@MOLECULE n-(6-amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-fluoro-n-methylbenzenesulfonamide 45 47 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -4.9817 1.1434 0.3744 C.ar 1 UNL1 -0.1326 2 C -5.8487 0.9311 1.4429 C.ar 1 UNL1 -0.1442 3 C -6.2786 -0.3598 1.7461 C.ar 1 UNL1 -0.1358 4 C -5.8511 -1.4362 0.9710 C.ar 1 UNL1 -0.1461 5 C -4.9875 -1.2262 -0.1024 C.ar 1 UNL1 -0.1550 6 C -4.5412 0.0628 -0.3918 C.ar 1 UNL1 -0.0590 7 C -3.5727 0.3108 -1.5178 C.3 1 UNL1 -0.0773 8 N -2.2113 0.5591 -0.9965 N.ar 1 UNL1 -0.4914 9 C -1.3926 -0.4776 -0.5384 C.ar 1 UNL1 0.5212 10 N -1.7974 -1.7700 -0.7143 N.pl3 1 UNL1 -0.5748 11 C -1.8939 1.9187 -0.7306 C.ar 1 UNL1 0.7146 12 O -2.6511 2.8029 -1.0738 O.2 1 UNL1 -0.5170 13 N -0.6886 2.1802 -0.0972 N.ar 1 UNL1 -0.6227 14 C 0.2281 1.1750 0.3306 C.ar 1 UNL1 0.6176 15 O 1.2560 1.5681 0.8415 O.2 1 UNL1 -0.5283 16 C -0.1744 -0.1830 0.0918 C.ar 1 UNL1 -0.3089 17 N 0.6276 -1.2772 0.4985 N.pl3 1 UNL1 -0.6413 18 C 0.8850 -1.3142 1.9470 C.3 1 UNL1 -0.2389 19 S 1.9796 -1.6585 -0.5639 S.O2 1 UNL1 2.3246 20 O 2.3828 -2.9917 -0.1691 O.2 1 UNL1 -0.9054 21 O 1.4999 -1.3941 -1.9019 O.2 1 UNL1 -0.8983 22 C 3.3034 -0.5733 -0.1831 C.ar 1 UNL1 -0.4331 23 C 4.3013 -1.0022 0.6937 C.ar 1 UNL1 -0.0243 24 C 5.3610 -0.1603 1.0175 C.ar 1 UNL1 -0.2647 25 C 5.3884 1.1070 0.4341 C.ar 1 UNL1 0.2562 26 C 4.4124 1.5577 -0.4526 C.ar 1 UNL1 -0.2533 27 C 3.3582 0.6976 -0.7559 C.ar 1 UNL1 0.0170 28 F 6.3928 1.9151 0.7332 F 1 UNL1 -0.1760 29 H -4.6740 -2.0734 -0.7061 H 1 UNL1 0.1406 30 H -6.1923 -2.4432 1.2039 H 1 UNL1 0.1513 31 H -6.9504 -0.5269 2.5863 H 1 UNL1 0.1525 32 H -6.1888 1.7747 2.0419 H 1 UNL1 0.1566 33 H -4.6443 2.1560 0.1362 H 1 UNL1 0.1782 34 H -3.5470 -0.5215 -2.2553 H 1 UNL1 0.1477 35 H -3.8944 1.2112 -2.1129 H 1 UNL1 0.1989 36 H -2.5765 -2.0213 -1.2790 H 1 UNL1 0.3048 37 H -1.1433 -2.5029 -0.4642 H 1 UNL1 0.3483 38 H -0.4457 3.1601 0.0701 H 1 UNL1 0.3476 39 H 1.3512 -2.2800 2.2143 H 1 UNL1 0.1551 40 H 1.5213 -0.4842 2.3047 H 1 UNL1 0.1450 41 H -0.0748 -1.2523 2.4907 H 1 UNL1 0.1501 42 H 4.2708 -2.0090 1.1304 H 1 UNL1 0.1750 43 H 2.5805 1.0379 -1.4504 H 1 UNL1 0.1726 44 H 6.1409 -0.4834 1.7027 H 1 UNL1 0.1749 45 H 4.4586 2.5538 -0.8876 H 1 UNL1 0.1781 @BOND 1 34 7 1 2 35 7 1 3 21 19 2 4 7 8 1 5 7 6 1 6 43 27 1 7 36 10 1 8 12 11 2 9 8 11 ar 10 8 9 ar 11 45 26 1 12 27 26 ar 13 27 22 ar 14 11 13 ar 15 10 9 1 16 10 37 1 17 29 5 1 18 19 22 1 19 19 20 2 20 19 17 1 21 9 16 ar 22 26 25 ar 23 6 5 ar 24 6 1 ar 25 22 23 ar 26 5 4 ar 27 13 38 1 28 13 14 ar 29 16 14 ar 30 16 17 1 31 33 1 1 32 14 15 2 33 1 2 ar 34 25 28 1 35 25 24 ar 36 17 18 1 37 23 24 ar 38 23 42 1 39 4 30 1 40 4 3 ar 41 24 44 1 42 2 3 ar 43 2 32 1 44 3 31 1 45 18 39 1 46 18 40 1 47 18 41 1