@MOLECULE 2-benzyl-3-[ethoxy(hydroxy)phosphoryl]propanoic acid 35 35 0 0 0 SMALL GASTEIGER @ATOM 1 P 2.8265 -0.3249 -0.1643 P.3 1 UNL111111111 0.2326 2 O 2.7996 1.0862 0.5875 O.3 1 UNL111111111 -0.2670 3 O 3.7887 -0.1077 -1.4384 O.3 1 UNL111111111 -0.4485 4 O 3.3239 -1.2822 0.8238 O.2 1 UNL111111111 -0.2673 5 O -0.3356 -0.8203 1.8780 O.3 1 UNL111111111 -0.5412 6 O -0.5020 -2.5610 0.4900 O.2 1 UNL111111111 -0.5175 7 C -0.0561 -0.3320 -0.4078 C.3 1 UNL111111111 -0.1357 8 C 1.2831 -0.6345 -1.1231 C.3 1 UNL111111111 -0.2093 9 C -1.1970 -0.4103 -1.4452 C.3 1 UNL111111111 -0.2963 10 C -2.4961 -0.0061 -0.8180 C.ar 1 UNL111111111 -0.0011 11 C -0.3119 -1.3837 0.6488 C.2 1 UNL111111111 0.6481 12 C -3.3535 -0.9783 -0.2992 C.ar 1 UNL111111111 -0.1691 13 C -2.8463 1.3438 -0.7401 C.ar 1 UNL111111111 -0.1760 14 C 2.2874 2.3141 0.0320 C.3 1 UNL111111111 -0.0109 15 C -4.5545 -0.6037 0.2970 C.ar 1 UNL111111111 -0.1363 16 C -4.0484 1.7154 -0.1427 C.ar 1 UNL111111111 -0.1414 17 C -4.9031 0.7436 0.3756 C.ar 1 UNL111111111 -0.1549 18 C 1.4395 2.8915 1.1659 C.3 1 UNL111111111 -0.4695 19 H -0.0745 0.6894 0.0638 H 1 UNL111111111 0.1871 20 H 1.3374 -0.0371 -2.0814 H 1 UNL111111111 0.1899 21 H 1.2956 -1.7243 -1.4410 H 1 UNL111111111 0.2041 22 H -0.9654 0.2418 -2.3118 H 1 UNL111111111 0.1551 23 H -1.2613 -1.4396 -1.8613 H 1 UNL111111111 0.1707 24 H -3.0771 -2.0322 -0.3520 H 1 UNL111111111 0.1663 25 H -2.1814 2.1052 -1.1408 H 1 UNL111111111 0.1487 26 H 3.1881 2.9349 -0.1593 H 1 UNL111111111 0.1225 27 H 1.7105 2.2390 -0.9056 H 1 UNL111111111 0.1130 28 H 4.7590 -0.0950 -1.1357 H 1 UNL111111111 0.3329 29 H -5.2199 -1.3641 0.7043 H 1 UNL111111111 0.1524 30 H -4.3201 2.7670 -0.0792 H 1 UNL111111111 0.1471 31 H -5.8405 1.0372 0.8427 H 1 UNL111111111 0.1502 32 H -0.4166 -1.4767 2.6148 H 1 UNL111111111 0.3548 33 H 1.1275 3.9159 0.9481 H 1 UNL111111111 0.1427 34 H 0.5432 2.2875 1.3563 H 1 UNL111111111 0.1590 35 H 2.0086 2.8996 2.1077 H 1 UNL111111111 0.1646 @BOND 1 1 2 1 2 1 3 1 3 1 4 2 4 1 8 1 5 2 14 1 6 3 28 1 7 5 11 1 8 5 32 1 9 6 11 2 10 7 8 1 11 7 9 1 12 7 11 1 13 7 19 1 14 8 20 1 15 8 21 1 16 9 10 1 17 9 22 1 18 9 23 1 19 10 12 ar 20 10 13 ar 21 12 15 ar 22 12 24 1 23 13 16 ar 24 13 25 1 25 14 18 1 26 14 26 1 27 14 27 1 28 15 17 ar 29 15 29 1 30 16 17 ar 31 16 30 1 32 17 31 1 33 18 33 1 34 18 34 1 35 18 35 1