RESIDUE 4O5 44 CONECT C1 4 N2 H1 H2 H3 CONECT N2 3 C1 C3 H4 CONECT C3 3 N2 O4 C5 CONECT O4 1 C3 CONECT C5 3 C3 C6 C11 CONECT C6 3 C5 C7 H5 CONECT C7 3 C6 C8 H6 CONECT C8 3 C7 C9 N12 CONECT C9 3 C8 F10 C11 CONECT F10 1 C9 CONECT C11 3 C5 C9 H7 CONECT N12 3 C8 C13 C28 CONECT C13 3 N12 C14 H8 CONECT C14 3 C13 C15 H9 CONECT C15 4 C14 N16 C28 H10 CONECT N16 3 C15 S17 H11 CONECT S17 4 N16 O18 O19 C20 CONECT O18 1 S17 CONECT O19 1 S17 CONECT C20 3 S17 C21 H12 CONECT C21 3 C20 C22 H13 CONECT C22 3 C21 C23 S27 CONECT C23 3 C22 C24 H14 CONECT C24 3 C23 C25 H15 CONECT C25 3 C24 CL26 S27 CONECT CL26 1 C25 CONECT S27 2 C22 C25 CONECT C28 3 N12 C15 O29 CONECT O29 1 C28 CONECT H1 1 C1 CONECT H2 1 C1 CONECT H3 1 C1 CONECT H4 1 N2 CONECT H5 1 C6 CONECT H6 1 C7 CONECT H7 1 C11 CONECT H8 1 C13 CONECT H9 1 C14 CONECT H10 1 C15 CONECT H11 1 N16 CONECT H12 1 C20 CONECT H13 1 C21 CONECT H14 1 C23 CONECT H15 1 C24 END HET 4O5 44 HETNAM 4O5 4-[(3S)-3-({[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfo HETNAM 2 4O5 nyl}amino)-2-oxo-2,3-dihydro-1H-pyrrol-1-yl]-3-fluoro-N HETNAM 3 4O5 -methylbenzamide FORMUL 4O5 C18 H15 Cl1 F1 N3 O4 S2