@MOLECULE {5-oxo-4-[(4-oxo-2,5-cyclohexadien-1-yl)methyl]-1-(2-oxoethyl)-4,5-dihydro-1h-imidazol-2-yl}methanaminium 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 N -2.4609 -3.3817 -0.0015 N.3 1 UNL111111111 -0.5892 2 C -3.0628 -2.0543 0.1590 C.3 1 UNL111111111 -0.1146 3 C -2.0718 -0.9579 0.4492 C.2 1 UNL111111111 0.3095 4 N -0.7963 -1.1254 0.6632 N.2 1 UNL111111111 -0.4834 5 N -2.4649 0.4059 0.5301 N.am 1 UNL111111111 -0.5483 6 C -1.3240 1.1995 0.8219 C.2 1 UNL111111111 0.5230 7 O -1.3510 2.3888 0.9465 O.2 1 UNL111111111 -0.4277 8 C -0.1637 0.1885 0.9213 C.3 1 UNL111111111 -0.0470 9 C -3.7869 0.9372 0.2799 C.3 1 UNL111111111 -0.1792 10 C -4.0464 1.0984 -1.2155 C.2 1 UNL111111111 0.3157 11 O -5.1744 1.1471 -1.6283 O.2 1 UNL111111111 -0.3984 12 C 0.9081 0.5111 -0.1225 C.3 1 UNL111111111 -0.2625 13 C 2.0987 -0.4670 -0.0302 C.3 1 UNL111111111 -0.1465 14 C 2.8038 -0.5050 -1.3526 C.2 1 UNL111111111 -0.0739 15 C 2.9843 -0.0863 1.1167 C.2 1 UNL111111111 -0.0683 16 C 4.0996 -0.2126 -1.4997 C.2 1 UNL111111111 -0.2895 17 C 4.2803 0.2071 0.9733 C.2 1 UNL111111111 -0.2902 18 C 4.9365 0.1898 -0.3500 C.2 1 UNL111111111 0.4659 19 O 6.1002 0.4915 -0.4864 O.2 1 UNL111111111 -0.4422 20 H -1.9799 -3.6778 0.8373 H 1 UNL111111111 0.2619 21 H -1.7983 -3.4029 -0.7642 H 1 UNL111111111 0.2586 22 H -3.6393 -1.8143 -0.7699 H 1 UNL111111111 0.1737 23 H -3.8154 -2.1067 0.9875 H 1 UNL111111111 0.1760 24 H 0.2609 0.1851 1.9575 H 1 UNL111111111 0.1905 25 H -4.5714 0.3010 0.7528 H 1 UNL111111111 0.1776 26 H -3.8841 1.9464 0.7677 H 1 UNL111111111 0.2029 27 H -3.1752 1.1739 -1.8739 H 1 UNL111111111 0.1273 28 H 0.4676 0.4732 -1.1394 H 1 UNL111111111 0.1573 29 H 1.2609 1.5565 0.0135 H 1 UNL111111111 0.1746 30 H 1.6958 -1.5065 0.1713 H 1 UNL111111111 0.1948 31 H 2.1813 -0.8023 -2.1978 H 1 UNL111111111 0.1488 32 H 2.4969 -0.0718 2.0924 H 1 UNL111111111 0.1494 33 H 4.6133 -0.2479 -2.4593 H 1 UNL111111111 0.1766 34 H 4.9252 0.4774 1.8081 H 1 UNL111111111 0.1767 @BOND 1 1 2 1 2 1 20 1 3 1 21 1 4 2 3 1 5 2 22 1 6 2 23 1 7 3 4 2 8 3 5 1 9 4 8 1 10 5 6 am 11 5 9 1 12 6 7 2 13 6 8 1 14 8 12 1 15 8 24 1 16 9 10 1 17 9 25 1 18 9 26 1 19 10 11 2 20 10 27 1 21 12 13 1 22 12 28 1 23 12 29 1 24 13 14 1 25 13 15 1 26 13 30 1 27 14 16 2 28 14 31 1 29 15 17 2 30 15 32 1 31 16 18 1 32 16 33 1 33 17 18 1 34 17 34 1 35 18 19 2