@MOLECULE methyl 7-(diethylamino)-4-hydroxy-6-propyl-3-quinolinecarboxylate 47 48 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.5057 -1.6979 -0.5554 O.2 1 UNL1 -0.4486 2 O 4.8597 -0.8688 0.2830 O.3 1 UNL1 -0.3297 3 O 5.2294 1.2942 -0.2132 O.2 1 UNL1 -0.5563 4 N -3.4862 0.4959 0.0498 N.pl3 1 UNL1 -0.4723 5 N 1.1567 2.0227 0.4356 N.ar 1 UNL1 -0.4140 6 C -2.0734 0.2773 -0.0247 C.ar 1 UNL1 0.2445 7 C -1.6309 -1.0266 -0.3568 C.ar 1 UNL1 -0.0803 8 C -2.5892 -2.1526 -0.5901 C.3 1 UNL1 -0.2592 9 C 0.6748 -0.2854 -0.1536 C.ar 1 UNL1 -0.2269 10 C 0.2265 0.9984 0.1802 C.ar 1 UNL1 0.2171 11 C -1.1449 1.2822 0.2497 C.ar 1 UNL1 -0.3493 12 C -0.2679 -1.2842 -0.4159 C.ar 1 UNL1 -0.0531 13 C -4.0860 0.9363 -1.2245 C.3 1 UNL1 -0.0540 14 C -3.9624 1.1739 1.2677 C.3 1 UNL1 -0.0658 15 C -2.8694 -2.8714 0.7422 C.3 1 UNL1 -0.2329 16 C 2.1199 -0.5966 -0.2382 C.ar 1 UNL1 0.5125 17 C -3.3969 2.1149 -1.9239 C.3 1 UNL1 -0.4872 18 C -4.0145 2.7062 1.2710 C.3 1 UNL1 -0.4802 19 C 2.9983 0.5320 0.0603 C.ar 1 UNL1 -0.4090 20 C -3.8824 -3.9977 0.5466 C.3 1 UNL1 -0.4404 21 C 2.5009 1.7714 0.3581 C.ar 1 UNL1 0.1887 22 C 4.4522 0.3900 0.0074 C.2 1 UNL1 0.6279 23 C 6.2665 -1.0862 0.1979 C.3 1 UNL1 -0.1887 24 H -3.5451 -1.7865 -1.0171 H 1 UNL1 0.1556 25 H -2.1872 -2.8694 -1.3331 H 1 UNL1 0.1459 26 H -1.4871 2.2806 0.5033 H 1 UNL1 0.1675 27 H 0.0955 -2.2894 -0.6661 H 1 UNL1 0.1865 28 H -4.0705 0.0494 -1.9043 H 1 UNL1 0.1427 29 H -5.1569 1.1724 -1.0383 H 1 UNL1 0.1389 30 H -4.9915 0.7744 1.4473 H 1 UNL1 0.1436 31 H -3.3409 0.8182 2.1220 H 1 UNL1 0.1419 32 H -1.9268 -3.2690 1.1631 H 1 UNL1 0.1387 33 H -3.2518 -2.1403 1.4810 H 1 UNL1 0.1410 34 H 0.8155 2.9460 0.6620 H 1 UNL1 0.3182 35 H -3.3950 3.0172 -1.3060 H 1 UNL1 0.1479 36 H -2.3522 1.8812 -2.1655 H 1 UNL1 0.1584 37 H -3.9027 2.3579 -2.8650 H 1 UNL1 0.1520 38 H -3.0311 3.1560 1.1065 H 1 UNL1 0.1427 39 H -4.6907 3.0891 0.4985 H 1 UNL1 0.1521 40 H -4.3831 3.0739 2.2365 H 1 UNL1 0.1516 41 H -4.8381 -3.6142 0.1717 H 1 UNL1 0.1416 42 H -3.5212 -4.7446 -0.1686 H 1 UNL1 0.1408 43 H -4.0850 -4.5161 1.4900 H 1 UNL1 0.1381 44 H 3.1701 2.6287 0.5520 H 1 UNL1 0.1845 45 H 6.8089 -0.3974 0.8535 H 1 UNL1 0.1390 46 H 6.5995 -0.9681 -0.8387 H 1 UNL1 0.1402 47 H 6.3675 -2.1256 0.5324 H 1 UNL1 0.1480 @BOND 1 37 17 1 2 36 17 1 3 17 35 1 4 17 13 1 5 28 13 1 6 25 8 1 7 13 29 1 8 13 4 1 9 24 8 1 10 46 23 1 11 27 12 1 12 8 7 1 13 8 15 1 14 1 16 2 15 12 7 ar 16 12 9 ar 17 7 6 ar 18 16 9 ar 19 16 19 ar 20 3 22 2 21 42 20 1 22 9 10 ar 23 6 4 1 24 6 11 ar 25 22 19 1 26 22 2 1 27 4 14 1 28 19 21 ar 29 41 20 1 30 10 11 ar 31 10 5 ar 32 23 2 1 33 23 47 1 34 23 45 1 35 11 26 1 36 21 5 ar 37 21 44 1 38 5 34 1 39 39 18 1 40 20 15 1 41 20 43 1 42 15 32 1 43 15 33 1 44 38 18 1 45 14 18 1 46 14 30 1 47 14 31 1 48 18 40 1