@MOLECULE n~2~-(3-aminobenzyl)-n~2~-[(4-fluoro-3-methylphenyl)sulfonyl]-n-hydroxy-d-alaninamide 46 47 0 0 0 SMALL GASTEIGER @ATOM 1 C 5.0666 0.3172 -0.8050 C.ar 1 UNL111111111 0.2521 2 C 3.7450 -0.1010 -1.0360 C.ar 1 UNL111111111 -0.3185 3 C 5.3189 1.5450 -0.1651 C.ar 1 UNL111111111 -0.2963 4 C 4.2451 2.3255 0.2423 C.ar 1 UNL111111111 -0.0729 5 C 2.9317 1.9062 0.0304 C.ar 1 UNL111111111 -0.2490 6 C 2.6822 0.6863 -0.5950 C.ar 1 UNL111111111 0.0422 7 C 1.2712 0.2202 -0.8930 C.3 1 UNL111111111 -0.0677 8 N 0.4187 -0.1637 0.2424 N.3 1 UNL111111111 -0.7866 9 C 0.7771 -1.3771 0.9819 C.3 1 UNL111111111 0.0612 10 C 2.2424 -1.5502 1.3738 C.3 1 UNL111111111 -0.4785 11 C 0.3793 -2.5444 0.0465 C.2 1 UNL111111111 0.5190 12 N -0.7621 -3.2557 0.4485 N.am 1 UNL111111111 -0.4036 13 O -1.3020 -4.1145 -0.5166 O.3 1 UNL111111111 -0.3015 14 O 1.0428 -2.9359 -0.8851 O.2 1 UNL111111111 -0.5107 15 S -0.4887 1.0704 1.0873 S.O2 1 UNL111111111 2.3615 16 O -0.4599 0.7127 2.4860 O.2 1 UNL111111111 -0.9109 17 O -0.0577 2.3548 0.5949 O.2 1 UNL111111111 -0.8967 18 C -2.1303 0.7902 0.5059 C.ar 1 UNL111111111 -0.3912 19 C -3.0132 0.0339 1.2747 C.ar 1 UNL111111111 -0.0652 20 C -4.3204 -0.1699 0.8384 C.ar 1 UNL111111111 -0.2338 21 C -4.7103 0.4077 -0.3679 C.ar 1 UNL111111111 0.2016 22 F -5.9536 0.2205 -0.7801 F 1 UNL111111111 -0.1678 23 C -3.8484 1.1781 -1.1591 C.ar 1 UNL111111111 -0.0460 24 C -2.5428 1.3600 -0.6981 C.ar 1 UNL111111111 -0.0661 25 C -4.3079 1.7815 -2.4365 C.3 1 UNL111111111 -0.4437 26 N 6.1285 -0.5221 -1.1439 N.pl3 1 UNL111111111 -0.6307 27 H 3.5566 -1.0434 -1.5454 H 1 UNL111111111 0.1660 28 H 6.3373 1.8727 0.0115 H 1 UNL111111111 0.1590 29 H 4.4297 3.2836 0.7291 H 1 UNL111111111 0.1474 30 H 2.1088 2.5520 0.3421 H 1 UNL111111111 0.1929 31 H 0.7518 1.0279 -1.4697 H 1 UNL111111111 0.1571 32 H 1.3105 -0.6665 -1.5821 H 1 UNL111111111 0.1681 33 H 0.1694 -1.4296 1.9354 H 1 UNL111111111 0.1735 34 H 2.6663 -0.6139 1.7637 H 1 UNL111111111 0.1760 35 H 2.3613 -2.3128 2.1517 H 1 UNL111111111 0.1543 36 H 2.8697 -1.8548 0.5233 H 1 UNL111111111 0.1774 37 H -1.5611 -2.8021 0.8644 H 1 UNL111111111 0.3051 38 H -0.5113 -4.6169 -0.8916 H 1 UNL111111111 0.3128 39 H -2.7034 -0.3905 2.2378 H 1 UNL111111111 0.1775 40 H -5.0208 -0.7574 1.4306 H 1 UNL111111111 0.1760 41 H -1.8546 1.9728 -1.2928 H 1 UNL111111111 0.1778 42 H -5.1849 2.4331 -2.2910 H 1 UNL111111111 0.1674 43 H -3.5353 2.3981 -2.9183 H 1 UNL111111111 0.1620 44 H -4.6044 1.0118 -3.1676 H 1 UNL111111111 0.1684 45 H 7.0463 -0.1333 -1.1945 H 1 UNL111111111 0.2900 46 H 5.9543 -1.2777 -1.7729 H 1 UNL111111111 0.2912 @BOND 1 1 3 ar 2 1 2 ar 3 2 6 ar 4 2 27 1 5 3 4 ar 6 3 28 1 7 4 5 ar 8 4 29 1 9 5 30 1 10 6 5 ar 11 6 7 1 12 7 31 1 13 7 32 1 14 8 7 1 15 9 8 1 16 9 11 1 17 9 33 1 18 10 9 1 19 10 34 1 20 10 35 1 21 10 36 1 22 11 12 am 23 11 14 2 24 12 13 1 25 12 37 1 26 13 38 1 27 15 8 1 28 15 18 1 29 16 15 2 30 17 15 2 31 18 19 ar 32 18 24 ar 33 19 20 ar 34 19 39 1 35 20 21 ar 36 20 40 1 37 21 22 1 38 23 21 ar 39 23 25 1 40 24 23 ar 41 24 41 1 42 25 42 1 43 25 43 1 44 25 44 1 45 26 1 1 46 26 45 1 47 26 46 1