@MOLECULE (6R)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 19 20 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.4555 -0.5084 -0.3140 S.3 1 UNL111111111 -0.0350 2 O 1.0278 2.3179 -0.7204 O.2 1 UNL111111111 -0.3846 3 O 2.6340 0.4296 0.5717 O.3 1 UNL111111111 -0.4963 4 O 2.7632 -1.5421 -0.4703 O.2 1 UNL111111111 -0.4880 5 N -0.0058 0.5156 0.4696 N.am 1 UNL111111111 -0.4845 6 C -1.4739 0.6692 0.6955 C.3 1 UNL111111111 0.0185 7 C -1.3670 2.1093 0.1177 C.3 1 UNL111111111 -0.3806 8 C 0.1138 1.7930 -0.1827 C.2 1 UNL111111111 0.6022 9 C 0.6043 -0.6956 0.1581 C.2 1 UNL111111111 0.0761 10 C -1.5162 -2.0402 0.0796 C.3 1 UNL111111111 -0.3103 11 C -0.0484 -1.8665 0.0041 C.2 1 UNL111111111 -0.1844 12 C 2.0888 -0.6780 0.0299 C.2 1 UNL111111111 0.6196 13 H -1.7345 0.5965 1.7679 H 1 UNL111111111 0.1704 14 H -1.5237 2.9161 0.8423 H 1 UNL111111111 0.1833 15 H -1.9595 2.3373 -0.7761 H 1 UNL111111111 0.1893 16 H -1.8647 -2.8115 -0.6431 H 1 UNL111111111 0.1831 17 H -1.8123 -2.4091 1.0860 H 1 UNL111111111 0.1772 18 H 0.5202 -2.7849 -0.1883 H 1 UNL111111111 0.1898 19 H 3.6206 0.4744 0.4495 H 1 UNL111111111 0.3544 @BOND 1 1 6 1 2 1 10 1 3 2 8 2 4 3 12 1 5 3 19 1 6 4 12 2 7 5 6 1 8 5 8 am 9 5 9 1 10 6 7 1 11 6 13 1 12 7 8 1 13 7 14 1 14 7 15 1 15 9 11 2 16 9 12 1 17 10 11 1 18 10 16 1 19 10 17 1 20 11 18 1