@MOLECULE 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]-2-phosphonopropanoic acid 37 36 0 0 0 SMALL GASTEIGER @ATOM 1 P -2.9904 0.5435 0.5461 P.3 1 UNL111111111 0.3186 2 O 3.5492 1.8395 -0.5329 O.3 1 UNL111111111 -0.5348 3 O 1.2648 -0.5885 1.7047 O.3 1 UNL111111111 -0.5913 4 O 1.7071 0.3281 -2.0425 O.2 1 UNL111111111 -0.5810 5 O -4.1276 1.3279 -0.2582 O.3 1 UNL111111111 -0.4033 6 O -3.6832 -0.8365 0.9541 O.3 1 UNL111111111 -0.4001 7 O -2.3737 1.2890 1.6361 O.2 1 UNL111111111 -0.3395 8 O -1.8829 -2.2822 -1.5610 O.3 1 UNL111111111 -0.5576 9 O -0.6600 -1.7654 0.2204 O.2 1 UNL111111111 -0.5319 10 N 0.2348 1.0729 -0.4994 N.am 1 UNL111111111 -0.5774 11 C 3.3324 -0.3373 0.5408 C.3 1 UNL111111111 0.0300 12 C 2.6385 0.9713 0.0913 C.3 1 UNL111111111 0.0718 13 C 2.2646 -1.3375 1.0375 C.3 1 UNL111111111 -0.0208 14 C 4.2846 0.0156 1.6896 C.3 1 UNL111111111 -0.4526 15 C 4.1149 -0.9745 -0.6099 C.3 1 UNL111111111 -0.4754 16 C 1.5016 0.7229 -0.9086 C.2 1 UNL111111111 0.5473 17 C -0.8908 0.9280 -1.4180 C.3 1 UNL111111111 -0.0264 18 C -2.0195 -0.0420 -0.9198 C.3 1 UNL111111111 -0.1469 19 C -1.4321 -1.4039 -0.6301 C.2 1 UNL111111111 0.7042 20 H 2.3008 1.5588 0.9801 H 1 UNL111111111 0.1741 21 H 1.8217 -1.9110 0.2052 H 1 UNL111111111 0.1240 22 H 2.6782 -2.0392 1.7832 H 1 UNL111111111 0.1296 23 H 3.4918 -1.0995 -1.5074 H 1 UNL111111111 0.1683 24 H 3.7262 0.3129 2.5871 H 1 UNL111111111 0.1578 25 H 4.9409 0.8519 1.4149 H 1 UNL111111111 0.1583 26 H 4.9207 -0.8318 1.9621 H 1 UNL111111111 0.1424 27 H 4.4988 -1.9626 -0.3346 H 1 UNL111111111 0.1485 28 H 4.9790 -0.3618 -0.8933 H 1 UNL111111111 0.1534 29 H -2.7753 -0.1389 -1.7842 H 1 UNL111111111 0.2301 30 H -0.5202 0.5273 -2.4016 H 1 UNL111111111 0.1801 31 H -1.3060 1.9438 -1.6429 H 1 UNL111111111 0.1609 32 H 0.0402 1.3212 0.4648 H 1 UNL111111111 0.3403 33 H 3.8318 1.4756 -1.4047 H 1 UNL111111111 0.3303 34 H 0.3811 -0.8839 1.4003 H 1 UNL111111111 0.3506 35 H -4.0284 -0.7825 1.9125 H 1 UNL111111111 0.3323 36 H -4.6755 1.9019 0.3797 H 1 UNL111111111 0.3274 37 H -1.5362 -3.2021 -1.4475 H 1 UNL111111111 0.3588 @BOND 1 1 5 1 2 1 6 1 3 1 7 2 4 1 18 1 5 2 12 1 6 2 33 1 7 3 13 1 8 3 34 1 9 4 16 2 10 5 36 1 11 6 35 1 12 8 19 1 13 8 37 1 14 9 19 2 15 10 16 am 16 10 17 1 17 10 32 1 18 11 12 1 19 11 13 1 20 11 14 1 21 11 15 1 22 12 16 1 23 12 20 1 24 13 21 1 25 13 22 1 26 14 24 1 27 14 25 1 28 14 26 1 29 15 23 1 30 15 27 1 31 15 28 1 32 17 18 1 33 17 30 1 34 17 31 1 35 18 19 1 36 18 29 1