@MOLECULE 5-{[7-(benzyloxy)-3-quinolinyl]methyl}-1,3-thiazolidine-2,4-dione 42 45 0 0 0 SMALL GASTEIGER @ATOM 1 S -4.3344 -1.1457 0.7637 S.3 1 UNL111111111 0.0372 2 O 3.8827 0.1226 -0.1138 O.3 1 UNL111111111 -0.3092 3 O -6.6058 1.8702 -0.1532 O.2 1 UNL111111111 -0.4353 4 O -6.6345 -2.5864 0.7790 O.2 1 UNL111111111 -0.4027 5 N -6.8036 -0.3501 0.3028 N.am 1 UNL111111111 -0.6499 6 N -0.3891 2.0028 0.3322 N.ar 1 UNL111111111 -0.3765 7 C -3.8084 1.0556 -0.8985 C.3 1 UNL111111111 -0.2601 8 C -4.5779 0.6400 0.3533 C.3 1 UNL111111111 -0.2539 9 C -2.3355 0.9688 -0.6732 C.ar 1 UNL111111111 -0.1314 10 C -0.1742 -0.0726 -0.9382 C.ar 1 UNL111111111 -0.1587 11 C -1.5739 -0.0523 -1.1802 C.ar 1 UNL111111111 -0.0687 12 C -6.0635 0.8366 0.1349 C.2 1 UNL111111111 0.5714 13 C 0.3931 0.9827 -0.1724 C.ar 1 UNL111111111 0.2106 14 C -1.6831 1.9918 0.0901 C.ar 1 UNL111111111 0.0718 15 C 0.6716 -1.0971 -1.4318 C.ar 1 UNL111111111 -0.0662 16 C 1.7828 1.0066 0.0849 C.ar 1 UNL111111111 -0.2743 17 C 2.5693 -0.0128 -0.4207 C.ar 1 UNL111111111 0.2659 18 C -6.1067 -1.5253 0.6270 C.2 1 UNL111111111 0.5188 19 C 2.0210 -1.0765 -1.1832 C.ar 1 UNL111111111 -0.2753 20 C 4.7783 -0.9023 -0.5648 C.3 1 UNL111111111 -0.0604 21 C 6.1110 -0.5013 -0.0076 C.ar 1 UNL111111111 -0.0288 22 C 7.2712 -0.7835 -0.7303 C.ar 1 UNL111111111 -0.1668 23 C 6.1902 0.1369 1.2302 C.ar 1 UNL111111111 -0.1335 24 C 8.5132 -0.4304 -0.2080 C.ar 1 UNL111111111 -0.1422 25 C 7.4350 0.4962 1.7436 C.ar 1 UNL111111111 -0.1458 26 C 8.5960 0.2108 1.0274 C.ar 1 UNL111111111 -0.1478 27 H -4.0952 2.1010 -1.1753 H 1 UNL111111111 0.1801 28 H -4.1148 0.4519 -1.7813 H 1 UNL111111111 0.1679 29 H -4.2453 1.2535 1.2296 H 1 UNL111111111 0.2011 30 H -2.0168 -0.8555 -1.7706 H 1 UNL111111111 0.1632 31 H -2.2665 2.8255 0.5046 H 1 UNL111111111 0.1738 32 H 0.2286 -1.9055 -2.0157 H 1 UNL111111111 0.1561 33 H 2.2103 1.8222 0.6684 H 1 UNL111111111 0.2002 34 H -7.8139 -0.3530 0.1839 H 1 UNL111111111 0.3442 35 H 2.6608 -1.8650 -1.5682 H 1 UNL111111111 0.1680 36 H 4.7687 -0.9242 -1.6707 H 1 UNL111111111 0.1409 37 H 4.4543 -1.8812 -0.1600 H 1 UNL111111111 0.1431 38 H 7.2115 -1.2752 -1.6986 H 1 UNL111111111 0.1503 39 H 5.2810 0.3600 1.7907 H 1 UNL111111111 0.1693 40 H 9.4200 -0.6520 -0.7672 H 1 UNL111111111 0.1499 41 H 7.4993 1.0003 2.7062 H 1 UNL111111111 0.1525 42 H 9.5674 0.4895 1.4310 H 1 UNL111111111 0.1507 @BOND 1 1 8 1 2 1 18 1 3 2 17 1 4 2 20 1 5 3 12 2 6 4 18 2 7 5 12 am 8 5 18 am 9 5 34 1 10 6 13 ar 11 6 14 ar 12 7 8 1 13 7 9 1 14 7 27 1 15 7 28 1 16 8 12 1 17 8 29 1 18 9 11 ar 19 9 14 ar 20 10 11 ar 21 10 13 ar 22 10 15 ar 23 11 30 1 24 13 16 ar 25 14 31 1 26 15 19 ar 27 15 32 1 28 16 17 ar 29 16 33 1 30 17 19 ar 31 19 35 1 32 20 21 1 33 20 36 1 34 20 37 1 35 21 22 ar 36 21 23 ar 37 22 24 ar 38 22 38 1 39 23 25 ar 40 23 39 1 41 24 26 ar 42 24 40 1 43 25 26 ar 44 25 41 1 45 26 42 1