@MOLECULE (2s)-2-({[(1r)-1-aminoethyl](hydroxy)phosphoryl}methyl)succinic acid 29 28 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.8936 -1.7425 0.3946 O.2 1 UNL1111 -0.2937 2 P 1.8051 -0.2826 0.2380 P.3 1 UNL1111 0.1322 3 O 1.7769 0.3569 1.7248 O.3 1 UNL1111 -0.3610 4 C 3.2784 0.5263 -0.6841 C.3 1 UNL1111 0.0639 5 N 3.0945 2.0015 -0.6283 N.3 1 UNL1111 -0.6382 6 C 4.6740 0.0940 -0.1838 C.3 1 UNL1111 -0.4556 7 C 0.3257 0.4203 -0.6519 C.3 1 UNL1111 -0.2613 8 C -1.0557 0.1124 -0.0307 C.3 1 UNL1111 -0.1158 9 C -1.4067 -1.3378 -0.2987 C.2 1 UNL1111 0.6404 10 O -1.8053 -1.9449 0.8410 O.3 1 UNL1111 -0.5375 11 O -1.3983 -1.9113 -1.3552 O.2 1 UNL1111 -0.5105 12 C -2.1176 0.9856 -0.7252 C.3 1 UNL1111 -0.3630 13 C -3.3578 1.0641 0.1127 C.2 1 UNL1111 0.6378 14 O -4.4316 0.6376 -0.5986 O.3 1 UNL1111 -0.5584 15 O -3.4749 1.4573 1.2418 O.2 1 UNL1111 -0.4936 16 H 1.7891 1.3737 1.6646 H 1 UNL1111 0.2942 17 H 3.1798 0.1944 -1.7699 H 1 UNL1111 0.1608 18 H 3.5844 2.4191 0.1548 H 1 UNL1111 0.2498 19 H 3.4515 2.4415 -1.4679 H 1 UNL1111 0.2419 20 H 4.8231 -0.9979 -0.2373 H 1 UNL1111 0.1769 21 H 5.4539 0.5496 -0.8056 H 1 UNL1111 0.1386 22 H 4.8762 0.3779 0.8587 H 1 UNL1111 0.1600 23 H 0.4675 1.5390 -0.7224 H 1 UNL1111 0.1952 24 H 0.3428 0.0358 -1.7157 H 1 UNL1111 0.1952 25 H -1.0811 0.3165 1.0798 H 1 UNL1111 0.2072 26 H -1.9680 -2.9161 0.7378 H 1 UNL1111 0.3554 27 H -1.7337 2.0186 -0.8799 H 1 UNL1111 0.1840 28 H -2.3442 0.5952 -1.7452 H 1 UNL1111 0.1978 29 H -5.2804 0.6506 -0.0906 H 1 UNL1111 0.3573 @BOND 1 2 1 2 2 2 4 1 3 2 3 1 4 3 16 1 5 4 5 1 6 4 17 1 7 5 18 1 8 5 19 1 9 6 4 1 10 6 20 1 11 6 21 1 12 6 22 1 13 7 2 1 14 7 23 1 15 7 24 1 16 8 7 1 17 8 9 1 18 8 25 1 19 9 11 2 20 9 10 1 21 10 26 1 22 12 8 1 23 12 27 1 24 12 28 1 25 13 12 1 26 13 14 1 27 14 29 1 28 15 13 2