@MOLECULE (2's,3r,5'r)-3-chloro-3',3'-dimethyl-7'-oxo-3-(phenylcarbamoyl)spiro[oxirane-2,6'-[4]thia[1]azabicyclo[3.2.0]heptane]-2'-carboxylic acid 40 43 0 0 0 SMALL GASTEIGER @ATOM 1 CL -0.6833 2.5631 1.5794 Cl 1 UNL111111111 -0.0373 2 S 1.9729 0.3361 1.6025 S.3 1 UNL111111111 -0.0568 3 O 0.0106 2.6837 -0.9796 O.3 1 UNL111111111 -0.1767 4 O 0.3294 -0.2915 -2.4440 O.2 1 UNL111111111 -0.3386 5 O -2.7937 1.8683 -1.1412 O.2 1 UNL111111111 -0.4019 6 O 4.8670 -2.0149 -1.1519 O.3 1 UNL111111111 -0.5688 7 O 5.0052 0.0634 -0.3434 O.2 1 UNL111111111 -0.4542 8 N 2.2381 0.2176 -1.0790 N.am 1 UNL111111111 -0.4884 9 N -2.2689 0.1277 0.2711 N.am 1 UNL111111111 -0.5609 10 C 0.5829 1.4492 -0.6010 C.3 1 UNL111111111 -0.0469 11 C 1.9787 1.2341 -0.0020 C.3 1 UNL111111111 0.0065 12 C -0.6841 1.9091 -0.0201 C.3 1 UNL111111111 0.0463 13 C 0.8890 0.3080 -1.5938 C.2 1 UNL111111111 0.5496 14 C 2.8110 -1.0357 -0.6173 C.3 1 UNL111111111 -0.0339 15 C 2.3273 -1.3427 0.8350 C.3 1 UNL111111111 0.0516 16 C -2.0367 1.3318 -0.3772 C.2 1 UNL111111111 0.5536 17 C 1.0423 -2.1566 0.7875 C.3 1 UNL111111111 -0.4689 18 C 3.3840 -2.0509 1.6589 C.3 1 UNL111111111 -0.4797 19 C 4.3259 -0.8679 -0.6649 C.2 1 UNL111111111 0.6265 20 C -3.4535 -0.6388 0.1241 C.ar 1 UNL111111111 0.2135 21 C -3.7257 -1.5932 1.1193 C.ar 1 UNL111111111 -0.2465 22 C -4.3104 -0.4929 -0.9720 C.ar 1 UNL111111111 -0.2001 23 C -4.8596 -2.3898 1.0098 C.ar 1 UNL111111111 -0.1032 24 C -5.4426 -1.2987 -1.0608 C.ar 1 UNL111111111 -0.1014 25 C -5.7213 -2.2449 -0.0769 C.ar 1 UNL111111111 -0.1899 26 H 2.6798 2.0895 -0.0200 H 1 UNL111111111 0.2067 27 H 2.5127 -1.8697 -1.3187 H 1 UNL111111111 0.2071 28 H 0.5868 -2.2773 1.7805 H 1 UNL111111111 0.1655 29 H 0.2790 -1.7250 0.1273 H 1 UNL111111111 0.1569 30 H 1.2328 -3.1762 0.4174 H 1 UNL111111111 0.1656 31 H 3.0080 -2.3578 2.6455 H 1 UNL111111111 0.1667 32 H 3.7307 -2.9689 1.1579 H 1 UNL111111111 0.1704 33 H 4.2789 -1.4366 1.8464 H 1 UNL111111111 0.1755 34 H -1.6015 -0.2043 0.9644 H 1 UNL111111111 0.3223 35 H 5.8502 -1.9814 -1.2584 H 1 UNL111111111 0.3613 36 H -3.0649 -1.7066 1.9741 H 1 UNL111111111 0.1555 37 H -4.1045 0.2382 -1.7565 H 1 UNL111111111 0.1941 38 H -5.0770 -3.1295 1.7793 H 1 UNL111111111 0.1492 39 H -6.1149 -1.1857 -1.9117 H 1 UNL111111111 0.1552 40 H -6.6081 -2.8691 -0.1549 H 1 UNL111111111 0.1546 @BOND 1 1 12 1 2 2 11 1 3 2 15 1 4 3 10 1 5 3 12 1 6 4 13 2 7 5 16 2 8 6 19 1 9 6 35 1 10 7 19 2 11 8 11 1 12 8 13 am 13 8 14 1 14 9 16 am 15 9 20 1 16 9 34 1 17 10 11 1 18 10 12 1 19 10 13 1 20 11 26 1 21 12 16 1 22 14 15 1 23 14 19 1 24 14 27 1 25 15 17 1 26 15 18 1 27 17 28 1 28 17 29 1 29 17 30 1 30 18 31 1 31 18 32 1 32 18 33 1 33 20 21 ar 34 20 22 ar 35 21 23 ar 36 21 36 1 37 22 24 ar 38 22 37 1 39 23 25 ar 40 23 38 1 41 24 25 ar 42 24 39 1 43 25 40 1