ULU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	C	sing	0.00Å	1.34Å
C	N1	doub	0.00Å	1.35Å	Aromatic
N1	C1	sing	0.00Å	1.34Å	Aromatic
C1	N2	doub	0.00Å	1.33Å	Aromatic
N2	C2	sing	0.00Å	1.34Å	Aromatic
C2	N3	sing	0.00Å	1.37Å	Aromatic
C3	N3	sing	0.00Å	1.37Å	Aromatic
N4	C3	doub	0.00Å	1.31Å	Aromatic
C4	N4	sing	0.00Å	1.39Å	Aromatic
C	C4	sing	0.00Å	1.41Å	Aromatic
C2	C4	doub	0.00Å	1.38Å	Aromatic
N3	C5	sing	0.00Å	1.46Å
C5	O	sing	0.00Å	1.42Å
O	C6	sing	0.00Å	1.44Å
C6	C7	sing	0.00Å	1.52Å
C7	N5	sing	0.00Å	1.47Å
N5	C8	sing	0.00Å	1.47Å
C8	C9	sing	0.00Å	1.52Å
C9	C10	sing	0.00Å	1.52Å
C10	N6	sing	0.00Å	1.46Å
N6	C11	sing	0.00Å	1.33Å
O1	C11	doub	0.00Å	1.23Å
C11	C12	sing	0.00Å	1.51Å
C12	C13	sing	0.00Å	1.52Å
C13	N7	sing	0.00Å	1.48Å
N7	N8	doub	0.00Å	1.25Å
N8	N9	doub	0.00Å	1.14Å
C14	N5	sing	0.00Å	1.46Å
C15	C14	sing	0.00Å	1.47Å
C16	C15	trip	0.00Å	1.19Å
C17	C16	sing	0.00Å	1.42Å
C17	N10	doub	0.00Å	1.32Å	Aromatic
N10	C18	sing	0.00Å	1.39Å	Aromatic
C18	C19	doub	0.00Å	1.41Å	Aromatic
N11	C19	sing	0.00Å	1.34Å
C19	N12	sing	0.00Å	1.35Å	Aromatic
N12	C20	doub	0.00Å	1.34Å	Aromatic
C20	N13	sing	0.00Å	1.34Å	Aromatic
N13	C21	doub	0.00Å	1.34Å	Aromatic
C18	C21	sing	0.00Å	1.38Å	Aromatic
C21	N14	sing	0.00Å	1.38Å	Aromatic
N14	C17	sing	0.00Å	1.39Å	Aromatic
C22	N14	sing	0.00Å	1.46Å
C22	O2	sing	0.00Å	1.41Å
O2	C23	sing	0.00Å	1.45Å
C24	C23	sing	0.00Å	1.51Å
O3	C24	sing	0.00Å	1.42Å
C23	C25	sing	0.00Å	1.54Å
O4	C25	sing	0.00Å	1.42Å
C25	C26	sing	0.00Å	1.53Å
C26	C22	sing	0.00Å	1.52Å
O5	C26	sing	0.00Å	1.42Å
C27	C6	sing	0.00Å	1.52Å
O6	C27	sing	0.00Å	1.42Å
C28	C27	sing	0.00Å	1.54Å
C5	C28	sing	0.00Å	1.54Å
O7	C28	sing	0.00Å	1.42Å
C7	H8	sing	0.00Å	1.10Å
C7	H9	sing	0.00Å	1.10Å
C8	H10	sing	0.00Å	1.10Å
C8	H11	sing	0.00Å	1.10Å
C9	H12	sing	0.00Å	1.10Å
C9	H13	sing	0.00Å	1.10Å
C1	H6	sing	0.00Å	1.08Å
O5	H32	sing	0.00Å	0.95Å
C5	H	sing	0.00Å	1.10Å
C6	H1	sing	0.00Å	1.10Å
O4	H30	sing	0.00Å	0.95Å
C3	H7	sing	0.00Å	1.08Å
O3	H28	sing	0.00Å	0.95Å
N	H5	sing	0.00Å	1.00Å
N	H4	sing	0.00Å	1.00Å
C10	H15	sing	0.00Å	1.10Å
C10	H14	sing	0.00Å	1.10Å
C12	H17	sing	0.00Å	1.10Å
C12	H18	sing	0.00Å	1.10Å
C13	H19	sing	0.00Å	1.10Å
C13	H20	sing	0.00Å	1.10Å
C14	H22	sing	0.00Å	1.10Å
C14	H21	sing	0.00Å	1.10Å
C20	H25	sing	0.00Å	1.08Å
C22	H2	sing	0.00Å	1.10Å
C23	H3	sing	0.00Å	1.10Å
C24	H27	sing	0.00Å	1.10Å
C24	H26	sing	0.00Å	1.10Å
C25	H29	sing	0.00Å	1.10Å
C26	H31	sing	0.00Å	1.10Å
C27	H33	sing	0.00Å	1.10Å
C28	H35	sing	0.00Å	1.10Å
N11	H23	sing	0.00Å	1.00Å
N11	H24	sing	0.00Å	1.00Å
N6	H16	sing	0.00Å	1.00Å
N9	H38	sing	0.00Å	1.00Å
O6	H34	sing	0.00Å	0.95Å
O7	H36	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N	C	N1	118.4°	90.0°
N	C	C4	124.0°	90.0°
C	N	H5	109.5°	90.0°
C	N	H4	109.5°	90.0°
C	N1	C1	118.8°	90.0°
N1	C	C4	117.6°	90.0°
N1	C1	N2	128.8°	90.0°
N1	C1	H6	115.6°	90.0°
C1	N2	C2	111.1°	90.0°
N2	C1	H6	115.6°	90.0°
N2	C2	N3	127.4°	90.0°
N2	C2	C4	126.8°	90.0°
C2	N3	C3	105.6°	90.0°
N3	C2	C4	105.9°	90.0°
C2	N3	C5	126.8°	90.0°
N3	C3	N4	114.1°	90.0°
C3	N3	C5	127.5°	90.0°
N3	C3	H7	122.9°	90.0°
C3	N4	C4	103.7°	90.0°
N4	C3	H7	123.0°	90.0°
N4	C4	C	132.4°	90.0°
N4	C4	C2	110.7°	90.0°
C	C4	C2	116.9°	90.0°
N3	C5	O	108.8°	90.0°
N3	C5	C28	114.1°	90.0°
N3	C5	H	108.9°	90.0°
C5	O	C6	107.8°	90.0°
O	C5	C28	107.6°	90.0°
O	C5	H	109.5°	90.0°
O	C6	C7	109.9°	90.0°
O	C6	C27	103.7°	90.0°
O	C6	H1	109.6°	90.0°
C6	C7	N5	113.6°	90.0°
C7	C6	C27	116.2°	90.0°
C6	C7	H8	108.4°	90.0°
C6	C7	H9	108.4°	90.0°
C7	C6	H1	108.6°	90.0°
C7	N5	C8	112.5°	90.0°
C7	N5	C14	115.0°	90.0°
N5	C7	H8	108.4°	90.0°
N5	C7	H9	108.4°	90.0°
N5	C8	C9	114.9°	90.0°
C8	N5	C14	110.3°	90.0°
N5	C8	H10	108.1°	90.0°
N5	C8	H11	108.1°	90.0°
C8	C9	C10	114.7°	90.0°
C9	C8	H10	108.1°	90.0°
C9	C8	H11	108.1°	90.0°
C8	C9	H12	108.2°	90.0°
C8	C9	H13	108.2°	90.0°
C9	C10	N6	112.2°	90.0°
C10	C9	H12	108.1°	90.0°
C10	C9	H13	108.2°	90.0°
C9	C10	H15	108.8°	90.0°
C9	C10	H14	108.8°	90.0°
C10	N6	C11	123.2°	90.0°
N6	C10	H15	108.8°	90.0°
N6	C10	H14	108.8°	90.0°
C10	N6	H16	118.4°	90.0°
N6	C11	O1	122.9°	90.0°
N6	C11	C12	115.7°	90.0°
C11	N6	H16	118.4°	90.0°
O1	C11	C12	121.4°	90.0°
C11	C12	C13	112.4°	90.0°
C11	C12	H17	108.7°	90.0°
C11	C12	H18	108.7°	90.0°
C12	C13	N7	109.5°	90.0°
C13	C12	H17	108.7°	90.0°
C13	C12	H18	108.7°	90.0°
C12	C13	H19	109.5°	90.0°
C12	C13	H20	109.4°	90.0°
C13	N7	N8	119.6°	90.0°
N7	C13	H19	109.4°	90.0°
N7	C13	H20	109.4°	90.0°
N7	N8	N9	169.0°	90.0°
N8	N9	H38	112.0°	90.0°
N5	C14	C15	114.9°	90.0°
N5	C14	H22	108.1°	90.0°
N5	C14	H21	108.1°	90.0°
C14	C15	C16	175.6°	90.0°
C15	C14	H22	108.1°	90.0°
C15	C14	H21	108.1°	90.0°
C15	C16	C17	176.1°	90.0°
C16	C17	N10	124.4°	90.0°
C16	C17	N14	122.4°	90.0°
C17	N10	C18	104.3°	90.0°
N10	C17	N14	113.1°	90.0°
N10	C18	C19	131.9°	90.0°
N10	C18	C21	111.0°	90.0°
C18	C19	N11	123.9°	90.0°
C18	C19	N12	117.6°	90.0°
C19	C18	C21	117.0°	90.0°
N11	C19	N12	118.5°	90.0°
C19	N11	H23	109.5°	90.0°
C19	N11	H24	109.4°	90.0°
C19	N12	C20	118.8°	90.0°
N12	C20	N13	128.8°	90.0°
N12	C20	H25	115.6°	90.0°
C20	N13	C21	111.2°	90.0°
N13	C20	H25	115.6°	90.0°
N13	C21	C18	126.6°	90.0°
N13	C21	N14	127.7°	90.0°
C18	C21	N14	105.7°	90.0°
C21	N14	C17	105.9°	90.0°
C21	N14	C22	125.7°	90.0°
C17	N14	C22	128.4°	90.0°
N14	C22	O2	109.7°	90.0°
N14	C22	C26	117.2°	90.0°
N14	C22	H2	108.3°	90.0°
C22	O2	C23	108.1°	90.0°
O2	C22	C26	105.1°	90.0°
O2	C22	H2	108.8°	90.0°
O2	C23	C24	109.5°	90.0°
O2	C23	C25	106.6°	90.0°
O2	C23	H3	109.1°	90.0°
C23	C24	O3	111.5°	90.0°
C24	C23	C25	115.3°	90.0°
C24	C23	H3	108.2°	90.0°
C23	C24	H27	109.0°	90.0°
C23	C24	H26	109.0°	90.0°
C24	O3	H28	109.5°	90.0°
O3	C24	H27	109.0°	90.0°
O3	C24	H26	108.9°	90.0°
C23	C25	O4	110.0°	90.0°
C23	C25	C26	103.2°	90.0°
C25	C23	H3	108.0°	90.0°
C23	C25	H29	110.2°	90.0°
O4	C25	C26	111.0°	90.0°
C25	O4	H30	109.5°	90.0°
O4	C25	H29	111.9°	90.0°
C25	C26	C22	100.3°	90.0°
C25	C26	O5	112.5°	90.0°
C26	C25	H29	110.2°	90.0°
C25	C26	H31	110.3°	90.0°
C22	C26	O5	110.7°	90.0°
C26	C22	H2	107.5°	90.0°
C22	C26	H31	110.5°	90.0°
C26	O5	H32	109.5°	90.0°
O5	C26	H31	112.0°	90.0°
C6	C27	O6	111.0°	90.0°
C6	C27	C28	102.7°	90.0°
C27	C6	H1	108.6°	90.0°
C6	C27	H33	110.0°	90.0°
O6	C27	C28	111.6°	90.0°
O6	C27	H33	111.4°	90.0°
C27	O6	H34	109.5°	90.0°
C27	C28	C5	103.4°	90.0°
C27	C28	O7	111.6°	90.0°
C28	C27	H33	109.8°	90.0°
C27	C28	H35	109.8°	90.0°
C5	C28	O7	110.7°	90.0°
C28	C5	H	107.9°	90.0°
C5	C28	H35	109.7°	90.0°
O7	C28	H35	111.4°	90.0°
C28	O7	H36	109.5°	90.0°
H8	C7	H9	109.4°	90.0°
H10	C8	H11	109.4°	90.0°
H12	C9	H13	109.5°	90.0°
H5	N	H4	109.5°	90.0°
H15	C10	H14	109.4°	90.0°
H17	C12	H18	109.5°	90.0°
H19	C13	H20	109.5°	90.0°
H22	C14	H21	109.5°	90.0°
H27	C24	H26	109.5°	90.0°
H23	N11	H24	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N	C	N1	C4	180.0°	90.0°
N	C	N1	C1	180.0°	90.0°
N	C	C4	N4	0.2°	90.0°
N	C	C4	C2	179.9°	90.0°
C	N	H5	H4	120.0°	90.0°
C	N1	C1	N2	0.1°	90.0°
N1	C	C4	N4	179.8°	90.0°
N1	C	C4	C2	0.1°	90.0°
C	N1	C1	H6	179.9°	90.0°
N1	C	N	H5	0.0°	90.0°
N1	C	N	H4	120.0°	90.0°
N1	C1	N2	H6	180.0°	90.0°
N1	C1	N2	C2	0.2°	90.0°
C1	N1	C	C4	0.0°	90.0°
C1	N2	C2	N3	179.3°	90.0°
C1	N2	C2	C4	0.3°	90.0°
N2	C2	N3	C4	179.7°	90.0°
N2	C2	N3	C3	179.9°	90.0°
N2	C2	C4	N4	180.0°	90.0°
N2	C2	C4	C	0.2°	90.0°
N2	C2	N3	C5	1.5°	90.0°
C2	N2	C1	H6	179.8°	90.0°
C2	N3	C3	C5	178.4°	90.0°
C2	N3	C3	N4	0.1°	90.0°
N3	C2	C4	N4	0.3°	90.0°
N3	C2	C4	C	179.5°	90.0°
C2	N3	C5	O	128.8°	90.0°
C2	N3	C5	C28	111.0°	90.0°
C2	N3	C5	H	9.6°	90.0°
C2	N3	C3	H7	179.9°	90.0°
N3	C3	N4	H7	180.0°	90.0°
N3	C3	N4	C4	0.0°	90.0°
C3	N3	C2	C4	0.2°	90.0°
C3	N3	C5	O	53.1°	90.0°
C3	N3	C5	C28	67.1°	90.0°
C3	N3	C5	H	172.4°	90.0°
C3	N4	C4	C	179.5°	90.0°
C3	N4	C4	C2	0.2°	90.0°
N4	C3	N3	C5	178.2°	90.0°
N4	C4	C	C2	179.7°	90.0°
C4	N4	C3	H7	180.0°	90.0°
C4	C	N	H5	180.0°	90.0°
C4	C	N	H4	60.0°	90.0°
C4	C2	N3	C5	178.2°	90.0°
N3	C5	O	C28	124.2°	90.0°
N3	C5	O	H	118.9°	90.0°
N3	C5	O	C6	146.5°	90.0°
N3	C5	C28	C27	119.1°	90.0°
N3	C5	C28	H	121.1°	90.0°
N3	C5	C28	O7	121.3°	90.0°
C5	N3	C3	H7	1.8°	90.0°
N3	C5	C28	H35	2.0°	90.0°
C5	O	C6	C7	162.5°	90.0°
C5	O	C6	C27	37.6°	90.0°
O	C5	C28	C27	1.8°	90.0°
O	C5	C28	H	118.1°	90.0°
O	C5	C28	O7	117.8°	90.0°
C5	O	C6	H1	78.2°	90.0°
O	C5	C28	H35	118.9°	90.0°
O	C6	C7	C27	117.4°	90.0°
O	C6	C7	H1	119.9°	90.0°
O	C6	C7	N5	65.0°	90.0°
O	C6	C27	H1	116.6°	90.0°
O	C6	C27	O6	156.5°	90.0°
O	C6	C27	C28	37.1°	90.0°
C6	O	C5	C28	22.3°	90.0°
O	C6	C7	H8	174.3°	90.0°
O	C6	C7	H9	55.6°	90.0°
C6	O	C5	H	94.7°	90.0°
O	C6	C27	H33	79.8°	90.0°
C6	C7	N5	H8	120.6°	90.0°
C6	C7	N5	H9	120.6°	90.0°
C6	C7	N5	C8	153.3°	90.0°
C6	C7	N5	C14	79.3°	90.0°
C7	C6	C27	H1	122.7°	90.0°
C7	C6	C27	O6	82.7°	90.0°
C7	C6	C27	C28	157.8°	90.0°
C6	C7	H8	H9	118.1°	90.0°
C7	C6	C27	H33	41.0°	90.0°
C7	N5	C8	C14	129.8°	90.0°
C7	N5	C8	C9	49.7°	90.0°
C7	N5	C14	C15	78.6°	90.0°
N5	C7	C6	C27	177.6°	90.0°
N5	C7	H8	H9	118.1°	90.0°
C7	N5	C8	H10	170.5°	90.0°
C7	N5	C8	H11	71.1°	90.0°
N5	C7	C6	H1	54.9°	90.0°
C7	N5	C14	H22	42.2°	90.0°
C7	N5	C14	H21	160.6°	90.0°
N5	C8	C9	H10	120.8°	90.0°
N5	C8	C9	H11	120.8°	90.0°
N5	C8	C9	C10	61.5°	90.0°
C8	N5	C14	C15	152.9°	90.0°
C8	N5	C7	H8	86.1°	90.0°
C8	N5	C7	H9	32.7°	90.0°
N5	C8	H10	H11	117.5°	90.0°
N5	C8	C9	H12	177.8°	90.0°
N5	C8	C9	H13	59.3°	90.0°
C8	N5	C14	H22	86.3°	90.0°
C8	N5	C14	H21	32.1°	90.0°
C8	C9	C10	H12	120.8°	90.0°
C8	C9	C10	H13	120.8°	90.0°
C8	C9	C10	N6	40.7°	90.0°
C9	C8	N5	C14	179.5°	90.0°
C9	C8	H10	H11	117.5°	90.0°
C8	C9	H12	H13	117.6°	90.0°
C8	C9	C10	H15	161.1°	90.0°
C8	C9	C10	H14	79.7°	90.0°
C9	C10	N6	H15	120.4°	90.0°
C9	C10	N6	H14	120.4°	90.0°
C9	C10	N6	C11	110.9°	90.0°
C10	C9	C8	H10	59.3°	90.0°
C10	C9	C8	H11	177.7°	90.0°
C10	C9	H12	H13	117.6°	90.0°
C9	C10	H15	H14	118.7°	90.0°
C9	C10	N6	H16	69.1°	90.0°
C10	N6	C11	H16	180.0°	90.0°
C10	N6	C11	O1	1.1°	90.0°
C10	N6	C11	C12	179.0°	90.0°
N6	C10	C9	H12	80.1°	90.0°
N6	C10	C9	H13	161.5°	90.0°
N6	C10	H15	H14	118.8°	90.0°
N6	C11	O1	C12	179.9°	90.0°
N6	C11	C12	C13	138.1°	90.0°
C11	N6	C10	H15	9.5°	90.0°
C11	N6	C10	H14	128.7°	90.0°
N6	C11	C12	H17	17.6°	90.0°
N6	C11	C12	H18	101.5°	90.0°
O1	C11	C12	C13	42.1°	90.0°
O1	C11	C12	H17	162.5°	90.0°
O1	C11	C12	H18	78.4°	90.0°
O1	C11	N6	H16	178.9°	90.0°
C11	C12	C13	H17	120.5°	90.0°
C11	C12	C13	H18	120.4°	90.0°
C11	C12	C13	N7	63.9°	90.0°
C11	C12	H17	H18	118.6°	90.0°
C11	C12	C13	H19	176.1°	90.0°
C11	C12	C13	H20	56.1°	90.0°
C12	C11	N6	H16	1.0°	90.0°
C12	C13	N7	H19	120.0°	90.0°
C12	C13	N7	H20	120.0°	90.0°
C12	C13	N7	N8	131.2°	90.0°
C13	C12	H17	H18	118.7°	90.0°
C12	C13	H19	H20	120.0°	90.0°
C13	N7	N8	N9	0.6°	90.0°
N7	C13	C12	H17	56.6°	90.0°
N7	C13	C12	H18	175.7°	90.0°
N7	C13	H19	H20	120.0°	90.0°
N8	N7	C13	H19	108.8°	90.0°
N8	N7	C13	H20	11.1°	90.0°
N7	N8	N9	H38	0.0°	90.0°
N5	C14	C15	H22	120.8°	90.0°
N5	C14	C15	H21	120.8°	90.0°
N5	C14	C15	C16	95.6°	90.0°
C14	N5	C7	H8	41.3°	90.0°
C14	N5	C7	H9	160.0°	90.0°
C14	N5	C8	H10	59.7°	90.0°
C14	N5	C8	H11	58.7°	90.0°
N5	C14	H22	H21	117.5°	90.0°
C14	C15	C16	C17	10.5°	90.0°
C15	C14	H22	H21	117.5°	90.0°
C15	C16	C17	N10	5.0°	90.0°
C15	C16	C17	N14	172.4°	90.0°
C16	C15	C14	H22	25.2°	90.0°
C16	C15	C14	H21	143.6°	90.0°
C16	C17	N10	N14	177.5°	90.0°
C16	C17	N10	C18	177.0°	90.0°
C16	C17	N14	C21	177.4°	90.0°
C16	C17	N14	C22	0.4°	90.0°
C17	N10	C18	C19	177.6°	90.0°
C17	N10	C18	C21	0.7°	90.0°
N10	C17	N14	C21	0.2°	90.0°
N10	C17	N14	C22	178.0°	90.0°
N10	C18	C19	C21	178.3°	90.0°
N10	C18	C19	N11	0.6°	90.0°
N10	C18	C19	N12	178.6°	90.0°
N10	C18	C21	N13	179.4°	90.0°
N10	C18	C21	N14	0.7°	90.0°
C18	N10	C17	N14	0.5°	90.0°
C18	C19	N11	N12	179.2°	90.0°
C18	C19	N12	C20	0.1°	90.0°
C19	C18	C21	N13	0.7°	90.0°
C19	C18	C21	N14	178.0°	90.0°
C18	C19	N11	H23	179.2°	90.0°
C18	C19	N11	H24	59.2°	90.0°
N11	C19	N12	C20	179.3°	90.0°
N11	C19	C18	C21	178.9°	90.0°
C19	N11	H23	H24	120.0°	90.0°
C19	N12	C20	N13	0.2°	90.0°
N12	C19	C18	C21	0.3°	90.0°
C19	N12	C20	H25	179.8°	90.0°
N12	C19	N11	H23	0.0°	90.0°
N12	C19	N11	H24	120.0°	90.0°
N12	C20	N13	H25	180.0°	90.0°
N12	C20	N13	C21	0.2°	90.0°
C20	N13	C21	C18	0.6°	90.0°
C20	N13	C21	N14	177.8°	90.0°
N13	C21	C18	N14	178.7°	90.0°
N13	C21	N14	C17	179.0°	90.0°
N13	C21	N14	C22	1.1°	90.0°
C21	N13	C20	H25	179.9°	90.0°
C18	C21	N14	C17	0.3°	90.0°
C18	C21	N14	C22	177.6°	90.0°
C21	N14	C17	C22	177.8°	90.0°
C21	N14	C22	O2	108.4°	90.0°
C21	N14	C22	C26	131.9°	90.0°
C21	N14	C22	H2	10.3°	90.0°
C17	N14	C22	O2	69.0°	90.0°
C17	N14	C22	C26	50.7°	90.0°
C17	N14	C22	H2	172.3°	90.0°
N14	C22	O2	C26	126.8°	90.0°
N14	C22	O2	H2	118.3°	90.0°
N14	C22	O2	C23	160.4°	90.0°
N14	C22	C26	C25	163.4°	90.0°
N14	C22	C26	H2	122.1°	90.0°
N14	C22	C26	O5	77.7°	90.0°
N14	C22	C26	H31	46.9°	90.0°
C22	O2	C23	C24	136.9°	90.0°
C22	O2	C23	C25	11.5°	90.0°
O2	C22	C26	C25	41.2°	90.0°
O2	C22	C26	H2	115.8°	90.0°
O2	C22	C26	O5	160.1°	90.0°
C22	O2	C23	H3	104.8°	90.0°
O2	C22	C26	H31	75.2°	90.0°
O2	C23	C24	C25	120.2°	90.0°
O2	C23	C24	H3	118.8°	90.0°
O2	C23	C24	O3	63.3°	90.0°
O2	C23	C25	H3	117.1°	90.0°
O2	C23	C25	O4	103.9°	90.0°
O2	C23	C25	C26	14.7°	90.0°
C23	O2	C22	C26	33.6°	90.0°
C23	O2	C22	H2	81.3°	90.0°
O2	C23	C24	H27	57.0°	90.0°
O2	C23	C24	H26	176.4°	90.0°
O2	C23	C25	H29	132.3°	90.0°
C23	C24	O3	H27	120.3°	90.0°
C23	C24	O3	H26	120.3°	90.0°
C24	C23	C25	H3	121.2°	90.0°
C24	C23	C25	O4	134.4°	90.0°
C24	C23	C25	C26	107.1°	90.0°
C23	C24	O3	H28	180.0°	90.0°
C23	C24	H27	H26	119.1°	90.0°
C24	C23	C25	H29	10.6°	90.0°
O3	C24	C23	C25	56.9°	90.0°
O3	C24	C23	H3	177.9°	90.0°
O3	C24	H27	H26	119.1°	90.0°
C23	C25	O4	C26	113.6°	90.0°
C23	C25	O4	H29	122.8°	90.0°
C23	C25	C26	H29	117.6°	90.0°
C23	C25	C26	C22	32.8°	90.0°
C23	C25	C26	O5	150.4°	90.0°
C23	C25	O4	H30	180.0°	90.0°
C25	C23	C24	H27	177.2°	90.0°
C25	C23	C24	H26	63.4°	90.0°
C23	C25	C26	H31	83.8°	90.0°
O4	C25	C26	H29	124.5°	90.0°
O4	C25	C26	C22	85.0°	90.0°
O4	C25	C26	O5	32.6°	90.0°
O4	C25	C23	H3	13.2°	90.0°
O4	C25	C26	H31	158.4°	90.0°
C25	C26	C22	O5	118.9°	90.0°
C25	C26	C22	H31	116.4°	90.0°
C25	C26	O5	H31	124.9°	90.0°
C25	C26	O5	H32	180.0°	90.0°
C26	C25	O4	H30	66.4°	90.0°
C25	C26	C22	H2	74.6°	90.0°
C26	C25	C23	H3	131.7°	90.0°
C22	C26	O5	H31	123.8°	90.0°
C22	C26	O5	H32	68.7°	90.0°
C22	C26	C25	H29	150.4°	90.0°
O5	C26	C22	H2	44.3°	90.0°
O5	C26	C25	H29	92.0°	90.0°
C6	C27	O6	C28	113.9°	90.0°
C6	C27	O6	H33	123.0°	90.0°
C6	C27	C28	H33	117.0°	90.0°
C6	C27	C28	C5	23.3°	90.0°
C6	C27	C28	O7	95.7°	90.0°
C27	C6	C7	H8	56.9°	90.0°
C27	C6	C7	H9	61.8°	90.0°
C6	C27	C28	H35	140.4°	90.0°
C6	C27	O6	H34	180.0°	90.0°
O6	C27	C28	H33	124.0°	90.0°
O6	C27	C28	C5	142.3°	90.0°
O6	C27	C28	O7	23.3°	90.0°
O6	C27	C6	H1	39.9°	90.0°
O6	C27	C28	H35	100.7°	90.0°
C27	C28	C5	O7	119.6°	90.0°
C27	C28	C5	H35	117.1°	90.0°
C27	C28	O7	H35	123.1°	90.0°
C27	C28	C5	H	119.8°	90.0°
C28	C27	C6	H1	79.5°	90.0°
C28	C27	O6	H34	66.1°	90.0°
C27	C28	O7	H36	180.0°	90.0°
C5	C28	O7	H35	122.4°	90.0°
C5	C28	C27	H33	93.7°	90.0°
C5	C28	O7	H36	65.5°	90.0°
O7	C28	C5	H	0.2°	90.0°
O7	C28	C27	H33	147.3°	90.0°
H8	C7	C6	H1	65.7°	90.0°
H9	C7	C6	H1	175.5°	90.0°
H10	C8	C9	H12	61.4°	90.0°
H10	C8	C9	H13	179.9°	90.0°
H11	C8	C9	H12	57.0°	90.0°
H11	C8	C9	H13	61.5°	90.0°
H12	C9	C10	H15	40.4°	90.0°
H12	C9	C10	H14	159.5°	90.0°
H13	C9	C10	H15	78.1°	90.0°
H13	C9	C10	H14	41.0°	90.0°
H32	O5	C26	H31	55.1°	90.0°
H	C5	C28	H35	123.1°	90.0°
H1	C6	C27	H33	163.7°	90.0°
H30	O4	C25	H29	57.2°	90.0°
H28	O3	C24	H27	59.7°	90.0°
H28	O3	C24	H26	59.7°	90.0°
H15	C10	N6	H16	170.5°	90.0°
H14	C10	N6	H16	51.3°	90.0°
H17	C12	C13	H19	63.4°	90.0°
H17	C12	C13	H20	176.6°	90.0°
H18	C12	C13	H19	55.7°	90.0°
H18	C12	C13	H20	64.3°	90.0°
H2	C22	C26	H31	169.0°	90.0°
H3	C23	C24	H27	61.8°	90.0°
H3	C23	C24	H26	57.6°	90.0°
H3	C23	C25	H29	110.6°	90.0°
H29	C25	C26	H31	33.9°	90.0°
H33	C27	C28	H35	23.4°	90.0°
H33	C27	O6	H34	57.0°	90.0°
H35	C28	O7	H36	56.9°	90.0°

Release date:	2025-03-19
Definition date:	2023-09-06
Last modified:	2025-03-14
Release status:	REL
Processing site:	PDBE
Derived from:	8QGH