@MOLECULE (6s,7s)-7-({n-[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]-d-allothreonyl}amino)-7-methoxy-3-{[(1-methyl-1h-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 71 74 0 0 0 SMALL GASTEIGER @ATOM 1 S 1.3710 1.2567 -1.7630 S.3 1 UNL1111111111 0.0406 2 S 6.1990 1.5952 -1.4288 S.3 1 UNL1111111111 0.1513 3 O -0.0230 1.2887 0.7766 O.3 1 UNL1111111111 -0.3536 4 O 2.2035 -0.4481 2.4201 O.2 1 UNL1111111111 -0.3746 5 O -1.6026 -1.0277 -1.0612 O.2 1 UNL1111111111 -0.4882 6 O 5.3021 -1.9073 0.1029 O.3 1 UNL1111111111 -0.5155 7 O 5.0759 -0.1474 1.4654 O.2 1 UNL1111111111 -0.4839 8 O -2.1537 -3.6475 -1.2408 O.3 1 UNL1111111111 -0.5437 9 O -3.7645 -0.0927 2.0203 O.2 1 UNL1111111111 -0.5723 10 O -5.9078 -0.8461 -1.3492 O.2 1 UNL1111111111 -0.4507 11 O -7.6676 1.1502 -2.1520 O.2 1 UNL1111111111 -0.4204 12 N 2.3296 -0.5894 0.0356 N.am 1 UNL1111111111 -0.4708 13 N -0.6490 -0.9910 1.0035 N.am 1 UNL1111111111 -0.6257 14 N -4.0203 -1.5814 0.3125 N.am 1 UNL1111111111 -0.5665 15 N -5.4824 0.3045 0.5643 N.am 1 UNL1111111111 -0.5511 16 N -7.8192 1.8463 0.0030 N.am 1 UNL1111111111 -0.4829 17 N 7.6275 1.2058 0.9575 N.ar 1 UNL1111111111 -0.1192 18 N 8.0428 -0.3195 -0.5732 N.ar 1 UNL1111111111 -0.2692 19 N 8.5491 0.3302 1.4475 N.ar 1 UNL1111111111 -0.0923 20 N 8.7707 -0.5625 0.5262 N.ar 1 UNL1111111111 -0.0378 21 C 0.3575 -0.0301 0.6425 C.3 1 UNL1111111111 0.3233 22 C 1.1007 -0.2329 -0.7322 C.3 1 UNL1111111111 -0.0186 23 C 1.7711 -0.3534 1.3243 C.2 1 UNL1111111111 0.5153 24 C 3.6163 -0.3853 -0.4460 C.2 1 UNL1111111111 0.0835 25 C 3.9119 0.1185 -1.6677 C.2 1 UNL1111111111 -0.0430 26 C 2.8774 0.6264 -2.6099 C.3 1 UNL1111111111 -0.3185 27 C -1.6307 -1.3671 0.0981 C.2 1 UNL1111111111 0.5688 28 C -2.7670 -2.2395 0.6704 C.3 1 UNL1111111111 -0.0677 29 C 5.3095 0.1652 -2.1717 C.3 1 UNL1111111111 -0.3408 30 C 4.7017 -0.7686 0.5069 C.2 1 UNL1111111111 0.6282 31 C -0.5936 1.6475 2.0285 C.3 1 UNL1111111111 -0.2048 32 C -2.6547 -3.6732 0.0662 C.3 1 UNL1111111111 0.1731 33 C -3.9788 -4.4257 0.1035 C.3 1 UNL1111111111 -0.4937 34 C -4.3586 -0.4464 1.0158 C.2 1 UNL1111111111 0.7275 35 C -5.8564 1.4609 1.4023 C.3 1 UNL1111111111 -0.0814 36 C -7.3888 1.6232 1.3860 C.3 1 UNL1111111111 -0.0999 37 C -6.1675 0.0907 -0.6327 C.2 1 UNL1111111111 0.5150 38 C 7.3018 0.7999 -0.3334 C.ar 1 UNL1111111111 0.0109 39 C -7.3017 1.0646 -1.0055 C.2 1 UNL1111111111 0.4903 40 C -9.0835 2.5617 -0.2169 C.3 1 UNL1111111111 -0.0409 41 C -10.2991 1.7200 0.1786 C.3 1 UNL1111111111 -0.4762 42 C 7.0486 2.2506 1.7816 C.3 1 UNL1111111111 -0.2371 43 H 0.7217 -1.0877 -1.3357 H 1 UNL1111111111 0.2067 44 H -0.7526 -1.1904 1.9937 H 1 UNL1111111111 0.3305 45 H 2.5924 -0.1674 -3.3340 H 1 UNL1111111111 0.1785 46 H 3.2569 1.4763 -3.2164 H 1 UNL1111111111 0.1792 47 H -2.7067 -2.3177 1.7909 H 1 UNL1111111111 0.1790 48 H 5.3599 0.2814 -3.2754 H 1 UNL1111111111 0.1858 49 H 5.8546 -0.7915 -1.9798 H 1 UNL1111111111 0.2138 50 H -0.6699 2.7397 1.9396 H 1 UNL1111111111 0.1559 51 H 0.0639 1.3735 2.8586 H 1 UNL1111111111 0.1374 52 H -1.5936 1.2096 2.1377 H 1 UNL1111111111 0.1503 53 H -1.8538 -4.2344 0.6120 H 1 UNL1111111111 0.1535 54 H -4.4385 -1.7863 -0.5974 H 1 UNL1111111111 0.3597 55 H -3.8296 -5.4724 -0.1981 H 1 UNL1111111111 0.1679 56 H -4.4289 -4.4209 1.1017 H 1 UNL1111111111 0.1572 57 H -4.7157 -4.0094 -0.5952 H 1 UNL1111111111 0.1637 58 H 6.1374 -2.1109 0.6097 H 1 UNL1111111111 0.3670 59 H -5.3506 2.3775 1.0161 H 1 UNL1111111111 0.1655 60 H -5.4939 1.3104 2.4490 H 1 UNL1111111111 0.1847 61 H -7.8875 0.7269 1.8228 H 1 UNL1111111111 0.1499 62 H -7.6829 2.4941 2.0150 H 1 UNL1111111111 0.1602 63 H -2.5393 -2.9174 -1.7740 H 1 UNL1111111111 0.3392 64 H -9.1460 2.8424 -1.2991 H 1 UNL1111111111 0.1719 65 H -9.0566 3.5146 0.3574 H 1 UNL1111111111 0.1387 66 H -11.2316 2.2533 -0.0429 H 1 UNL1111111111 0.1572 67 H -10.3045 1.4747 1.2450 H 1 UNL1111111111 0.1463 68 H -10.3291 0.7746 -0.3804 H 1 UNL1111111111 0.1656 69 H 7.0640 3.2238 1.2583 H 1 UNL1111111111 0.1669 70 H 7.6100 2.3533 2.7331 H 1 UNL1111111111 0.1845 71 H 5.9947 1.9916 2.0387 H 1 UNL1111111111 0.1963 @BOND 1 1 22 1 2 1 26 1 3 2 29 1 4 2 38 1 5 3 21 1 6 3 31 1 7 4 23 2 8 5 27 2 9 6 30 1 10 6 58 1 11 7 30 2 12 8 32 1 13 8 63 1 14 9 34 2 15 10 37 2 16 11 39 2 17 12 22 1 18 12 23 am 19 12 24 1 20 13 21 1 21 13 27 am 22 13 44 1 23 14 28 1 24 14 34 am 25 14 54 1 26 15 34 am 27 15 35 1 28 15 37 am 29 16 36 1 30 16 39 am 31 16 40 1 32 17 19 ar 33 17 38 ar 34 17 42 1 35 18 20 ar 36 18 38 ar 37 19 20 ar 38 21 22 1 39 21 23 1 40 22 43 1 41 24 25 2 42 24 30 1 43 25 26 1 44 25 29 1 45 26 45 1 46 26 46 1 47 27 28 1 48 28 32 1 49 28 47 1 50 29 48 1 51 29 49 1 52 31 50 1 53 31 51 1 54 31 52 1 55 32 33 1 56 32 53 1 57 33 55 1 58 33 56 1 59 33 57 1 60 35 36 1 61 35 59 1 62 35 60 1 63 36 61 1 64 36 62 1 65 37 39 1 66 40 41 1 67 40 64 1 68 40 65 1 69 41 66 1 70 41 67 1 71 41 68 1 72 42 69 1 73 42 70 1 74 42 71 1