@MOLECULE {4-[hydroxy(methyl)amino]-1-(4-methylphenyl)-4-oxobutyl}phosphonic acid 37 37 0 0 0 SMALL GASTEIGER @ATOM 1 C 3.6929 -1.1682 1.3023 C.ar 1 UNL111 -0.1843 2 C 2.4815 -0.4917 1.4113 C.ar 1 UNL111 -0.1659 3 C 1.6593 -0.3237 0.2923 C.ar 1 UNL111 -0.0113 4 C 2.0666 -0.8522 -0.9375 C.ar 1 UNL111 -0.1316 5 C 3.2767 -1.5294 -1.0453 C.ar 1 UNL111 -0.1850 6 C 4.0994 -1.6896 0.0727 C.ar 1 UNL111 0.0378 7 O 1.8683 2.7682 0.4258 O.3 1 UNL111 -0.3706 8 P 0.4790 2.1876 -0.1271 P.3 1 UNL111 0.2506 9 O -0.5827 3.1422 0.1889 O.2 1 UNL111 -0.2865 10 O 0.7538 1.9398 -1.6920 O.3 1 UNL111 -0.4259 11 C 0.3385 0.4063 0.4519 C.3 1 UNL111 -0.0516 12 C -0.7981 -0.4356 -0.2018 C.3 1 UNL111 -0.2253 13 C -2.1937 -0.0869 0.3282 C.3 1 UNL111 -0.3480 14 C -3.1744 -1.1529 -0.0707 C.2 1 UNL111 0.5568 15 N -4.4956 -1.0540 0.4820 N.am 1 UNL111 -0.2958 16 C -5.5761 -1.6645 -0.3042 C.3 1 UNL111 -0.2703 17 O -4.8204 0.3099 0.6638 O.3 1 UNL111 -0.3426 18 O -2.8995 -2.1406 -0.7105 O.2 1 UNL111 -0.4932 19 C 5.4050 -2.3973 -0.0532 C.3 1 UNL111 -0.4604 20 H 4.3238 -1.2905 2.1796 H 1 UNL111 0.1503 21 H 2.1813 -0.0930 2.3798 H 1 UNL111 0.1533 22 H 1.4421 -0.7297 -1.8252 H 1 UNL111 0.1678 23 H 3.5842 -1.9344 -2.0071 H 1 UNL111 0.1526 24 H 2.6433 2.1662 0.1435 H 1 UNL111 0.3100 25 H 0.6730 2.8192 -2.1960 H 1 UNL111 0.3280 26 H 0.0944 0.4903 1.5667 H 1 UNL111 0.1821 27 H -0.7935 -0.3819 -1.3114 H 1 UNL111 0.1658 28 H -0.5831 -1.5081 0.0185 H 1 UNL111 0.1626 29 H -2.1903 0.0306 1.4321 H 1 UNL111 0.1739 30 H -2.5457 0.8989 -0.0607 H 1 UNL111 0.1987 31 H -5.8144 -1.1130 -1.2283 H 1 UNL111 0.1475 32 H -5.2788 -2.6956 -0.5786 H 1 UNL111 0.1772 33 H -6.4875 -1.7162 0.3153 H 1 UNL111 0.1546 34 H -5.0121 0.3665 1.6446 H 1 UNL111 0.3015 35 H 6.1941 -1.7069 -0.3897 H 1 UNL111 0.1624 36 H 5.7419 -2.8322 0.8976 H 1 UNL111 0.1562 37 H 5.3635 -3.2191 -0.7817 H 1 UNL111 0.1584 @BOND 1 1 2 ar 2 1 20 1 3 2 3 ar 4 2 21 1 5 3 11 1 6 4 3 ar 7 4 22 1 8 5 4 ar 9 5 23 1 10 6 5 ar 11 6 1 ar 12 7 8 1 13 7 24 1 14 8 10 1 15 9 8 2 16 10 25 1 17 11 12 1 18 11 8 1 19 11 26 1 20 12 27 1 21 12 28 1 22 13 14 1 23 13 12 1 24 13 29 1 25 13 30 1 26 14 18 2 27 15 17 1 28 15 14 am 29 16 15 1 30 16 31 1 31 16 32 1 32 16 33 1 33 17 34 1 34 19 6 1 35 19 35 1 36 19 36 1 37 19 37 1