@MOLECULE (6s,7r)-7-{[(2z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-8-oxo-3-[(2s)-tetrahydro-2-furanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 49 52 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.0810 2.7548 0.5106 S.3 1 UNL1111111111 -0.0159 2 S 4.3622 -3.2090 -0.1608 S.2 1 UNL1111111111 0.1602 3 O -5.9860 0.8248 0.0526 O.3 1 UNL1111111111 -0.4128 4 O 0.1016 -0.8529 1.9458 O.2 1 UNL1111111111 -0.3994 5 O -1.6308 -2.4787 -0.1452 O.3 1 UNL1111111111 -0.5311 6 OXT -3.4727 -2.3943 1.0944 O.2 1 UNL1111111111 -0.4928 7 O 3.0390 2.1136 1.5021 O.2 1 UNL1111111111 -0.4553 8 O 4.9874 2.7416 -0.6866 O.2 1 UNL1111111111 -0.1076 9 N -1.2127 0.1645 0.2457 N.am 1 UNL1111111111 -0.4865 10 N 1.6230 1.2819 -0.0871 N.am 1 UNL1111111111 -0.5624 11 N 5.0298 1.3782 -0.7784 N.2 1 UNL1111111111 -0.1504 12 N 2.6633 -1.2303 -0.3614 N.ar 1 UNL1111111111 -0.5402 13 N 1.5473 -3.3089 -0.3908 N.pl3 1 UNL1111111111 -0.5596 14 C -0.8609 1.5540 -0.1400 C.3 1 UNL1111111111 -0.0092 15 CA 0.4481 1.4228 0.7312 C.3 1 UNL1111111111 0.0213 16 C -3.6243 0.4326 0.1466 C.2 1 UNL1111111111 -0.0468 17 C -4.9995 -0.1940 0.1237 C.3 1 UNL1111111111 0.1089 18 C -0.1470 0.0240 1.1925 C.2 1 UNL1111111111 0.5486 19 CA -2.5151 -0.3274 0.2976 C.2 1 UNL1111111111 0.0233 20 C -3.6144 1.9070 -0.0175 C.3 1 UNL1111111111 -0.3273 21 C -5.2035 -1.1364 -1.0800 C.3 1 UNL1111111111 -0.3053 22 C -6.3860 -0.5414 -1.8602 C.3 1 UNL1111111111 -0.2962 23 C -6.5973 0.8399 -1.2325 C.3 1 UNL1111111111 -0.0286 24 C -2.6174 -1.7956 0.4943 C.2 1 UNL1111111111 0.6412 25 C 2.8782 1.4641 0.4989 C.2 1 UNL1111111111 0.5791 26 C 4.0143 0.7875 -0.2393 C.2 1 UNL1111111111 -0.0202 27 C 3.9480 -0.6791 -0.2735 C.ar 1 UNL1111111111 0.1775 28 C 4.9750 -1.5736 -0.1717 C.ar 1 UNL1111111111 -0.3526 29 C 2.6836 -2.5557 -0.2905 C.ar 1 UNL1111111111 0.3029 30 C 6.1695 3.2761 -1.3002 C.3 1 UNL1111111111 -0.2333 31 H -0.7025 1.6692 -1.2284 H 1 UNL1111111111 0.1784 32 HA 0.5834 2.1459 1.5636 H 1 UNL1111111111 0.2080 33 H -5.2168 -0.6915 1.1033 H 1 UNL1111111111 0.1772 34 H -4.4382 2.3677 0.5867 H 1 UNL1111111111 0.2090 35 H -3.8493 2.1711 -1.0717 H 1 UNL1111111111 0.1785 36 H -5.4172 -2.1653 -0.7403 H 1 UNL1111111111 0.1633 37 H -4.3016 -1.2012 -1.7108 H 1 UNL1111111111 0.1477 38 H -6.1763 -0.4785 -2.9391 H 1 UNL1111111111 0.1439 39 H -7.2864 -1.1710 -1.7539 H 1 UNL1111111111 0.1486 40 H 1.5523 0.5597 -0.8151 H 1 UNL1111111111 0.3399 41 H -6.1317 1.6511 -1.8148 H 1 UNL1111111111 0.1151 42 H -7.6521 1.0824 -1.0257 H 1 UNL1111111111 0.1375 43 H -1.7310 -3.4605 -0.0304 H 1 UNL1111111111 0.3475 44 H 6.0248 -1.3492 -0.0982 H 1 UNL1111111111 0.2024 45 H 6.0112 4.3541 -1.1761 H 1 UNL1111111111 0.1502 46 H 6.2259 3.0016 -2.3574 H 1 UNL1111111111 0.1453 47 H 7.0681 2.9456 -0.7703 H 1 UNL1111111111 0.1475 48 H 1.5371 -4.2373 -0.0140 H 1 UNL1111111111 0.3029 49 H 0.6659 -2.8069 -0.3146 H 1 UNL1111111111 0.3277 @BOND 1 1 14 1 2 1 20 1 3 2 28 ar 4 2 29 ar 5 3 17 1 6 3 23 1 7 4 18 2 8 5 24 1 9 5 43 1 10 6 24 2 11 7 25 2 12 8 11 1 13 8 30 1 14 9 14 1 15 9 18 am 16 9 19 1 17 10 15 1 18 10 25 am 19 10 40 1 20 11 26 2 21 12 27 ar 22 12 29 ar 23 13 29 1 24 13 48 1 25 13 49 1 26 14 15 1 27 14 31 1 28 15 18 1 29 15 32 1 30 16 17 1 31 16 19 2 32 16 20 1 33 17 21 1 34 17 33 1 35 19 24 1 36 20 34 1 37 20 35 1 38 21 22 1 39 21 36 1 40 21 37 1 41 22 23 1 42 22 38 1 43 22 39 1 44 23 41 1 45 23 42 1 46 25 26 1 47 26 27 1 48 27 28 ar 49 28 44 1 50 30 45 1 51 30 46 1 52 30 47 1