@MOLECULE 5-[2-(3-methoxy-2-naphthyl)ethyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid 41 43 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -3.4922 -2.6653 -0.3256 O.3 1 UNL1 -0.5588 2 C -2.7567 -1.8903 0.5135 C.2 1 UNL1 0.6157 3 OXT -1.9932 -2.3653 1.3041 O.2 1 UNL1 -0.4268 4 CA -3.1043 -0.4543 0.2907 C.ar 1 UNL1 0.1287 5 N -4.4449 -0.2081 0.0193 N.ar 1 UNL1 -0.5144 6 C -4.9303 1.0950 -0.2002 C.ar 1 UNL1 0.6973 7 O -6.0976 1.2822 -0.4591 O.2 1 UNL1 -0.4847 8 N -3.9977 2.1302 -0.0965 N.ar 1 UNL1 -0.6214 9 C -2.6200 1.9389 0.1754 C.ar 1 UNL1 0.5942 10 O -1.9223 2.9226 0.2271 O.2 1 UNL1 -0.4551 11 C -2.1903 0.5444 0.3690 C.ar 1 UNL1 -0.1652 12 C -0.7352 0.3546 0.6035 C.3 1 UNL1 -0.2529 13 C 0.0189 0.4215 -0.7408 C.3 1 UNL1 -0.2519 14 C 1.4767 0.2015 -0.5039 C.ar 1 UNL1 -0.0662 15 C 2.3510 1.2452 -0.3675 C.ar 1 UNL1 -0.1239 16 C 3.7351 1.0175 -0.1183 C.ar 1 UNL1 -0.0643 17 C 4.6439 2.0989 0.0228 C.ar 1 UNL1 -0.1230 18 C 5.9731 1.8619 0.2689 C.ar 1 UNL1 -0.1736 19 C 6.4509 0.5340 0.3828 C.ar 1 UNL1 -0.1236 20 C 5.5920 -0.5278 0.2485 C.ar 1 UNL1 -0.1795 21 C 4.2113 -0.3068 -0.0068 C.ar 1 UNL1 0.0576 22 C 3.3068 -1.3940 -0.1527 C.ar 1 UNL1 -0.3319 23 C 1.9822 -1.1350 -0.3955 C.ar 1 UNL1 0.2369 24 O 1.0064 -2.0665 -0.5639 O.3 1 UNL1 -0.3118 25 C 1.3874 -3.4290 -0.4291 C.3 1 UNL1 -0.2020 26 H -3.3039 -3.6350 -0.2400 H 1 UNL1 0.3674 27 H -5.0919 -0.9869 -0.1129 H 1 UNL1 0.3544 28 H -4.3394 3.0848 -0.2380 H 1 UNL1 0.3479 29 H -0.3423 1.1426 1.2872 H 1 UNL1 0.1780 30 H -0.5067 -0.6056 1.1154 H 1 UNL1 0.1786 31 H -0.3834 -0.3371 -1.4443 H 1 UNL1 0.1565 32 H -0.1618 1.4052 -1.2242 H 1 UNL1 0.1610 33 H 1.9987 2.2757 -0.4424 H 1 UNL1 0.1662 34 H 4.2663 3.1163 -0.0685 H 1 UNL1 0.1521 35 H 6.6753 2.6850 0.3786 H 1 UNL1 0.1499 36 H 7.5095 0.3713 0.5776 H 1 UNL1 0.1472 37 H 5.9512 -1.5507 0.3343 H 1 UNL1 0.1525 38 H 3.6930 -2.4030 -0.0679 H 1 UNL1 0.1673 39 H 2.1078 -3.7104 -1.2033 H 1 UNL1 0.1356 40 H 1.7766 -3.6281 0.5748 H 1 UNL1 0.1389 41 H 0.4348 -3.9529 -0.5786 H 1 UNL1 0.1469 @BOND 1 31 13 1 2 32 13 1 3 39 25 1 4 13 14 1 5 13 12 1 6 41 25 1 7 24 25 1 8 24 23 1 9 14 23 ar 10 14 15 ar 11 7 6 2 12 33 15 1 13 25 40 1 14 23 22 ar 15 15 16 ar 16 1 26 1 17 1 2 1 18 28 8 1 19 6 8 ar 20 6 5 ar 21 22 38 1 22 22 21 ar 23 16 21 ar 24 16 17 ar 25 27 5 1 26 8 9 ar 27 34 17 1 28 21 20 ar 29 5 4 ar 30 17 18 ar 31 9 10 2 32 9 11 ar 33 20 37 1 34 20 19 ar 35 18 35 1 36 18 19 ar 37 4 11 ar 38 4 2 1 39 11 12 1 40 19 36 1 41 2 3 2 42 12 30 1 43 12 29 1