@MOLECULE n~4~-(2-tert-butyl-6-methoxyquinolin-8-yl)pentane-1,4-diamine 52 53 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.5033 4.1852 0.5195 O.3 1 UNL1111111111 -0.3131 2 N 1.1700 -0.4837 -0.8392 N.pl3 1 UNL1111111111 -0.5178 3 N -1.4982 -0.3770 -0.2069 N.ar 1 UNL1111111111 -0.3870 4 N 3.5310 -3.7252 2.5193 N.3 1 UNL1111111111 -0.6397 5 C -3.6575 -1.5251 -0.3037 C.3 1 UNL1111111111 0.1198 6 C 2.5344 -0.6505 -1.3509 C.3 1 UNL1111111111 0.1225 7 C 3.0635 -2.0357 -0.9104 C.3 1 UNL1111111111 -0.3029 8 C -2.7728 -0.3680 0.1419 C.ar 1 UNL1111111111 0.1416 9 C 0.6746 0.6973 -0.3615 C.ar 1 UNL1111111111 0.3289 10 C -0.7160 0.7160 0.0693 C.ar 1 UNL1111111111 -0.0192 11 C 3.1538 -2.1220 0.6135 C.3 1 UNL1111111111 -0.3204 12 C -2.8162 -2.7197 -0.7755 C.3 1 UNL1111111111 -0.4444 13 C -4.5570 -1.9788 0.8566 C.3 1 UNL1111111111 -0.4635 14 C -4.5125 -1.0094 -1.4758 C.3 1 UNL1111111111 -0.4600 15 C -1.2258 1.8659 0.7149 C.ar 1 UNL1111111111 0.0609 16 C 2.5340 -0.5561 -2.8846 C.3 1 UNL1111111111 -0.4866 17 C -3.3534 0.7298 0.8585 C.ar 1 UNL1111111111 -0.2036 18 C -2.5853 1.8191 1.1528 C.ar 1 UNL1111111111 -0.1317 19 C 1.4291 1.8632 -0.2367 C.ar 1 UNL1111111111 -0.4767 20 C 3.5187 -3.5516 1.0553 C.3 1 UNL1111111111 -0.1047 21 C -0.4331 3.0167 0.8690 C.ar 1 UNL1111111111 -0.3810 22 C 0.8562 3.0000 0.3622 C.ar 1 UNL1111111111 0.3436 23 C 2.7128 4.3666 -0.2001 C.3 1 UNL1111111111 -0.1998 24 H 3.1969 0.1465 -0.9225 H 1 UNL1111111111 0.1440 25 H 4.0582 -2.2094 -1.3614 H 1 UNL1111111111 0.1430 26 H 2.4092 -2.8362 -1.3046 H 1 UNL1111111111 0.1471 27 H 0.5201 -1.2487 -0.9974 H 1 UNL1111111111 0.3352 28 H 3.8969 -1.3988 0.9936 H 1 UNL1111111111 0.1390 29 H 2.1861 -1.8248 1.0686 H 1 UNL1111111111 0.1622 30 H -2.1839 -2.4431 -1.6288 H 1 UNL1111111111 0.1552 31 H -3.4458 -3.5606 -1.0788 H 1 UNL1111111111 0.1378 32 H -2.1427 -3.0637 0.0182 H 1 UNL1111111111 0.1523 33 H -5.3199 -1.2343 1.1095 H 1 UNL1111111111 0.1438 34 H -5.0843 -2.9067 0.6056 H 1 UNL1111111111 0.1485 35 H -3.9654 -2.1740 1.7602 H 1 UNL1111111111 0.1525 36 H -5.1337 -1.8079 -1.8924 H 1 UNL1111111111 0.1470 37 H -5.1775 -0.1965 -1.1675 H 1 UNL1111111111 0.1453 38 H -3.8774 -0.6272 -2.2846 H 1 UNL1111111111 0.1547 39 H 3.5511 -0.5703 -3.2861 H 1 UNL1111111111 0.1479 40 H 2.0548 0.3728 -3.2185 H 1 UNL1111111111 0.1627 41 H 1.9824 -1.3849 -3.3414 H 1 UNL1111111111 0.1539 42 H -4.3977 0.6777 1.1497 H 1 UNL1111111111 0.1617 43 H -2.9816 2.6719 1.7017 H 1 UNL1111111111 0.1635 44 H 2.4508 1.8957 -0.5891 H 1 UNL1111111111 0.1720 45 H 4.5174 -3.8412 0.6637 H 1 UNL1111111111 0.1364 46 H 2.7937 -4.2825 0.6323 H 1 UNL1111111111 0.1428 47 H -0.8293 3.9026 1.3498 H 1 UNL1111111111 0.1789 48 H 4.2256 -3.1475 2.9623 H 1 UNL1111111111 0.2448 49 H 2.6334 -3.5190 2.9285 H 1 UNL1111111111 0.2498 50 H 2.9676 5.4097 0.0340 H 1 UNL1111111111 0.1472 51 H 3.4916 3.6904 0.1640 H 1 UNL1111111111 0.1311 52 H 2.5455 4.2444 -1.2747 H 1 UNL1111111111 0.1345 @BOND 1 1 22 1 2 1 23 1 3 2 6 1 4 2 9 1 5 2 27 1 6 3 8 ar 7 3 10 ar 8 4 20 1 9 4 48 1 10 4 49 1 11 5 8 1 12 5 12 1 13 5 13 1 14 5 14 1 15 6 7 1 16 6 16 1 17 6 24 1 18 7 11 1 19 7 25 1 20 7 26 1 21 8 17 ar 22 9 10 ar 23 9 19 ar 24 10 15 ar 25 11 20 1 26 11 28 1 27 11 29 1 28 12 30 1 29 12 31 1 30 12 32 1 31 13 33 1 32 13 34 1 33 13 35 1 34 14 36 1 35 14 37 1 36 14 38 1 37 15 18 ar 38 15 21 ar 39 16 39 1 40 16 40 1 41 16 41 1 42 17 18 ar 43 17 42 1 44 18 43 1 45 19 22 ar 46 19 44 1 47 20 45 1 48 20 46 1 49 21 22 ar 50 21 47 1 51 23 50 1 52 23 51 1 53 23 52 1