@MOLECULE n-(2-aminoethyl)-n~2~-[(1s)-2,2,2-trifluoro-1-(4'-sulfamoyl-4-biphenylyl)ethyl]-l-leucinamide 62 63 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.7783 -0.4498 0.0467 C.ar 1 UNL1111111111 0.0279 2 C 0.4663 -0.3022 0.9469 C.ar 1 UNL1111111111 -0.1615 3 C 1.3569 -0.8150 0.0013 C.ar 1 UNL1111111111 -0.0228 4 C 0.8986 -1.6839 -0.9919 C.ar 1 UNL1111111111 -0.1548 5 C -0.4477 -2.0314 -1.0443 C.ar 1 UNL1111111111 -0.1323 6 C -0.8806 -0.6481 0.8921 C.ar 1 UNL1111111111 -0.1117 7 C -1.3398 -1.5080 -0.1068 C.ar 1 UNL1111111111 -0.0456 8 C -2.8008 -1.8781 -0.1997 C.3 1 UNL1111111111 -0.0110 9 C -3.1135 -2.9157 0.9197 C.3 1 UNL1111111111 0.5214 10 F -2.2816 -3.9559 0.8925 F 1 UNL1111111111 -0.2029 11 F -3.0503 -2.4580 2.1633 F 1 UNL1111111111 -0.1809 12 F -4.3266 -3.4590 0.8151 F 1 UNL1111111111 -0.2100 13 N -3.3387 2.3367 0.5266 N.am 1 UNL1111111111 -0.5878 14 C -3.9258 3.4831 1.2225 C.3 1 UNL1111111111 -0.0692 15 N -3.6627 -0.6955 0.0169 N.3 1 UNL1111111111 -0.5509 16 C -3.4172 0.3771 -0.9708 C.3 1 UNL1111111111 -0.0318 17 C -3.9748 0.1006 -2.3768 C.3 1 UNL1111111111 -0.3344 18 C -3.1178 0.7265 -3.4944 C.3 1 UNL1111111111 -0.0542 19 C -1.7722 0.0052 -3.6358 C.3 1 UNL1111111111 -0.4599 20 C -2.9029 2.2244 -3.2597 C.3 1 UNL1111111111 -0.4636 21 C -4.1055 1.6193 -0.3666 C.2 1 UNL1111111111 0.5707 22 O -5.2204 1.9761 -0.6822 O.2 1 UNL1111111111 -0.5353 23 C 3.5534 -0.7936 1.1567 C.ar 1 UNL1111111111 -0.1889 24 C 4.9074 -0.4683 1.1852 C.ar 1 UNL1111111111 -0.0536 25 C 5.4825 0.2066 0.1097 C.ar 1 UNL1111111111 -0.3752 26 C 4.7099 0.5554 -0.9971 C.ar 1 UNL1111111111 -0.0575 27 C 3.3570 0.2271 -1.0302 C.ar 1 UNL1111111111 -0.1917 28 S 7.1941 0.5917 0.1334 S.O2 1 UNL1111111111 2.3462 29 N 7.2788 2.1050 0.9836 N.3 1 UNL1111111111 -0.9442 30 O 7.8733 -0.3634 0.9760 O.2 1 UNL1111111111 -0.9099 31 O 7.6204 0.8778 -1.2162 O.2 1 UNL1111111111 -0.9136 32 C -4.7221 3.0192 2.4704 C.3 1 UNL1111111111 -0.1352 33 N -5.1436 4.2340 3.1985 N.3 1 UNL1111111111 -0.6485 34 H 0.8276 0.3674 1.7258 H 1 UNL1111111111 0.1595 35 H 1.5983 -2.0944 -1.7192 H 1 UNL1111111111 0.1616 36 H -0.7954 -2.7148 -1.8188 H 1 UNL1111111111 0.1585 37 H -1.5799 -0.2479 1.6301 H 1 UNL1111111111 0.1760 38 H -3.0075 -2.3691 -1.1950 H 1 UNL1111111111 0.1593 39 H -2.4948 1.9469 0.9140 H 1 UNL1111111111 0.3110 40 H -4.5973 4.0391 0.5273 H 1 UNL1111111111 0.1629 41 H -3.1164 4.1851 1.5234 H 1 UNL1111111111 0.1539 42 H -4.6557 -0.9499 0.0337 H 1 UNL1111111111 0.2865 43 H -2.3102 0.5583 -1.0392 H 1 UNL1111111111 0.1703 44 H -5.0141 0.4918 -2.4549 H 1 UNL1111111111 0.1783 45 H -4.0627 -0.9868 -2.5521 H 1 UNL1111111111 0.1417 46 H -3.6822 0.6021 -4.4544 H 1 UNL1111111111 0.1346 47 H -1.1733 0.4489 -4.4394 H 1 UNL1111111111 0.1466 48 H -1.9080 -1.0540 -3.8758 H 1 UNL1111111111 0.1395 49 H -1.1741 0.0645 -2.7198 H 1 UNL1111111111 0.1454 50 H -2.2090 2.4193 -2.4358 H 1 UNL1111111111 0.1436 51 H -2.4944 2.7123 -4.1510 H 1 UNL1111111111 0.1456 52 H -3.8490 2.7263 -3.0126 H 1 UNL1111111111 0.1624 53 H 3.1003 -1.3254 1.9919 H 1 UNL1111111111 0.1627 54 H 5.5082 -0.7617 2.0542 H 1 UNL1111111111 0.1733 55 H 5.1544 1.0755 -1.8542 H 1 UNL1111111111 0.1755 56 H 2.7498 0.4953 -1.8928 H 1 UNL1111111111 0.1598 57 H 7.7349 2.0923 1.8811 H 1 UNL1111111111 0.2945 58 H 7.5747 2.9055 0.4495 H 1 UNL1111111111 0.2946 59 H -4.0740 2.4078 3.1330 H 1 UNL1111111111 0.1416 60 H -5.5692 2.3729 2.1544 H 1 UNL1111111111 0.1324 61 H -5.4612 4.0225 4.1297 H 1 UNL1111111111 0.2509 62 H -5.8744 4.7277 2.7113 H 1 UNL1111111111 0.2503 @BOND 1 1 3 1 2 1 23 ar 3 1 27 ar 4 2 6 ar 5 2 3 ar 6 2 34 1 7 3 4 ar 8 4 5 ar 9 4 35 1 10 5 7 ar 11 5 36 1 12 6 7 ar 13 6 37 1 14 7 8 1 15 8 9 1 16 8 15 1 17 8 38 1 18 9 10 1 19 9 12 1 20 9 11 1 21 13 14 1 22 13 21 am 23 13 39 1 24 14 32 1 25 14 40 1 26 14 41 1 27 15 16 1 28 15 42 1 29 16 21 1 30 16 17 1 31 16 43 1 32 17 18 1 33 17 44 1 34 17 45 1 35 18 19 1 36 18 20 1 37 18 46 1 38 19 47 1 39 19 48 1 40 19 49 1 41 20 50 1 42 20 51 1 43 20 52 1 44 21 22 2 45 23 24 ar 46 23 53 1 47 24 25 ar 48 24 54 1 49 25 26 ar 50 25 28 1 51 26 27 ar 52 26 55 1 53 27 56 1 54 28 31 2 55 28 30 2 56 28 29 1 57 29 57 1 58 29 58 1 59 32 33 1 60 32 59 1 61 32 60 1 62 33 61 1 63 33 62 1