RESIDUE 1XI 44 CONECT C5 4 C6 N2 C20 H5 CONECT C6 4 C5 C7 O9 H6 CONECT C7 4 C6 C2 O8 H7 CONECT N1 3 C32 C2 HN1 CONECT N2 3 C5 C3 C22 CONECT C3 4 N2 C2 H3 H31 CONECT C33 4 C32 H33 H331 H332 CONECT C32 3 N1 C33 O34 CONECT O34 1 C32 CONECT C2 4 C7 N1 C3 H2 CONECT C22 3 N2 N23 S21 CONECT N23 2 C22 C24 CONECT C24 4 N23 C26 H241 H24 CONECT C26 3 C24 C27 C31 CONECT C27 3 C26 C28 H27 CONECT C28 3 C27 C29 H28 CONECT C29 3 C28 C30 H29 CONECT C30 3 C29 C31 H30 CONECT C31 3 C26 C30 H311 CONECT S21 2 C22 C20 CONECT C20 4 C5 S21 H20 H201 CONECT O9 2 C6 HO9 CONECT O8 2 C7 HO8 CONECT H5 1 C5 CONECT H6 1 C6 CONECT H7 1 C7 CONECT HN1 1 N1 CONECT H3 1 C3 CONECT H31 1 C3 CONECT H33 1 C33 CONECT H331 1 C33 CONECT H332 1 C33 CONECT H2 1 C2 CONECT H241 1 C24 CONECT H24 1 C24 CONECT H27 1 C27 CONECT H28 1 C28 CONECT H29 1 C29 CONECT H30 1 C30 CONECT H311 1 C31 CONECT H20 1 C20 CONECT H201 1 C20 CONECT HO9 1 O9 CONECT HO8 1 O8 END HET 1XI 44 HETNAM 1XI ~{N}-[(3~{Z},6~{S},7~{R},8~{R},8~{a}~{S})-7,8-bis(oxida HETNAM 2 1XI nyl)-3-(phenylmethyl)imino-1,5,6,7,8,8~{a}-hexahydro-[1 HETNAM 3 1XI ,3]thiazolo[3,4-a]pyridin-6-yl]ethanamide FORMUL 1XI C16 H21 N3 O3 S1