@MOLECULE n~2~-[4-(aminomethyl)benzyl]-n~2~-[(4-fluoro-3-methylphenyl)sulfonyl]-n-hydroxy-d-alaninamide 49 50 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.5931 1.5755 -0.0799 C.3 1 UNL111111111 0.0403 2 C -0.7242 2.3779 -0.0153 C.2 1 UNL111111111 0.5023 3 C 6.6938 -0.5713 0.0890 C.3 1 UNL111111111 -0.1189 4 O -1.0822 3.0329 0.9338 O.2 1 UNL111111111 -0.4900 5 N -1.3921 2.4705 -1.2512 N.am 1 UNL111111111 -0.3913 6 N 6.8818 0.1291 1.3766 N.3 1 UNL111111111 -0.6161 7 C -2.0843 -0.7723 0.5437 C.ar 1 UNL111111111 -0.4051 8 C -2.7639 -1.6360 -0.3161 C.ar 1 UNL111111111 -0.0721 9 C -4.1432 -1.5245 -0.4889 C.ar 1 UNL111111111 -0.0556 10 C -4.8021 -0.5155 0.2270 C.ar 1 UNL111111111 0.2084 11 C -4.1464 0.3490 1.1000 C.ar 1 UNL111111111 -0.2263 12 C -2.7690 0.2087 1.2580 C.ar 1 UNL111111111 -0.0453 13 C -4.8848 -2.4421 -1.3918 C.3 1 UNL111111111 -0.4414 14 C 1.1237 -0.3473 -1.5212 C.3 1 UNL111111111 -0.0730 15 C 2.5783 -0.4201 -1.1307 C.ar 1 UNL111111111 -0.0593 16 C 3.4552 0.5996 -1.5024 C.ar 1 UNL111111111 -0.1589 17 C 4.7937 0.5415 -1.1249 C.ar 1 UNL111111111 -0.1776 18 C 5.2603 -0.5373 -0.3741 C.ar 1 UNL111111111 -0.0522 19 C 4.3883 -1.5669 -0.0199 C.ar 1 UNL111111111 -0.1718 20 C 3.0522 -1.5120 -0.4040 C.ar 1 UNL111111111 -0.1365 21 C 1.3636 1.7417 1.2264 C.3 1 UNL111111111 -0.4752 22 N 0.2414 0.2021 -0.4716 N.3 1 UNL111111111 -0.7817 23 O -2.7038 2.9520 -1.1653 O.3 1 UNL111111111 -0.3029 24 S -0.3485 -0.9497 0.7300 S.O2 1 UNL111111111 2.3481 25 O 0.0299 -0.5267 2.0514 O.2 1 UNL111111111 -0.8791 26 O 0.0462 -2.2471 0.2196 O.2 1 UNL111111111 -0.9186 27 F -6.1087 -0.3792 0.0716 F 1 UNL111111111 -0.1684 28 H 1.2124 2.0399 -0.9037 H 1 UNL111111111 0.1617 29 H 7.3735 -0.1093 -0.6633 H 1 UNL111111111 0.1519 30 H 7.0550 -1.6190 0.2115 H 1 UNL111111111 0.1553 31 H -1.4458 1.6648 -1.8616 H 1 UNL111111111 0.3119 32 H 6.6538 1.1084 1.3008 H 1 UNL111111111 0.2459 33 H 6.3052 -0.2737 2.0993 H 1 UNL111111111 0.2492 34 H -2.2250 -2.4227 -0.8594 H 1 UNL111111111 0.1803 35 H -4.6894 1.1220 1.6437 H 1 UNL111111111 0.1815 36 H -2.2440 0.8826 1.9507 H 1 UNL111111111 0.1882 37 H -5.6925 -2.9720 -0.8609 H 1 UNL111111111 0.1672 38 H -5.3568 -1.9002 -2.2275 H 1 UNL111111111 0.1654 39 H -4.2415 -3.2164 -1.8346 H 1 UNL111111111 0.1594 40 H 0.9948 0.2809 -2.4360 H 1 UNL111111111 0.1410 41 H 0.7593 -1.3667 -1.8157 H 1 UNL111111111 0.1767 42 H 3.1007 1.4432 -2.0918 H 1 UNL111111111 0.1490 43 H 5.4729 1.3401 -1.4166 H 1 UNL111111111 0.1540 44 H 4.7505 -2.4157 0.5576 H 1 UNL111111111 0.1590 45 H 2.3728 -2.3303 -0.1325 H 1 UNL111111111 0.1911 46 H 2.1832 1.0172 1.3095 H 1 UNL111111111 0.1655 47 H 1.7907 2.7476 1.3098 H 1 UNL111111111 0.1541 48 H 0.7295 1.6048 2.1206 H 1 UNL111111111 0.2000 49 H -2.6113 3.8691 -0.7596 H 1 UNL111111111 0.3096 @BOND 1 1 22 1 2 1 2 1 3 1 28 1 4 2 5 am 5 2 4 2 6 3 18 1 7 3 6 1 8 3 29 1 9 3 30 1 10 5 23 1 11 5 31 1 12 6 32 1 13 6 33 1 14 7 8 ar 15 7 12 ar 16 8 9 ar 17 8 34 1 18 9 13 1 19 9 10 ar 20 10 27 1 21 11 10 ar 22 11 35 1 23 12 11 ar 24 12 36 1 25 13 37 1 26 13 38 1 27 13 39 1 28 14 40 1 29 14 41 1 30 15 14 1 31 15 20 ar 32 16 15 ar 33 16 42 1 34 17 16 ar 35 17 18 ar 36 17 43 1 37 18 19 ar 38 19 20 ar 39 19 44 1 40 20 45 1 41 21 1 1 42 21 46 1 43 21 47 1 44 21 48 1 45 22 14 1 46 23 49 1 47 24 22 1 48 24 7 1 49 25 24 2 50 26 24 2