@MOLECULE n-[(1r)-2-[(2-methyl-2-propanyl)amino]-2-oxo-1-(3-pyridinyl)ethyl]-n-[4-(2-methyl-2-propanyl)phenyl]-2-furamide 63 65 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.3929 -3.2449 0.1196 O.2 1 UNL1111111111 -0.4520 2 C -1.0003 -2.2770 -0.2864 C.2 1 UNL1111111111 0.5890 3 C -2.4627 -2.3209 -0.4181 C.ar 1 UNL1111111111 -0.0154 4 C -3.3953 -3.0645 0.2561 C.ar 1 UNL1111111111 -0.1361 5 C -4.6780 -2.6863 -0.2791 C.ar 1 UNL1111111111 -0.2449 6 C -4.4308 -1.7492 -1.2451 C.ar 1 UNL1111111111 0.0006 7 O -3.0785 -1.5053 -1.3547 O.2 1 UNL1111111111 -0.1834 8 N -0.2898 -1.1402 -0.6966 N.am 1 UNL1111111111 -0.4742 9 C 1.0809 -1.0586 -0.2545 C.ar 1 UNL1111111111 0.1578 10 C 2.0878 -1.1511 -1.2197 C.ar 1 UNL1111111111 -0.1515 11 C 3.4091 -0.9646 -0.8328 C.ar 1 UNL1111111111 -0.1778 12 C 3.7403 -0.6999 0.5023 C.ar 1 UNL1111111111 -0.0038 13 C 5.1883 -0.4168 0.8524 C.3 1 UNL1111111111 0.1186 14 C 5.6006 0.8841 0.1368 C.3 1 UNL1111111111 -0.4622 15 C 5.4124 -0.2317 2.3628 C.3 1 UNL1111111111 -0.4617 16 C 6.0678 -1.5878 0.3778 C.3 1 UNL1111111111 -0.4589 17 C 2.7244 -0.6749 1.4593 C.ar 1 UNL1111111111 -0.1647 18 C 1.3947 -0.8562 1.0905 C.ar 1 UNL1111111111 -0.1610 19 C -0.9569 0.1561 -0.8940 C.3 1 UNL1111111111 -0.0016 20 C -1.7629 0.5636 0.3678 C.2 1 UNL1111111111 0.5440 21 N -2.7186 1.5250 0.1612 N.am 1 UNL1111111111 -0.6254 22 C -3.5677 2.0358 1.2683 C.3 1 UNL1111111111 0.3438 23 C -2.6795 2.6982 2.3329 C.3 1 UNL1111111111 -0.4885 24 C -4.5295 3.0769 0.6622 C.3 1 UNL1111111111 -0.4969 25 C -4.3694 0.8761 1.8783 C.3 1 UNL1111111111 -0.4921 26 O -1.5448 0.0607 1.4493 O.2 1 UNL1111111111 -0.5267 27 C 0.0420 1.2388 -1.2036 C.ar 1 UNL1111111111 -0.1426 28 C 0.4084 1.4964 -2.5247 C.ar 1 UNL1111111111 -0.0643 29 C 1.3632 2.4763 -2.7864 C.ar 1 UNL1111111111 -0.2476 30 C 1.9236 3.1722 -1.7082 C.ar 1 UNL1111111111 0.0646 31 N 1.5720 2.9341 -0.4299 N.ar 1 UNL1111111111 -0.3683 32 C 0.6571 1.9834 -0.1807 C.ar 1 UNL1111111111 0.0738 33 H -3.2239 -3.7880 1.0304 H 1 UNL1111111111 0.1843 34 H -5.6183 -3.0845 0.0383 H 1 UNL1111111111 0.1719 35 H -5.0171 -1.1777 -1.9252 H 1 UNL1111111111 0.1680 36 H 1.8330 -1.3579 -2.2568 H 1 UNL1111111111 0.1628 37 H 4.1931 -1.0179 -1.5861 H 1 UNL1111111111 0.1517 38 H 4.9486 1.7156 0.4319 H 1 UNL1111111111 0.1548 39 H 6.6295 1.1631 0.3809 H 1 UNL1111111111 0.1428 40 H 5.5327 0.7880 -0.9509 H 1 UNL1111111111 0.1434 41 H 5.1162 -1.1250 2.9237 H 1 UNL1111111111 0.1492 42 H 6.4691 -0.0459 2.5824 H 1 UNL1111111111 0.1419 43 H 4.8482 0.6233 2.7519 H 1 UNL1111111111 0.1497 44 H 6.0459 -1.7018 -0.7103 H 1 UNL1111111111 0.1448 45 H 7.1126 -1.4418 0.6689 H 1 UNL1111111111 0.1419 46 H 5.7275 -2.5342 0.8145 H 1 UNL1111111111 0.1527 47 H 2.9522 -0.5040 2.5102 H 1 UNL1111111111 0.1602 48 H 0.5999 -0.8345 1.8411 H 1 UNL1111111111 0.1881 49 H -1.6612 0.0362 -1.7677 H 1 UNL1111111111 0.1766 50 H -2.8510 1.9418 -0.7449 H 1 UNL1111111111 0.3111 51 H -2.0692 3.5030 1.9104 H 1 UNL1111111111 0.1530 52 H -3.2809 3.1192 3.1433 H 1 UNL1111111111 0.1483 53 H -1.9916 1.9646 2.7823 H 1 UNL1111111111 0.1818 54 H -5.1757 2.6365 -0.1041 H 1 UNL1111111111 0.1501 55 H -5.1848 3.4893 1.4378 H 1 UNL1111111111 0.1592 56 H -3.9902 3.9192 0.2158 H 1 UNL1111111111 0.1536 57 H -3.6998 0.1349 2.3439 H 1 UNL1111111111 0.1852 58 H -5.0535 1.2302 2.6535 H 1 UNL1111111111 0.1468 59 H -4.9560 0.3456 1.1222 H 1 UNL1111111111 0.1499 60 H -0.0342 0.9270 -3.3429 H 1 UNL1111111111 0.1624 61 H 1.6747 2.6926 -3.8034 H 1 UNL1111111111 0.1636 62 H 2.6829 3.9487 -1.8539 H 1 UNL1111111111 0.1683 63 H 0.4250 1.8094 0.8816 H 1 UNL1111111111 0.1915 @BOND 1 1 2 2 2 2 3 1 3 2 8 am 4 3 4 ar 5 4 33 1 6 5 4 ar 7 5 34 1 8 6 5 ar 9 6 35 1 10 7 6 ar 11 7 3 ar 12 8 9 1 13 9 10 ar 14 10 11 ar 15 10 36 1 16 11 37 1 17 12 11 ar 18 12 13 1 19 13 14 1 20 13 15 1 21 14 38 1 22 14 39 1 23 14 40 1 24 15 41 1 25 15 42 1 26 15 43 1 27 16 13 1 28 16 44 1 29 16 45 1 30 16 46 1 31 17 12 ar 32 17 47 1 33 18 9 ar 34 18 17 ar 35 18 48 1 36 19 8 1 37 19 20 1 38 19 49 1 39 20 26 2 40 21 20 am 41 21 22 1 42 21 50 1 43 22 23 1 44 23 51 1 45 23 52 1 46 23 53 1 47 24 22 1 48 24 54 1 49 24 55 1 50 24 56 1 51 25 22 1 52 25 57 1 53 25 58 1 54 25 59 1 55 27 19 1 56 27 32 ar 57 28 27 ar 58 28 60 1 59 29 28 ar 60 29 30 ar 61 29 61 1 62 30 31 ar 63 30 62 1 64 31 32 ar 65 32 63 1