@MOLECULE (2r)-2-ammonio-4-{4-[(1z)-2-({(3s)-1-[(r)-carboxylato(4-hydroxyphenyl)methyl]-2-oxo-3-azetidinyl}amino)-n-hydroxy-2-oxoethanimidoyl]phenoxy}butanoate 36 33 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 0.0227 1.8472 1.4777 C.2 1 UNL1 -0.3508 2 O 1.1300 1.5871 3.7008 O.2 1 UNL1 -0.1280 3 C -1.3790 1.5832 1.3179 C.ar 1 UNL1 0.1282 4 N 0.7094 2.2656 0.3124 N.2 1 UNL1 0.1394 5 C -2.3229 1.1623 2.2620 C.ar 1 UNL1 -0.0913 6 C -2.2041 1.6774 0.1921 C.ar 1 UNL1 0.0591 7 O 1.8688 2.5224 0.3893 O.2 1 UNL1 -0.1955 8 C -3.5649 0.9382 2.1267 C.ar 1 UNL1 -0.0626 9 C -3.4467 1.4666 0.0216 C.ar 1 UNL1 -0.1627 10 C -4.3538 1.0509 0.9845 C.ar 1 UNL1 0.2279 11 O -5.7070 0.7995 0.9959 O.3 1 UNL1 -0.0967 12 C -6.2692 0.9044 -0.1820 C.1 1 UNL1 0.1633 13 C -6.9047 0.9619 -1.2154 C.1 1 UNL1 -0.1543 14 C -7.6278 1.0258 -2.3736 C.1 1 UNL1 0.1756 15 C -7.5107 -2.5822 -0.9641 C.1 1 UNL1 0.6412 16 N -8.2414 1.0744 -3.3569 N.1 1 UNL1 -0.2059 17 O -8.4547 -2.6321 -0.2776 O.2 1 UNL1 -0.3234 18 O -6.5642 -2.5275 -1.6465 O.2 1 UNL1 -0.3179 19 C 1.2143 -0.9677 -0.6154 C.3 2 UNL2 -0.1491 20 C -0.0356 -1.4193 -0.3306 C.1 2 UNL2 0.1868 21 C 2.0604 -1.0347 2.8912 C.2 2 UNL2 0.4075 22 O 2.6953 -1.9761 2.9550 O.2 2 UNL2 -0.4075 23 C 3.4252 -0.1919 -1.1810 C.3 2 UNL2 -0.2236 24 C 4.6410 0.2235 -1.4060 C.3 2 UNL2 0.2468 25 C 4.6684 -3.3970 0.6066 C.1 3 UNL3 0.6710 26 C 5.6441 0.8093 -0.5188 C.2 2 UNL2 -0.0464 27 C 5.4711 0.2293 -2.6069 C.2 2 UNL2 -0.0337 28 O 4.0858 -2.4761 0.1772 O.2 3 UNL3 -0.3801 29 O 5.2525 -4.3154 1.0232 O.2 3 UNL3 -0.2917 30 C 6.8114 1.1719 -0.7080 C.2 2 UNL2 -0.1568 31 C 6.6377 0.5880 -2.8091 C.2 2 UNL2 -0.1591 32 C 7.6734 1.1638 -1.9169 C.2 2 UNL2 0.5463 33 O 8.8010 1.4893 -2.0992 O.2 2 UNL2 -0.3056 34 N 2.2905 -0.5860 -0.9126 N.3 2 UNL2 0.2870 35 N -1.1009 -1.7979 -0.0648 N.1 2 UNL2 -0.1915 36 C 0.6064 1.7032 2.6867 C.1 1 UNL1 0.5544 @BOND 1 16 14 3 2 31 27 2 3 31 32 1 4 27 24 1 5 14 13 1 6 33 32 2 7 32 30 1 8 18 15 2 9 24 23 1 10 24 26 1 11 13 12 3 12 23 34 1 13 15 17 2 14 34 19 1 15 30 26 2 16 19 20 1 17 20 35 3 18 12 11 1 19 9 6 ar 20 9 10 ar 21 28 25 2 22 6 3 ar 23 4 7 2 24 4 1 1 25 25 29 2 26 10 11 1 27 10 8 ar 28 3 1 1 29 3 5 ar 30 1 36 2 31 8 5 ar 32 36 2 2 33 21 22 2