@MOLECULE [(2,2-dimethylpropanoyl)oxy]methyl (6r,7r)-7-{[(2z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-[(z)-2-(4-methyl-1,3-thiazol-5-yl)vinyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 69 72 0 0 0 SMALL GASTEIGER @ATOM 1 S -0.9266 -3.6986 -0.5262 S.3 1 UNL11111111111111 0.0157 2 S 4.0966 -2.7951 0.8177 S.2 1 UNL11111111111111 0.1603 3 S -2.6967 2.5746 -1.7995 S.2 1 UNL11111111111111 0.2063 4 O -0.7553 0.5238 1.4329 O.2 1 UNL11111111111111 -0.3694 5 O 2.3906 0.2387 0.7353 O.3 1 UNL11111111111111 -0.3853 6 O 1.6234 0.7019 -1.3494 O.2 1 UNL11111111111111 -0.5091 7 O -4.1869 -0.7562 2.4344 O.2 1 UNL11111111111111 -0.4471 8 O 1.8674 2.4344 0.7058 O.3 1 UNL11111111111111 -0.4560 9 O -6.6868 -1.1607 0.7979 O.2 1 UNL11111111111111 -0.1119 10 O 3.2530 4.1383 1.1068 O.2 1 UNL11111111111111 -0.5223 11 N 0.2214 -1.5551 0.7878 N.am 1 UNL11111111111111 -0.4898 12 N -2.9269 -1.7506 0.8003 N.am 1 UNL11111111111111 -0.5784 13 N -6.0242 -0.3227 -0.0566 N.2 1 UNL11111111111111 -0.1377 14 N -2.8336 0.0157 -1.3215 N.ar 1 UNL11111111111111 -0.5358 15 N 5.6094 -0.7172 1.0955 N.ar 1 UNL11111111111111 -0.3685 16 N -0.9661 0.5508 -2.6985 N.pl3 1 UNL11111111111111 -0.5610 17 C -0.5969 -2.7763 1.0219 C.3 1 UNL11111111111111 -0.0172 18 C -1.7441 -1.8637 1.6082 C.3 1 UNL11111111111111 0.0205 19 C -0.7577 -0.6518 1.3231 C.2 1 UNL11111111111111 0.5305 20 C 1.1004 -1.3992 -0.2771 C.2 1 UNL11111111111111 0.0802 21 C 0.8067 -3.7425 -1.1187 C.3 1 UNL11111111111111 -0.3149 22 C 1.4450 -2.3953 -1.1304 C.2 1 UNL11111111111111 -0.0808 23 C 1.7064 -0.0296 -0.3945 C.2 1 UNL11111111111111 0.6297 24 C 2.5003 -2.2589 -2.1333 C.2 1 UNL11111111111111 -0.1639 25 C -3.9707 -0.9352 1.2630 C.2 1 UNL11111111111111 0.5720 26 C -4.7547 -0.2521 0.1604 C.2 1 UNL11111111111111 -0.0227 27 C 3.7951 -2.0187 -1.8779 C.2 1 UNL11111111111111 -0.1062 28 C 2.9451 1.5311 0.9039 C.3 1 UNL11111111111111 0.2224 29 C 0.9251 4.5774 0.4323 C.3 1 UNL11111111111111 0.0655 30 C 4.3743 -1.7824 -0.5824 C.ar 1 UNL11111111111111 -0.2513 31 C -3.9193 0.6239 -0.6771 C.ar 1 UNL11111111111111 0.1621 32 C 2.1534 3.7601 0.8007 C.2 1 UNL11111111111111 0.6032 33 C 1.1792 6.0315 0.8374 C.3 1 UNL11111111111111 -0.4596 34 C 0.7714 4.4558 -1.0890 C.3 1 UNL11111111111111 -0.4533 35 C -0.3007 4.0213 1.1566 C.3 1 UNL11111111111111 -0.4537 36 C 5.2116 -0.7423 -0.2447 C.ar 1 UNL11111111111111 0.1661 37 C -4.0077 1.9793 -0.8122 C.ar 1 UNL11111111111111 -0.3464 38 C 5.7001 0.3233 -1.1483 C.3 1 UNL11111111111111 -0.4399 39 C -2.0625 0.9001 -1.9392 C.ar 1 UNL11111111111111 0.2813 40 C 5.1191 -1.7147 1.7843 C.ar 1 UNL11111111111111 -0.0191 41 C -8.0763 -1.1703 0.4407 C.3 1 UNL11111111111111 -0.2329 42 H -0.1207 -3.4416 1.7706 H 1 UNL11111111111111 0.1761 43 H -1.9726 -2.0212 2.6814 H 1 UNL11111111111111 0.1977 44 H 1.4038 -4.4459 -0.4980 H 1 UNL11111111111111 0.1789 45 H 0.7813 -4.1866 -2.1389 H 1 UNL11111111111111 0.1804 46 H -2.7713 -1.7514 -0.2204 H 1 UNL11111111111111 0.3511 47 H 2.1636 -2.4074 -3.1651 H 1 UNL11111111111111 0.1683 48 H 4.5139 -1.9574 -2.7080 H 1 UNL11111111111111 0.1677 49 H 3.7433 1.7198 0.1699 H 1 UNL11111111111111 0.1403 50 H 3.2561 1.5277 1.9658 H 1 UNL11111111111111 0.1593 51 H 0.3464 6.6754 0.5370 H 1 UNL11111111111111 0.1512 52 H 1.3069 6.1331 1.9223 H 1 UNL11111111111111 0.1561 53 H 2.0931 6.4266 0.3743 H 1 UNL11111111111111 0.1588 54 H -0.1021 5.0146 -1.4424 H 1 UNL11111111111111 0.1556 55 H 0.6430 3.4065 -1.3902 H 1 UNL11111111111111 0.1663 56 H 1.6466 4.8463 -1.6214 H 1 UNL11111111111111 0.1488 57 H -1.2137 4.5503 0.8623 H 1 UNL11111111111111 0.1536 58 H -0.2052 4.1032 2.2452 H 1 UNL11111111111111 0.1522 59 H -0.4570 2.9530 0.9349 H 1 UNL11111111111111 0.1811 60 H -4.7546 2.6249 -0.3801 H 1 UNL11111111111111 0.1994 61 H 6.3325 1.0562 -0.6155 H 1 UNL11111111111111 0.1839 62 H 6.3071 -0.0921 -1.9670 H 1 UNL11111111111111 0.1645 63 H 4.8687 0.8793 -1.6123 H 1 UNL11111111111111 0.1726 64 H 5.3067 -1.8736 2.8385 H 1 UNL11111111111111 0.1922 65 H -8.5001 -0.1621 0.4637 H 1 UNL11111111111111 0.1481 66 H -8.2221 -1.6233 -0.5449 H 1 UNL11111111111111 0.1444 67 H -8.5042 -1.7932 1.2356 H 1 UNL11111111111111 0.1497 68 H -0.7996 -0.4490 -2.7746 H 1 UNL11111111111111 0.2968 69 H -0.0954 1.0422 -2.5127 H 1 UNL11111111111111 0.3234 @BOND 1 1 17 1 2 1 21 1 3 2 30 ar 4 2 40 ar 5 3 37 ar 6 3 39 ar 7 4 19 2 8 5 23 1 9 5 28 1 10 6 23 2 11 7 25 2 12 8 28 1 13 8 32 1 14 9 13 1 15 9 41 1 16 10 32 2 17 11 17 1 18 11 19 am 19 11 20 1 20 12 18 1 21 12 25 am 22 12 46 1 23 13 26 2 24 14 31 ar 25 14 39 ar 26 15 36 ar 27 15 40 ar 28 16 39 1 29 16 68 1 30 16 69 1 31 17 18 1 32 17 42 1 33 18 19 1 34 18 43 1 35 20 22 2 36 20 23 1 37 21 22 1 38 21 44 1 39 21 45 1 40 22 24 1 41 24 27 2 42 24 47 1 43 25 26 1 44 26 31 1 45 27 30 1 46 27 48 1 47 28 49 1 48 28 50 1 49 29 32 1 50 29 33 1 51 29 34 1 52 29 35 1 53 30 36 ar 54 31 37 ar 55 33 51 1 56 33 52 1 57 33 53 1 58 34 54 1 59 34 55 1 60 34 56 1 61 35 57 1 62 35 58 1 63 35 59 1 64 36 38 1 65 37 60 1 66 38 61 1 67 38 62 1 68 38 63 1 69 40 64 1 70 41 65 1 71 41 66 1 72 41 67 1