@MOLECULE (2z)-2-(phosphonooxy)-2-butenoic acid 18 17 0 0 0 SMALL GASTEIGER @ATOM 1 P -1.4892 -0.1040 0.1477 P.3 1 UNL1111111111 0.3536 2 O -0.1786 0.3538 -0.7190 O.2 1 UNL1111111111 -0.3093 3 O -1.4523 -1.6823 0.0313 O.3 1 UNL1111111111 -0.3837 4 O -2.5908 0.3257 -0.9088 O.3 1 UNL1111111111 -0.2516 5 O -1.6771 0.5041 1.4459 O.2 1 UNL1111111111 -0.2093 6 O 3.0831 -0.7796 0.0430 O.3 1 UNL1111111111 -0.5431 7 O 1.2256 -1.9981 0.0270 O.2 1 UNL1111111111 -0.5422 8 C 1.0681 0.4165 -0.1679 C.2 1 UNL1111111111 0.0803 9 C 1.6820 1.5899 0.0688 C.2 1 UNL1111111111 -0.0904 10 C 0.9930 2.8969 -0.0319 C.3 1 UNL1111111111 -0.4383 11 C 1.7362 -0.8988 -0.0273 C.2 1 UNL1111111111 0.6324 12 H 2.7380 1.6178 0.3481 H 1 UNL1111111111 0.1666 13 H 0.3481 2.9585 -0.9249 H 1 UNL1111111111 0.1742 14 H 0.3232 3.0583 0.8333 H 1 UNL1111111111 0.1796 15 H 1.6900 3.7427 -0.0686 H 1 UNL1111111111 0.1458 16 H -0.4650 -2.0043 0.0531 H 1 UNL1111111111 0.3659 17 H -2.4706 -0.2428 -1.7626 H 1 UNL1111111111 0.3098 18 H 3.5495 -1.6492 0.1460 H 1 UNL1111111111 0.3599 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 1 5 2 5 2 8 1 6 3 16 1 7 4 17 1 8 6 11 1 9 6 18 1 10 7 11 2 11 8 9 2 12 8 11 1 13 9 10 1 14 9 12 1 15 10 13 1 16 10 14 1 17 10 15 1