@MOLECULE (3s)-3-hydroxy-2-butanone 14 13 0 0 0 SMALL GASTEIGER @ATOM 1 C -1.2297 1.2339 0.6421 C.3 1 UNL1111111111 -0.4896 2 C -0.6664 0.2768 -0.4046 C.3 1 UNL1111111111 0.0705 3 O -1.4841 -0.8596 -0.5186 O.3 1 UNL1111111111 -0.5324 4 C 0.7475 -0.1377 0.0083 C.2 1 UNL1111111111 0.4406 5 C 1.8776 0.7317 -0.4376 C.3 1 UNL1111111111 -0.5506 6 O 0.9120 -1.1303 0.6721 O.2 1 UNL1111111111 -0.4516 7 H -0.7457 2.2143 0.6083 H 1 UNL1111111111 0.1523 8 H -2.3060 1.3859 0.4722 H 1 UNL1111111111 0.1722 9 H -1.1246 0.8359 1.6595 H 1 UNL1111111111 0.1616 10 H -0.6987 0.7064 -1.4316 H 1 UNL1111111111 0.1555 11 H -1.3165 -1.4853 0.2255 H 1 UNL1111111111 0.3333 12 H 1.5811 1.7714 -0.6159 H 1 UNL1111111111 0.1678 13 H 2.6926 0.7357 0.3040 H 1 UNL1111111111 0.1849 14 H 2.3125 0.3422 -1.3725 H 1 UNL1111111111 0.1854 @BOND 1 1 2 1 2 1 7 1 3 1 8 1 4 1 9 1 5 2 3 1 6 2 4 1 7 2 10 1 8 3 11 1 9 4 5 1 10 4 6 2 11 5 12 1 12 5 13 1 13 5 14 1