@MOLECULE 3-[5-(2-methyl-2-propanyl)-3-(phosphonomethoxy)-1,2-oxazol-4-yl]-l-alanine 40 40 0 0 0 SMALL USER_CHARGES @ATOM 1 P -3.7974 -0.4296 -0.1357 P.3 1 UNL11111111111 0.2981 2 O 1.7380 -2.1637 0.5777 O.2 1 UNL11111111111 0.0428 3 O -1.2846 -0.6661 -0.3742 O.3 1 UNL11111111111 -0.1874 4 OXT 0.3728 1.6382 1.8433 O.3 1 UNL11111111111 -0.5377 5 O 2.0411 2.8462 0.9930 O.2 1 UNL11111111111 -0.5349 6 O -3.2525 1.0712 -0.0385 O.3 1 UNL11111111111 -0.3812 7 O -4.6198 -0.6451 1.2241 O.3 1 UNL11111111111 -0.4175 8 O -4.5606 -0.7251 -1.3452 O.2 1 UNL11111111111 -0.3529 9 N 0.3529 -2.1582 0.5820 N.ar 1 UNL11111111111 -0.3665 10 N 0.2432 3.2645 -1.2798 N.3 1 UNL11111111111 -0.6299 11 C 3.6663 -0.9340 -0.2104 C.3 1 UNL11111111111 0.1072 12 C 2.1850 -1.0536 -0.1151 C.ar 1 UNL11111111111 0.0675 13 C 1.1135 -0.3185 -0.5615 C.ar 1 UNL11111111111 -0.2261 14 C 1.0375 0.9436 -1.3107 C.3 1 UNL11111111111 -0.2427 15 C 4.1090 0.3612 0.4837 C.3 1 UNL11111111111 -0.4591 16 C 4.0611 -0.9063 -1.6959 C.3 1 UNL11111111111 -0.4525 17 C 4.3321 -2.1372 0.4758 C.3 1 UNL11111111111 -0.4633 18 CA 0.2805 2.0245 -0.5006 C.3 1 UNL11111111111 0.0065 19 C -0.0361 -1.0751 -0.0934 C.ar 1 UNL11111111111 0.2640 20 C 1.0220 2.2294 0.8170 C.2 1 UNL11111111111 0.5823 21 C -2.2970 -1.3522 0.3740 C.3 1 UNL11111111111 0.0229 22 H 0.4957 0.7966 -2.2772 H 1 UNL11111111111 0.1860 23 H 2.0451 1.3134 -1.5962 H 1 UNL11111111111 0.1586 24 H 5.1963 0.4874 0.4305 H 1 UNL11111111111 0.1574 25 H 3.6569 1.2519 0.0281 H 1 UNL11111111111 0.1643 26 H 3.8296 0.3698 1.5436 H 1 UNL11111111111 0.1553 27 H 3.6237 -0.0475 -2.2172 H 1 UNL11111111111 0.1518 28 H 5.1493 -0.8395 -1.8104 H 1 UNL11111111111 0.1560 29 H 3.7296 -1.8124 -2.2162 H 1 UNL11111111111 0.1528 30 H 5.4243 -2.0716 0.4131 H 1 UNL11111111111 0.1572 31 H 4.0697 -2.1926 1.5395 H 1 UNL11111111111 0.1567 32 H 4.0337 -3.0854 0.0129 H 1 UNL11111111111 0.1551 33 HA -0.7777 1.6799 -0.3039 H 1 UNL11111111111 0.2091 34 H1 1.1586 3.6679 -1.4143 H 1 UNL11111111111 0.2640 35 H2 -0.3734 3.9536 -0.8816 H 1 UNL11111111111 0.2597 36 H -2.3494 -2.4353 0.0699 H 1 UNL11111111111 0.1849 37 H -2.1077 -1.2714 1.4828 H 1 UNL11111111111 0.1930 38 HXT 0.8290 1.7299 2.7163 H 1 UNL11111111111 0.3501 39 H -3.8425 1.6858 -0.5990 H 1 UNL11111111111 0.3218 40 H -5.6033 -0.4384 1.0744 H 1 UNL11111111111 0.3265 @BOND 1 22 14 1 2 27 16 1 3 29 16 1 4 28 16 1 5 16 11 1 6 23 14 1 7 34 10 1 8 8 1 2 9 14 13 1 10 14 18 1 11 10 35 1 12 10 18 1 13 39 6 1 14 13 12 ar 15 13 19 ar 16 18 33 1 17 18 20 1 18 3 19 1 19 3 21 1 20 11 12 1 21 11 17 1 22 11 15 1 23 1 6 1 24 1 21 1 25 1 7 1 26 12 2 ar 27 19 9 ar 28 32 17 1 29 25 15 1 30 36 21 1 31 21 37 1 32 30 17 1 33 24 15 1 34 17 31 1 35 15 26 1 36 2 9 ar 37 20 5 2 38 20 4 1 39 40 7 1 40 4 38 1