@MOLECULE 2-(4-biphenylyl)-5-chloro-3-methyl-4-quinolinecarboxylic acid 43 46 0 0 0 SMALL GASTEIGER @ATOM 1 CL -5.6421 0.4980 -0.0241 Cl 1 UNL111111111111 -0.0544 2 O -3.5864 2.3721 -1.3127 O.3 1 UNL111111111111 -0.5371 3 O -3.6860 2.6873 0.8987 O.2 1 UNL111111111111 -0.4679 4 N -0.9181 -1.5172 0.0903 N.ar 1 UNL111111111111 -0.3508 5 C -1.1684 0.8915 -0.0194 C.ar 1 UNL111111111111 0.0143 6 C -0.3838 -0.3124 0.0331 C.ar 1 UNL111111111111 0.1683 7 C -2.5381 0.7590 -0.0072 C.ar 1 UNL111111111111 -0.0943 8 C -3.1498 -0.5233 0.0434 C.ar 1 UNL111111111111 -0.0685 9 C 1.0895 -0.2323 0.0265 C.ar 1 UNL111111111111 -0.0236 10 C -2.2853 -1.6515 0.0968 C.ar 1 UNL111111111111 0.1495 11 C -0.5199 2.2254 -0.0820 C.3 1 UNL111111111111 -0.4591 12 C 3.8521 -0.0912 0.0099 C.ar 1 UNL111111111111 -0.0042 13 C 1.7780 -0.1384 1.2350 C.ar 1 UNL111111111111 -0.1245 14 C 1.7660 -0.2501 -1.1931 C.ar 1 UNL111111111111 -0.1247 15 C -4.5382 -0.7997 0.0528 C.ar 1 UNL111111111111 0.0156 16 C -2.8116 -2.9739 0.1626 C.ar 1 UNL111111111111 -0.1354 17 C 3.1666 -0.0600 1.2261 C.ar 1 UNL111111111111 -0.1569 18 C 3.1550 -0.1798 -1.1978 C.ar 1 UNL111111111111 -0.1573 19 C 5.3152 -0.0354 0.0018 C.ar 1 UNL111111111111 -0.0217 20 C -3.3387 2.0069 -0.0282 C.2 1 UNL111111111111 0.6420 21 C -5.0475 -2.0689 0.1210 C.ar 1 UNL111111111111 -0.1601 22 C -4.1657 -3.1755 0.1770 C.ar 1 UNL111111111111 -0.1268 23 C 5.9697 1.0436 0.5990 C.ar 1 UNL111111111111 -0.1561 24 C 6.0439 -1.0630 -0.6024 C.ar 1 UNL111111111111 -0.1536 25 C 7.3604 1.0958 0.5856 C.ar 1 UNL111111111111 -0.1417 26 C 7.4347 -1.0040 -0.6122 C.ar 1 UNL111111111111 -0.1410 27 C 8.0908 0.0732 -0.0181 C.ar 1 UNL111111111111 -0.1494 28 H -0.8451 2.8711 0.7531 H 1 UNL111111111111 0.1800 29 H 0.5791 2.1901 -0.0364 H 1 UNL111111111111 0.1747 30 H -0.7707 2.7485 -1.0214 H 1 UNL111111111111 0.1784 31 H 1.2329 -0.1393 2.1782 H 1 UNL111111111111 0.1631 32 H 1.2126 -0.3259 -2.1260 H 1 UNL111111111111 0.1621 33 H -2.1041 -3.8040 0.1966 H 1 UNL111111111111 0.1824 34 H 3.7195 0.0108 2.1622 H 1 UNL111111111111 0.1608 35 H 3.7000 -0.1941 -2.1407 H 1 UNL111111111111 0.1600 36 H -6.1230 -2.2542 0.1384 H 1 UNL111111111111 0.1769 37 H -4.5820 -4.1816 0.2264 H 1 UNL111111111111 0.1625 38 H 5.3919 1.8404 1.0645 H 1 UNL111111111111 0.1561 39 H 5.5274 -1.9074 -1.0570 H 1 UNL111111111111 0.1583 40 H 7.8755 1.9367 1.0449 H 1 UNL111111111111 0.1503 41 H 8.0073 -1.8012 -1.0819 H 1 UNL111111111111 0.1508 42 H 9.1772 0.1159 -0.0229 H 1 UNL111111111111 0.1488 43 H -4.1521 3.1823 -1.3902 H 1 UNL111111111111 0.3543 @BOND 1 1 15 1 2 2 20 1 3 2 43 1 4 3 20 2 5 4 6 ar 6 4 10 ar 7 5 6 ar 8 5 7 ar 9 5 11 1 10 6 9 1 11 7 8 ar 12 7 20 1 13 8 10 ar 14 8 15 ar 15 9 13 ar 16 9 14 ar 17 10 16 ar 18 11 28 1 19 11 29 1 20 11 30 1 21 12 17 ar 22 12 18 ar 23 12 19 1 24 13 17 ar 25 13 31 1 26 14 18 ar 27 14 32 1 28 15 21 ar 29 16 22 ar 30 16 33 1 31 17 34 1 32 18 35 1 33 19 23 ar 34 19 24 ar 35 21 22 ar 36 21 36 1 37 22 37 1 38 23 25 ar 39 23 38 1 40 24 26 ar 41 24 39 1 42 25 27 ar 43 25 40 1 44 26 27 ar 45 26 41 1 46 27 42 1