@MOLECULE 5-[4-(6-carboxy-2-naphthyl)butyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid 46 48 0 0 0 SMALL USER_CHARGES @ATOM 1 OXT 3.0304 2.3874 0.3826 O.2 1 UNL11111111 -0.4343 2 C 4.2017 2.1753 0.2388 C.2 1 UNL11111111 0.6169 3 O 5.0804 3.1940 0.0491 O.3 1 UNL11111111 -0.5674 4 CA 4.9156 0.8646 0.2328 C.2 1 UNL11111111 0.1150 5 N 6.2552 0.8981 -0.1360 N.am 1 UNL11111111 -0.5139 6 C 7.0432 -0.2661 -0.1930 C.2 1 UNL11111111 0.6964 7 O 8.2054 -0.2097 -0.5249 O.2 1 UNL11111111 -0.4796 8 N 6.4093 -1.4628 0.1538 N.am 1 UNL11111111 -0.6175 9 C 5.0537 -1.5590 0.5475 C.2 1 UNL11111111 0.5864 10 O 4.6322 -2.6528 0.8369 O.2 1 UNL11111111 -0.4526 11 C 4.2931 -0.2976 0.5600 C.2 1 UNL11111111 -0.1579 12 C 2.8538 -0.4278 0.9120 C.3 1 UNL11111111 -0.2603 13 C 2.0132 -0.5806 -0.3684 C.3 1 UNL11111111 -0.2540 14 C 0.5226 -0.6218 -0.0199 C.3 1 UNL11111111 -0.2554 15 C -0.3225 -0.7948 -1.2922 C.3 1 UNL11111111 -0.2946 16 C -1.7747 -0.8003 -0.9286 C.ar 1 UNL11111111 0.0467 17 C -2.4978 0.3673 -0.9038 C.ar 1 UNL11111111 -0.2178 18 C -3.8711 0.3574 -0.5408 C.ar 1 UNL11111111 0.0542 19 C -4.6375 1.5561 -0.5092 C.ar 1 UNL11111111 -0.1905 20 C -5.9621 1.5268 -0.1601 C.ar 1 UNL11111111 -0.0770 21 C -6.5779 0.2933 0.1734 C.ar 1 UNL11111111 -0.1583 22 C -7.9964 0.2383 0.5497 C.2 1 UNL11111111 0.6460 23 O -8.5872 1.4637 0.5027 O.3 1 UNL11111111 -0.5575 24 O -8.6400 -0.7284 0.8742 O.2 1 UNL11111111 -0.5082 25 C -5.8605 -0.8815 0.1528 C.ar 1 UNL11111111 -0.0555 26 C -4.4879 -0.8690 -0.2055 C.ar 1 UNL11111111 -0.0642 27 C -3.7188 -2.0660 -0.2356 C.ar 1 UNL11111111 -0.1184 28 C -2.3961 -2.0327 -0.5874 C.ar 1 UNL11111111 -0.1850 29 H 4.6553 4.0906 0.0392 H 1 UNL11111111 0.3746 30 H 6.9720 -2.3186 0.1251 H 1 UNL11111111 0.3500 31 H 2.6889 -1.3117 1.5711 H 1 UNL11111111 0.1746 32 H 2.4932 0.4431 1.5012 H 1 UNL11111111 0.1698 33 H 2.2169 0.2618 -1.0563 H 1 UNL11111111 0.1414 34 H 2.3088 -1.5038 -0.9031 H 1 UNL11111111 0.1452 35 H 0.3140 -1.4474 0.6870 H 1 UNL11111111 0.1448 36 H 0.2268 0.3092 0.5027 H 1 UNL11111111 0.1481 37 H -0.0966 0.0183 -2.0117 H 1 UNL11111111 0.1521 38 H -0.0390 -1.7316 -1.8131 H 1 UNL11111111 0.1529 39 H -2.0313 1.3169 -1.1585 H 1 UNL11111111 0.1607 40 H -4.1501 2.4944 -0.7683 H 1 UNL11111111 0.1601 41 H -6.5586 2.4421 -0.1335 H 1 UNL11111111 0.1748 42 H -9.5439 1.4406 0.7545 H 1 UNL11111111 0.3557 43 H -6.3393 -1.8316 0.4104 H 1 UNL11111111 0.1757 44 H -4.2040 -3.0062 0.0266 H 1 UNL11111111 0.1582 45 H -1.8008 -2.9442 -0.6102 H 1 UNL11111111 0.1596 46 H 6.7043 1.7904 -0.3564 H 1 UNL11111111 0.3602 @BOND 1 37 15 1 2 38 15 1 3 15 16 1 4 15 14 1 5 39 17 1 6 33 13 1 7 16 17 ar 8 16 28 ar 9 17 18 ar 10 34 13 1 11 40 19 1 12 45 28 1 13 28 27 ar 14 18 19 ar 15 18 26 ar 16 7 6 2 17 19 20 ar 18 13 14 1 19 13 12 1 20 46 5 1 21 27 26 ar 22 27 44 1 23 26 25 ar 24 6 5 am 25 6 8 am 26 20 41 1 27 20 21 ar 28 5 4 1 29 14 36 1 30 14 35 1 31 29 3 1 32 3 2 1 33 30 8 1 34 25 21 ar 35 25 43 1 36 8 9 am 37 21 22 1 38 4 2 1 39 4 11 2 40 2 1 2 41 23 22 1 42 23 42 1 43 9 11 1 44 9 10 2 45 22 24 2 46 11 12 1 47 12 32 1 48 12 31 1