RESIDUE 3CQ 79 CONECT N42 2 C43 C21 CONECT C43 3 N42 C44 C20 CONECT C44 3 C43 O45 O46 CONECT O45 1 C44 CONECT O46 2 C44 H1 CONECT C1 2 C2 C13 CONECT C2 2 C1 C29 CONECT C3 3 C4 C9 H2 CONECT C4 3 C3 C11 H3 CONECT C5 3 C7 C8 H4 CONECT C6 3 C10 C13 H5 CONECT C7 3 C5 C14 H6 CONECT C8 3 C5 C15 H7 CONECT C9 3 C3 C17 H8 CONECT C10 3 C6 C18 F47 CONECT C11 3 C4 C19 H9 CONECT C12 3 C18 C33 H10 CONECT C13 3 C1 C6 C33 CONECT C14 3 C7 C16 C23 CONECT C15 3 C8 C16 C24 CONECT C16 3 C14 C15 C25 CONECT C17 3 C9 C19 N34 CONECT C18 3 C10 C12 O39 CONECT C19 3 C11 C17 S40 CONECT C22 3 N34 N36 S40 CONECT C23 3 C14 N36 O38 CONECT C24 4 C15 C26 H11 H12 CONECT C25 4 C16 N35 H13 H14 CONECT C26 4 C24 N35 H15 H16 CONECT C20 3 C43 C30 S41 CONECT C21 3 N42 N35 S41 CONECT C27 4 N37 H17 H18 H19 CONECT C28 4 N37 H20 H21 H22 CONECT C29 4 C2 N37 H23 H24 CONECT C30 4 C20 C31 H25 H26 CONECT C31 4 C30 C32 H27 H28 CONECT C32 4 C31 O39 H29 H30 CONECT C33 3 C12 C13 H31 CONECT N34 2 C17 C22 CONECT N36 3 C22 C23 H32 CONECT N35 3 C25 C26 C21 CONECT N37 3 C27 C28 C29 CONECT O38 1 C23 CONECT O39 2 C18 C32 CONECT S40 2 C19 C22 CONECT S41 2 C20 C21 CONECT F47 1 C10 CONECT H1 1 O46 CONECT H2 1 C3 CONECT H3 1 C4 CONECT H4 1 C5 CONECT H5 1 C6 CONECT H6 1 C7 CONECT H7 1 C8 CONECT H8 1 C9 CONECT H9 1 C11 CONECT H10 1 C12 CONECT H11 1 C24 CONECT H12 1 C24 CONECT H13 1 C25 CONECT H14 1 C25 CONECT H15 1 C26 CONECT H16 1 C26 CONECT H17 1 C27 CONECT H18 1 C27 CONECT H19 1 C27 CONECT H20 1 C28 CONECT H21 1 C28 CONECT H22 1 C28 CONECT H23 1 C29 CONECT H24 1 C29 CONECT H25 1 C30 CONECT H26 1 C30 CONECT H27 1 C31 CONECT H28 1 C31 CONECT H29 1 C32 CONECT H30 1 C32 CONECT H31 1 C33 CONECT H32 1 N36 END HET 3CQ 79 HETNAM 3CQ 2-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydroisoqui HETNAM 2 3CQ nolin-2(1H)-yl]-5-(3-{4-[3-(dimethylamino)prop-1-yn-1-y HETNAM 3 3CQ l]-2-fluorophenoxy}propyl)-1,3-thiazole-4-carboxylic ac HETNAM 4 3CQ id FORMUL 3CQ C35 H32 F1 N5 O4 S2