@MOLECULE (5r,6e)-3-{(r)-[(e)-2-acetamidovinyl]sulfinyl}-6-(1-hydroxy-2-propanylidene)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 39 40 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.2181 0.2728 -1.8545 S.O 1 UNL1111111111 1.2397 2 O 3.4120 -2.2804 0.3352 O.2 1 UNL1111111111 -0.3954 3 O 0.3355 -3.4685 0.6172 O.3 1 UNL1111111111 -0.4777 4 O -1.2939 1.7581 -1.8868 O.2 1 UNL1111111111 -0.8335 5 O 5.1629 2.9936 -0.2254 O.3 1 UNL1111111111 -0.5170 6 O -0.9970 -2.8491 -1.0530 O.2 1 UNL1111111111 -0.5327 7 O -5.2044 2.1667 1.0389 O.2 1 UNL1111111111 -0.4732 8 N 1.4368 -1.0270 0.9500 N.am 1 UNL1111111111 -0.4503 9 N -4.5875 0.0966 0.3502 N.am 1 UNL1111111111 -0.5806 10 C 1.7181 0.4908 1.0115 C.3 1 UNL1111111111 0.0440 11 C 0.8383 1.1155 -0.0873 C.3 1 UNL1111111111 -0.2909 12 C 3.1694 0.1879 0.6938 C.2 1 UNL1111111111 -0.2902 13 C 2.8423 -1.2716 0.5861 C.2 1 UNL1111111111 0.5897 14 C 0.4028 -1.2078 -0.0167 C.2 1 UNL1111111111 0.0254 15 C 0.0185 -0.0445 -0.5883 C.2 1 UNL1111111111 -0.2338 16 C 4.2870 0.8895 0.5407 C.2 1 UNL1111111111 0.0981 17 C -0.1633 -2.5463 -0.2303 C.2 1 UNL1111111111 0.6388 18 C 4.2938 2.3859 0.7044 C.3 1 UNL1111111111 -0.0342 19 C 5.5898 0.2553 0.2282 C.3 1 UNL1111111111 -0.4653 20 C -2.6254 -0.2804 -0.9575 C.2 1 UNL1111111111 -0.6226 21 C -3.4561 0.5660 -0.3262 C.2 1 UNL1111111111 0.1919 22 C -5.4432 0.9836 1.0320 C.2 1 UNL1111111111 0.6029 23 C -6.6132 0.3431 1.7130 C.3 1 UNL1111111111 -0.5305 24 H 1.5255 0.8908 2.0207 H 1 UNL1111111111 0.1663 25 H 1.4298 1.5860 -0.8960 H 1 UNL1111111111 0.1745 26 H 0.1962 1.9301 0.3095 H 1 UNL1111111111 0.1869 27 H 3.2873 2.8372 0.6195 H 1 UNL1111111111 0.1330 28 H 4.7349 2.6727 1.6848 H 1 UNL1111111111 0.1670 29 H 6.2417 0.2363 1.1185 H 1 UNL1111111111 0.1781 30 H 6.1467 0.8100 -0.5454 H 1 UNL1111111111 0.1793 31 H 5.4902 -0.7880 -0.1144 H 1 UNL1111111111 0.1772 32 H -2.7738 -1.3568 -0.9956 H 1 UNL1111111111 0.2021 33 H -0.0316 -4.3779 0.4501 H 1 UNL1111111111 0.3464 34 H 4.8115 2.8983 -1.1358 H 1 UNL1111111111 0.3126 35 H -3.3162 1.6654 -0.2962 H 1 UNL1111111111 0.2040 36 H -4.7753 -0.8974 0.3478 H 1 UNL1111111111 0.3140 37 H -7.2242 1.1113 2.2201 H 1 UNL1111111111 0.1959 38 H -6.3035 -0.3788 2.4817 H 1 UNL1111111111 0.1802 39 H -7.2741 -0.1749 1.0038 H 1 UNL1111111111 0.1797 @BOND 1 1 4 2 2 1 15 1 3 1 20 1 4 2 13 2 5 3 17 1 6 3 33 1 7 5 18 1 8 5 34 1 9 6 17 2 10 7 22 2 11 8 10 1 12 8 13 am 13 8 14 1 14 9 21 1 15 9 22 am 16 9 36 1 17 10 11 1 18 10 12 1 19 10 24 1 20 11 15 1 21 11 25 1 22 11 26 1 23 12 13 1 24 12 16 2 25 14 15 2 26 14 17 1 27 16 18 1 28 16 19 1 29 18 27 1 30 18 28 1 31 19 29 1 32 19 30 1 33 19 31 1 34 20 21 2 35 20 32 1 36 21 35 1 37 22 23 1 38 23 37 1 39 23 38 1 40 23 39 1