@MOLECULE 2-[(2S)-2-[(1S)-1-aminoethyl]-4-benzyl-5-oxo-2H-imidazol-1-yl]acetic acid 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.7373 0.3521 -0.8434 C.ar 1 UNL111111111 -0.4194 2 C -3.8776 1.1133 -1.0837 C.ar 1 UNL111111111 -0.1584 3 C -5.1168 0.6924 -0.6018 C.ar 1 UNL111111111 -0.2796 4 C -5.2124 -0.4924 0.1246 C.ar 1 UNL111111111 -0.1227 5 C -4.0727 -1.2555 0.3719 C.ar 1 UNL111111111 -0.4183 6 C -2.8329 -0.8345 -0.1123 C.ar 1 UNL111111111 0.6169 7 C -1.6149 -1.6781 0.1312 C.3 1 UNL111111111 -1.1168 8 C -0.4235 -0.8955 0.5337 C.2 1 UNL111111111 0.6024 9 C 0.9780 -1.4085 0.2003 C.2 1 UNL111111111 0.2077 10 O 1.3404 -2.4022 -0.3678 O.2 1 UNL111111111 -0.2425 11 N -0.3823 0.2122 1.1983 N.2 1 UNL111111111 -0.4548 12 C 1.0127 0.6873 1.3069 C.3 1 UNL111111111 0.1074 13 C 1.2118 1.9816 0.4411 C.3 1 UNL111111111 0.2531 14 C 0.3567 3.1032 1.0342 C.3 1 UNL111111111 -1.0032 15 N 0.7922 1.6927 -0.9456 N.3 1 UNL111111111 -0.9759 16 N 1.8173 -0.4709 0.8106 N.am 1 UNL111111111 -0.5069 17 C 3.2530 -0.5377 0.7916 C.3 1 UNL111111111 -0.3028 18 C 3.8583 -0.1344 -0.5427 C.2 1 UNL111111111 0.4444 19 O 3.3949 0.5011 -1.4503 O.2 1 UNL111111111 -0.4632 20 O 5.1318 -0.5941 -0.5931 O.3 1 UNL111111111 -0.4386 21 H -1.7634 0.6939 -1.2061 H 1 UNL111111111 0.2597 22 H -3.7996 2.0402 -1.6479 H 1 UNL111111111 0.1742 23 H -6.0060 1.2881 -0.7910 H 1 UNL111111111 0.1869 24 H -6.1774 -0.8223 0.5019 H 1 UNL111111111 0.1886 25 H -4.1553 -2.1753 0.9452 H 1 UNL111111111 0.2478 26 H -1.8161 -2.4571 0.9057 H 1 UNL111111111 0.3636 27 H -1.3824 -2.2584 -0.8001 H 1 UNL111111111 0.3242 28 H 1.2574 0.8865 2.3802 H 1 UNL111111111 0.2235 29 H 2.2974 2.2557 0.4993 H 1 UNL111111111 0.1192 30 H -0.7141 2.8379 0.9870 H 1 UNL111111111 0.3419 31 H 0.5961 3.2892 2.0853 H 1 UNL111111111 0.2753 32 H 0.4853 4.0432 0.4885 H 1 UNL111111111 0.2693 33 H 0.5854 2.5292 -1.4638 H 1 UNL111111111 0.3751 34 H 1.4983 1.1576 -1.4315 H 1 UNL111111111 0.4439 35 H 3.6919 0.0999 1.5984 H 1 UNL111111111 0.2422 36 H 3.5712 -1.5978 1.0164 H 1 UNL111111111 0.2926 37 H 5.5980 -0.3920 -1.4444 H 1 UNL111111111 0.3434 @BOND 1 1 2 ar 2 1 6 ar 3 1 21 1 4 2 3 ar 5 2 22 1 6 3 4 ar 7 3 23 1 8 4 5 ar 9 4 24 1 10 5 6 ar 11 5 25 1 12 6 7 1 13 7 8 1 14 7 26 1 15 7 27 1 16 8 11 2 17 8 9 1 18 9 16 am 19 9 10 2 20 11 12 1 21 12 13 1 22 12 16 1 23 12 28 1 24 13 14 1 25 13 15 1 26 13 29 1 27 14 30 1 28 14 31 1 29 14 32 1 30 15 33 1 31 15 34 1 32 16 17 1 33 17 18 1 34 17 35 1 35 17 36 1 36 18 20 1 37 18 19 2 38 20 37 1