@MOLECULE {(1r)-1-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinyl}methyl)amino]ethyl}phosphonic acid 40 40 0 0 0 SMALL GASTEIGER @ATOM 1 C -2.6745 0.8563 0.5673 C.ar 1 UNL1111 0.0094 2 C -2.6715 3.1330 0.1356 C.ar 1 UNL1111 0.0691 3 C -1.3405 3.0504 -0.3206 C.ar 1 UNL1111 0.1563 4 O -0.9003 -3.7644 1.0120 O.2 1 UNL1111 -0.2286 5 O -3.3703 -3.4070 0.1920 O.3 1 UNL1111 -0.3510 6 C -0.7440 -0.6793 0.0836 C.3 1 UNL1111 0.0099 7 C 0.7652 1.7746 -0.8006 C.3 1 UNL1111 -0.0998 8 C 3.0595 1.3228 0.1017 C.3 1 UNL1111 0.1348 9 C 3.9094 1.9229 1.2532 C.3 1 UNL1111 -0.4263 10 N -3.3114 2.0378 0.5840 N.ar 1 UNL1111 -0.3498 11 C -0.6603 1.8258 -0.3307 C.ar 1 UNL1111 -0.0737 12 C -1.3552 0.6957 0.1075 C.ar 1 UNL1111 -0.0857 13 O -0.6531 4.1224 -0.7914 O.3 1 UNL1111 -0.4503 14 C -3.4257 4.4196 0.1273 C.3 1 UNL1111 -0.4445 15 O -1.9038 -1.5357 0.0183 O.3 1 UNL1111 -0.3667 16 N 1.6601 1.6945 0.3838 N.3 1 UNL1111 -0.5249 17 P -1.7958 -3.1405 0.0616 P.3 1 UNL1111 0.3543 18 O -1.5381 -3.5894 -1.4371 O.3 1 UNL1111 -0.2751 19 P 3.2859 -0.5409 -0.1902 P.3 1 UNL1111 0.2406 20 O 2.4499 -1.1870 -1.2074 O.2 1 UNL1111 -0.3092 21 O 4.8721 -0.5765 -0.4435 O.3 1 UNL1111 -0.4466 22 O 3.0685 -1.3395 1.1860 O.3 1 UNL1111 -0.3745 23 H -3.2641 0.0044 0.9325 H 1 UNL1111 0.1940 24 H -3.7040 -2.9819 1.0616 H 1 UNL1111 0.3176 25 H -0.1035 -0.8274 -0.8170 H 1 UNL1111 0.1634 26 H -0.1435 -0.8591 1.0029 H 1 UNL1111 0.1517 27 H 1.0432 2.7113 -1.3462 H 1 UNL1111 0.1663 28 H 0.8839 0.9435 -1.5374 H 1 UNL1111 0.1546 29 H 3.3775 1.8316 -0.8718 H 1 UNL1111 0.1743 30 H 3.6280 1.5520 2.2465 H 1 UNL1111 0.1480 31 H 4.9880 1.7681 1.1172 H 1 UNL1111 0.1548 32 H 3.7370 3.0118 1.2784 H 1 UNL1111 0.1610 33 H -1.1761 4.9592 -0.7119 H 1 UNL1111 0.3258 34 H -3.5906 4.7837 -0.8974 H 1 UNL1111 0.1595 35 H -4.4296 4.2930 0.5745 H 1 UNL1111 0.1879 36 H -2.9181 5.2017 0.7079 H 1 UNL1111 0.1548 37 H 1.2284 1.1680 1.1427 H 1 UNL1111 0.2723 38 H -2.2088 -3.0935 -2.0434 H 1 UNL1111 0.3085 39 H 5.1345 -1.4549 -0.8807 H 1 UNL1111 0.3343 40 H 3.7589 -1.0725 1.8811 H 1 UNL1111 0.3033 @BOND 1 1 10 ar 2 1 12 ar 3 1 23 1 4 2 3 ar 5 2 10 ar 6 2 14 1 7 3 11 ar 8 3 13 1 9 4 17 2 10 5 17 1 11 5 24 1 12 6 12 1 13 6 15 1 14 6 25 1 15 6 26 1 16 7 11 1 17 7 16 1 18 7 27 1 19 7 28 1 20 8 9 1 21 8 16 1 22 8 19 1 23 8 29 1 24 9 30 1 25 9 31 1 26 9 32 1 27 11 12 ar 28 13 33 1 29 14 34 1 30 14 35 1 31 14 36 1 32 15 17 1 33 16 37 1 34 17 18 1 35 18 38 1 36 19 20 2 37 19 21 1 38 19 22 1 39 21 39 1 40 22 40 1