@MOLECULE 5-hydroxy-1-methyl-4-oxo-piperidine-2,3,5,6-tetraide-2-carboxylic acid 19 19 0 0 0 SMALL USER_CHARGES @ATOM 1 O -3.2485 0.8060 -0.0079 O.3 1 UNL11111111 -0.4357 2 O -2.4766 -1.8246 -0.0892 O.2 1 UNL11111111 -0.4987 3 O 2.7288 -0.2777 -1.1372 O.3 1 UNL11111111 -0.5395 4 O 2.8300 -0.9405 0.9954 O.2 1 UNL11111111 -0.4396 5 N 0.3430 1.1062 0.0840 N.4 1 UNL11111111 -0.2192 6 C 0.7198 -0.2088 0.0461 C.3 1 UNL11111111 0.1244 7 C -1.0067 1.4380 0.0668 C.3 1 UNL11111111 -0.0880 8 C -0.1781 -1.2392 -0.0025 C.3 1 UNL11111111 -0.3776 9 C -1.9446 0.4492 0.0093 C.3 1 UNL11111111 0.0727 10 C 1.3466 2.1706 0.1222 C.3 1 UNL11111111 -0.2570 11 C -1.5974 -0.9846 -0.0336 C.2 1 UNL11111111 0.4366 12 C 2.1813 -0.5255 0.0773 C.2 1 UNL11111111 0.6087 13 H -1.2745 2.4952 0.1009 H 1 UNL11111111 0.1893 14 H 0.1377 -2.2806 -0.0175 H 1 UNL11111111 0.2027 15 H 1.9685 2.0911 1.0349 H 1 UNL11111111 0.1650 16 H 0.8747 3.1693 0.1270 H 1 UNL11111111 0.1669 17 H 2.0067 2.1184 -0.7671 H 1 UNL11111111 0.1728 18 H -3.8165 -0.0243 -0.0499 H 1 UNL11111111 0.3563 19 H 3.6833 -0.5419 -1.2046 H 1 UNL11111111 0.3597 @BOND 1 19 3 1 2 3 12 1 3 17 10 1 4 2 11 2 5 18 1 1 6 11 8 1 7 11 9 1 8 14 8 1 9 1 9 1 10 8 6 1 11 9 7 1 12 6 12 1 13 6 5 1 14 7 5 1 15 7 13 1 16 12 4 2 17 5 10 1 18 10 16 1 19 10 15 1