.7139 2.5360 H 1 UNL1 0.1560 56 H -9.2272 -0.5860 2.9659 H 1 UNL1 0.1415 57 H 3.1137 -3.8014 0.6150 H 1 UNL1 0.1584 58 H 4.5487 -3.1879 1.5092 H 1 UNL1 0.1790 59 H 2.8882 -2.7917 2.0733 H 1 UNL1 0.1634 60 H 8.2767 0.4039 -2.1567 H 1 UNL1 0.1765 61 H 10.1915 1.2871 -0.7935 H 1 UNL1 0.1727 62 H 7.4427 2.2407 2.4152 H 1 UNL1 0.1718 63 H 5.5451 1.3753 1.0441 H 1 UNL1 0.1703 @BOND 1 60 30 1 2 37 10 1 3 45 22 1 4 36 4 1 5 11 9 1 6 11 12 1 7 47 24 1 8 44 21 1 9 10 9 ar 10 10 5 ar 11 4 5 ar 12 4 1 ar 13 30 12 ar 14 30 31 ar 15 9 8 ar 16 5 6 ar 17 22 46 1 18 22 21 1 19 22 23 1 20 48 24 1 21 61 31 1 22 1 2 ar 23 21 20 1 24 21 43 1 25 12 34 ar 26 20 17 1 27 24 23 1 28 24 25 1 29 40 16 1 30 31 32 ar 31 17 16 ar 32 17 18 ar 33 16 15 ar 34 51 25 1 35 41 18 1 36 18 19 ar 37 8 28 2 38 8 7 ar 39 15 39 1 40 15 14 ar 41 6 7 ar 42 6 3 ar 43 2 3 ar 44 2 13 1 45 23 26 1 46 19 14 ar 47 19 42 1 48 14 13 1 49 7 29 1 50 25 50 1 51 25 49 1 52 13 38 1 53 57 29 1 54 34 63 1 55 34 33 ar 56 53 26 1 57 32 33 ar 58 32 35 1 59 29 58 1 60 29 59 1 61 26 52 1 62 26 27 1 63 33 62 1 64 54 27 1 65 27 55 1 66 27 56 1