PRD_002097

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	0.00Å	1.40Å	Aromatic
C1	C6	doub	0.00Å	1.39Å	Aromatic
C2	C3	doub	0.00Å	1.39Å	Aromatic
C3	C4	sing	0.00Å	1.41Å	Aromatic
C4	C5	doub	0.00Å	1.41Å	Aromatic
C5	C6	sing	0.00Å	1.41Å	Aromatic
C6	C7	sing	0.00Å	1.56Å
C7	C8	sing	0.00Å	1.57Å
C8	C9	sing	0.00Å	1.58Å
C8	N1	sing	0.00Å	1.50Å
C9	O1	doub	0.00Å	1.28Å
C9	O2	sing	0.00Å	1.24Å
N1	C10	sing	0.00Å	1.36Å
C10	O3	doub	0.00Å	1.25Å
C1	H1	sing	0.00Å	1.08Å
C2	H2	sing	0.00Å	1.08Å
C3	H3	sing	0.00Å	1.08Å
C4	H4	sing	0.00Å	1.08Å
C5	H5	sing	0.00Å	1.08Å
C7	H6	sing	0.00Å	1.10Å
C7	H7	sing	0.00Å	1.10Å
C8	H8	sing	0.00Å	1.10Å
N1	H9	sing	0.00Å	1.00Å
O2	H10	sing	0.00Å	0.95Å
N2	C11	sing	0.00Å	1.50Å
N2	H11	sing	0.00Å	1.00Å
C11	C12	sing	0.00Å	1.59Å
C11	C13	sing	0.00Å	1.53Å
C11	H12	sing	0.00Å	1.10Å
C12	O4	doub	0.00Å	1.25Å
C13	C14	sing	0.00Å	1.52Å
C13	H13	sing	0.00Å	1.10Å
C13	H14	sing	0.00Å	1.10Å
C14	C15	sing	0.00Å	1.59Å
C14	H15	sing	0.00Å	1.10Å
C14	H16	sing	0.00Å	1.10Å
C15	N3	sing	0.00Å	1.60Å
C15	H17	sing	0.00Å	1.10Å
C15	H18	sing	0.00Å	1.10Å
N3	C16	sing	0.00Å	1.44Å
N3	H19	sing	0.00Å	1.00Å
C16	N4	sing	0.00Å	1.51Å
C16	N5	doub	0.00Å	1.40Å
N4	H20	sing	0.00Å	1.00Å
N4	H21	sing	0.00Å	1.00Å
N5	H22	sing	0.00Å	1.00Å
N5	H23	sing	0.00Å	1.00Å
N6	C17	sing	0.00Å	1.46Å
N6	H24	sing	0.00Å	1.00Å
C17	C18	sing	0.00Å	1.51Å
C17	C19	sing	0.00Å	1.60Å
C17	H25	sing	0.00Å	1.10Å
C18	O5	doub	0.00Å	1.22Å
C19	C20	sing	0.00Å	1.62Å
C19	C21	sing	0.00Å	1.57Å
C19	H26	sing	0.00Å	1.10Å
C20	H27	sing	0.00Å	1.10Å
C20	H28	sing	0.00Å	1.10Å
C20	H29	sing	0.00Å	1.10Å
C21	H30	sing	0.00Å	1.10Å
C21	H31	sing	0.00Å	1.10Å
C21	H32	sing	0.00Å	1.10Å
N7	C22	sing	0.00Å	1.49Å
C22	C23	sing	0.00Å	1.56Å
C22	C24	sing	0.00Å	1.55Å
C23	O6	doub	0.00Å	1.45Å
C23	H33	sing	0.00Å	1.08Å
C24	C25	sing	0.00Å	1.61Å
C25	C26	sing	0.00Å	1.56Å
C26	N8	sing	0.00Å	1.45Å
N8	C27	sing	0.00Å	1.39Å
C27	N9	sing	0.00Å	1.36Å
C27	N10	doub	0.00Å	1.36Å
N7	H34	sing	0.00Å	1.00Å
C22	H35	sing	0.00Å	1.10Å
C24	H36	sing	0.00Å	1.10Å
C24	H37	sing	0.00Å	1.10Å
C25	H38	sing	0.00Å	1.10Å
C25	H39	sing	0.00Å	1.10Å
C26	H40	sing	0.00Å	1.10Å
C26	H41	sing	0.00Å	1.10Å
N8	H42	sing	0.00Å	1.00Å
N9	H43	sing	0.00Å	1.00Å
N9	H44	sing	0.00Å	1.00Å
N10	H45	sing	0.00Å	1.00Å
N10	H46	sing	0.00Å	1.00Å
C10	N2	sing	0.00Å	1.38Å
C12	N6	sing	0.00Å	1.32Å
C18	N7	sing	0.00Å	1.34Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	C6	121.6°	90.0°
C1	C2	C3	119.9°	90.0°
C2	C1	H1	119.2°	90.0°
C1	C2	H2	120.0°	90.0°
C1	C6	C5	118.5°	90.0°
C1	C6	C7	121.2°	90.0°
C6	C1	H1	119.2°	90.0°
C2	C3	C4	119.6°	90.0°
C3	C2	H2	120.0°	90.0°
C2	C3	H3	120.2°	90.0°
C3	C4	C5	120.2°	90.0°
C4	C3	H3	120.2°	90.0°
C3	C4	H4	119.9°	90.0°
C4	C5	C6	120.2°	90.0°
C5	C4	H4	119.9°	90.0°
C4	C5	H5	119.9°	90.0°
C5	C6	C7	120.3°	90.0°
C6	C5	H5	119.9°	90.0°
C6	C7	C8	115.1°	90.0°
C6	C7	H6	108.1°	90.0°
C6	C7	H7	108.1°	90.0°
C7	C8	C9	112.5°	90.0°
C7	C8	N1	114.5°	90.0°
C8	C7	H6	108.0°	90.0°
C8	C7	H7	108.1°	90.0°
C7	C8	H8	107.5°	90.0°
C9	C8	N1	106.2°	90.0°
C8	C9	O1	118.8°	90.0°
C8	C9	O2	116.0°	90.0°
C9	C8	H8	107.4°	90.0°
C8	N1	C10	121.0°	90.0°
N1	C8	H8	108.4°	90.0°
C8	N1	H9	119.5°	90.0°
O1	C9	O2	125.0°	90.0°
C9	O2	H10	109.5°	90.0°
N1	C10	O3	118.8°	90.0°
C10	N1	H9	119.5°	90.0°
N1	C10	N2	119.0°	90.0°
O3	C10	N2	122.2°	90.0°
H6	C7	H7	109.5°	90.0°
C11	N2	H11	116.9°	90.0°
N2	C11	C12	104.5°	90.0°
N2	C11	C13	109.1°	90.0°
N2	C11	H12	112.8°	90.0°
C11	N2	C10	126.2°	90.0°
H11	N2	C10	116.9°	90.0°
C12	C11	C13	106.0°	90.0°
C12	C11	H12	111.5°	90.0°
C11	C12	O4	123.6°	90.0°
C11	C12	N6	116.7°	90.0°
C13	C11	H12	112.4°	90.0°
C11	C13	C14	112.2°	90.0°
C11	C13	H13	108.8°	90.0°
C11	C13	H14	108.8°	90.0°
O4	C12	N6	119.7°	90.0°
C14	C13	H13	108.8°	90.0°
C14	C13	H14	108.8°	90.0°
C13	C14	C15	109.8°	90.0°
C13	C14	H15	109.4°	90.0°
C13	C14	H16	109.4°	90.0°
H13	C13	H14	109.5°	90.0°
C15	C14	H15	109.4°	90.0°
C15	C14	H16	109.4°	90.0°
C14	C15	N3	118.6°	90.0°
C14	C15	H17	107.1°	90.0°
C14	C15	H18	107.1°	90.0°
H15	C14	H16	109.5°	90.0°
N3	C15	H17	107.2°	90.0°
N3	C15	H18	107.2°	90.0°
C15	N3	C16	150.9°	90.0°
C15	N3	H19	104.6°	90.0°
H17	C15	H18	109.5°	90.0°
C16	N3	H19	104.5°	90.0°
N3	C16	N4	135.9°	90.0°
N3	C16	N5	103.3°	90.0°
N4	C16	N5	119.8°	90.0°
C16	N4	H20	120.0°	90.0°
C16	N4	H21	120.0°	90.0°
C16	N5	H22	120.0°	90.0°
C16	N5	H23	120.0°	90.0°
H20	N4	H21	120.0°	90.0°
H22	N5	H23	120.0°	90.0°
C17	N6	H24	119.0°	90.0°
N6	C17	C18	109.8°	90.0°
N6	C17	C19	109.8°	90.0°
N6	C17	H25	109.0°	90.0°
C17	N6	C12	122.0°	90.0°
H24	N6	C12	119.0°	90.0°
C18	C17	C19	112.3°	90.0°
C18	C17	H25	108.4°	90.0°
C17	C18	O5	121.9°	90.0°
C17	C18	N7	112.1°	90.0°
C19	C17	H25	107.3°	90.0°
C17	C19	C20	106.7°	90.0°
C17	C19	C21	111.4°	90.0°
C17	C19	H26	107.7°	90.0°
O5	C18	N7	125.3°	90.0°
C20	C19	C21	115.3°	90.0°
C20	C19	H26	107.4°	90.0°
C19	C20	H27	109.5°	90.0°
C19	C20	H28	109.4°	90.0°
C19	C20	H29	109.5°	90.0°
C21	C19	H26	108.0°	90.0°
C19	C21	H30	109.5°	90.0°
C19	C21	H31	109.5°	90.0°
C19	C21	H32	109.5°	90.0°
H27	C20	H28	109.5°	90.0°
H27	C20	H29	109.5°	90.0°
H28	C20	H29	109.5°	90.0°
H30	C21	H31	109.4°	90.0°
H30	C21	H32	109.5°	90.0°
H31	C21	H32	109.5°	90.0°
N7	C22	C23	102.7°	90.0°
N7	C22	C24	113.7°	90.0°
C22	N7	H34	119.9°	90.0°
N7	C22	H35	110.7°	90.0°
C22	N7	C18	120.2°	90.0°
C23	C22	C24	109.8°	90.0°
C22	C23	O6	114.0°	90.0°
C22	C23	H33	123.0°	90.0°
C23	C22	H35	109.7°	90.0°
C22	C24	C25	103.4°	90.0°
C24	C22	H35	109.9°	90.0°
C22	C24	H36	111.0°	90.0°
C22	C24	H37	110.9°	90.0°
O6	C23	H33	123.0°	90.0°
C24	C25	C26	106.1°	90.0°
C25	C24	H36	110.9°	90.0°
C25	C24	H37	111.0°	90.0°
C24	C25	H38	110.3°	90.0°
C24	C25	H39	110.3°	90.0°
C25	C26	N8	110.6°	90.0°
C26	C25	H38	110.3°	90.0°
C26	C25	H39	110.3°	90.0°
C25	C26	H40	109.2°	90.0°
C25	C26	H41	109.2°	90.0°
C26	N8	C27	126.7°	90.0°
N8	C26	H40	109.2°	90.0°
N8	C26	H41	109.2°	90.0°
C26	N8	H42	116.6°	90.0°
N8	C27	N9	121.2°	90.0°
N8	C27	N10	112.0°	90.0°
C27	N8	H42	116.6°	90.0°
N9	C27	N10	126.8°	90.0°
C27	N9	H43	120.0°	90.0°
C27	N9	H44	120.0°	90.0°
C27	N10	H45	120.0°	90.0°
C27	N10	H46	120.0°	90.0°
H34	N7	C18	119.9°	90.0°
H36	C24	H37	109.5°	90.0°
H38	C25	H39	109.5°	90.0°
H40	C26	H41	109.5°	90.0°
H43	N9	H44	120.0°	90.0°
H45	N10	H46	120.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	C6	H1	180.0°	90.0°
C1	C2	C3	H2	180.0°	90.0°
C1	C2	C3	C4	0.1°	90.0°
C2	C1	C6	C5	2.0°	90.0°
C2	C1	C6	C7	179.1°	90.0°
C1	C2	C3	H3	179.9°	90.0°
C6	C1	C2	C3	1.3°	90.0°
C1	C6	C5	C4	1.2°	90.0°
C1	C6	C5	C7	178.9°	90.0°
C1	C6	C7	C8	35.1°	90.0°
C6	C1	C2	H2	178.6°	90.0°
C1	C6	C5	H5	178.9°	90.0°
C1	C6	C7	H6	85.7°	90.0°
C1	C6	C7	H7	156.0°	90.0°
C2	C3	C4	H3	180.0°	90.0°
C2	C3	C4	C5	0.9°	90.0°
C3	C2	C1	H1	178.6°	90.0°
C2	C3	C4	H4	179.1°	90.0°
C3	C4	C5	H4	180.0°	90.0°
C3	C4	C5	C6	0.3°	90.0°
C4	C3	C2	H2	179.9°	90.0°
C3	C4	C5	H5	179.7°	90.0°
C4	C5	C6	H5	180.0°	90.0°
C4	C5	C6	C7	179.9°	90.0°
C5	C4	C3	H3	179.1°	90.0°
C5	C6	C7	C8	146.0°	90.0°
C5	C6	C1	H1	178.0°	90.0°
C6	C5	C4	H4	179.7°	90.0°
C5	C6	C7	H6	93.2°	90.0°
C5	C6	C7	H7	25.1°	90.0°
C6	C7	C8	H6	120.8°	90.0°
C6	C7	C8	H7	120.8°	90.0°
C6	C7	C8	C9	172.7°	90.0°
C6	C7	C8	N1	51.3°	90.0°
C7	C6	C1	H1	0.9°	90.0°
C7	C6	C5	H5	0.0°	90.0°
C6	C7	H6	H7	117.4°	90.0°
C6	C7	C8	H8	69.2°	90.0°
C7	C8	C9	N1	126.0°	90.0°
C7	C8	C9	H8	118.1°	90.0°
C7	C8	N1	H8	120.0°	90.0°
C7	C8	C9	O1	167.2°	90.0°
C7	C8	C9	O2	16.5°	90.0°
C7	C8	N1	C10	164.9°	90.0°
C8	C7	H6	H7	117.4°	90.0°
C7	C8	N1	H9	15.1°	90.0°
C9	C8	N1	H8	115.2°	90.0°
C8	C9	O1	O2	175.9°	90.0°
C9	C8	N1	C10	70.3°	90.0°
C9	C8	C7	H6	66.5°	90.0°
C9	C8	C7	H7	51.9°	90.0°
C9	C8	N1	H9	109.7°	90.0°
C8	C9	O2	H10	176.0°	90.0°
N1	C8	C9	O1	66.8°	90.0°
N1	C8	C9	O2	109.5°	90.0°
C8	N1	C10	H9	180.0°	90.0°
C8	N1	C10	O3	0.4°	90.0°
N1	C8	C7	H6	172.1°	90.0°
N1	C8	C7	H7	69.6°	90.0°
C8	N1	C10	N2	178.4°	90.0°
O1	C9	C8	H8	49.1°	90.0°
O1	C9	O2	H10	0.0°	90.0°
O2	C9	C8	H8	134.7°	90.0°
N1	C10	O3	N2	178.7°	90.0°
C10	N1	C8	H8	44.9°	90.0°
N1	C10	N2	C11	177.3°	90.0°
N1	C10	N2	H11	2.7°	90.0°
O3	C10	N1	H9	179.6°	90.0°
O3	C10	N2	C11	3.9°	90.0°
O3	C10	N2	H11	176.1°	90.0°
H1	C1	C2	H2	1.4°	90.0°
H2	C2	C3	H3	0.1°	90.0°
H3	C3	C4	H4	0.9°	90.0°
H4	C4	C5	H5	0.3°	90.0°
H6	C7	C8	H8	51.6°	90.0°
H7	C7	C8	H8	170.0°	90.0°
H8	C8	N1	H9	135.1°	90.0°
H9	N1	C10	N2	1.6°	90.0°
C11	N2	H11	C10	180.0°	90.0°
N2	C11	C12	C13	115.2°	90.0°
N2	C11	C12	H12	122.2°	90.0°
N2	C11	C13	H12	125.9°	90.0°
N2	C11	C12	O4	111.6°	90.0°
N2	C11	C13	C14	74.9°	90.0°
N2	C11	C13	H13	45.5°	90.0°
N2	C11	C13	H14	164.7°	90.0°
N2	C11	C12	N6	65.9°	90.0°
H11	N2	C11	C12	96.2°	90.0°
H11	N2	C11	C13	16.8°	90.0°
H11	N2	C11	H12	142.5°	90.0°
C12	C11	C13	H12	122.0°	90.0°
C11	C12	O4	N6	177.4°	90.0°
C12	C11	C13	C14	173.0°	90.0°
C12	C11	C13	H13	66.6°	90.0°
C12	C11	C13	H14	52.6°	90.0°
C11	C12	N6	C17	173.9°	90.0°
C11	C12	N6	H24	6.1°	90.0°
C12	C11	N2	C10	83.8°	90.0°
C13	C11	C12	O4	3.6°	90.0°
C11	C13	C14	H13	120.4°	90.0°
C11	C13	C14	H14	120.4°	90.0°
C11	C13	H13	H14	118.8°	90.0°
C11	C13	C14	C15	175.6°	90.0°
C11	C13	C14	H15	64.4°	90.0°
C11	C13	C14	H16	55.5°	90.0°
C13	C11	N2	C10	163.2°	90.0°
C13	C11	C12	N6	178.9°	90.0°
H12	C11	C12	O4	126.2°	90.0°
H12	C11	C13	C14	51.0°	90.0°
H12	C11	C13	H13	171.4°	90.0°
H12	C11	C13	H14	69.4°	90.0°
H12	C11	N2	C10	37.5°	90.0°
H12	C11	C12	N6	56.3°	90.0°
O4	C12	N6	C17	3.6°	90.0°
O4	C12	N6	H24	176.4°	90.0°
C14	C13	H13	H14	118.7°	90.0°
C13	C14	C15	H15	120.0°	90.0°
C13	C14	C15	H16	120.1°	90.0°
C13	C14	H15	H16	119.9°	90.0°
C13	C14	C15	N3	58.1°	90.0°
C13	C14	C15	H17	179.4°	90.0°
C13	C14	C15	H18	63.2°	90.0°
H13	C13	C14	C15	55.2°	90.0°
H13	C13	C14	H15	175.2°	90.0°
H13	C13	C14	H16	64.9°	90.0°
H14	C13	C14	C15	64.0°	90.0°
H14	C13	C14	H15	56.1°	90.0°
H14	C13	C14	H16	176.0°	90.0°
C15	C14	H15	H16	119.9°	90.0°
C14	C15	N3	H17	121.3°	90.0°
C14	C15	N3	H18	121.3°	90.0°
C14	C15	H17	H18	115.9°	90.0°
C14	C15	N3	C16	93.9°	90.0°
C14	C15	N3	H19	86.1°	90.0°
H15	C14	C15	N3	61.9°	90.0°
H15	C14	C15	H17	59.4°	90.0°
H15	C14	C15	H18	176.8°	90.0°
H16	C14	C15	N3	178.2°	90.0°
H16	C14	C15	H17	60.5°	90.0°
H16	C14	C15	H18	56.9°	90.0°
N3	C15	H17	H18	115.9°	90.0°
C15	N3	C16	H19	180.0°	90.0°
C15	N3	C16	N4	23.7°	90.0°
C15	N3	C16	N5	168.9°	90.0°
H17	C15	N3	C16	144.8°	90.0°
H17	C15	N3	H19	35.2°	90.0°
H18	C15	N3	C16	27.4°	90.0°
H18	C15	N3	H19	152.6°	90.0°
N3	C16	N4	N5	165.8°	90.0°
N3	C16	N4	H20	165.9°	90.0°
N3	C16	N4	H21	14.1°	90.0°
N3	C16	N5	H22	169.9°	90.0°
N3	C16	N5	H23	10.1°	90.0°
H19	N3	C16	N4	156.3°	90.0°
H19	N3	C16	N5	11.1°	90.0°
C16	N4	H20	H21	180.0°	90.0°
N4	C16	N5	H22	0.0°	90.0°
N4	C16	N5	H23	180.0°	90.0°
N5	C16	N4	H20	0.0°	90.0°
N5	C16	N4	H21	180.0°	90.0°
C16	N5	H22	H23	180.0°	90.0°
C17	N6	H24	C12	180.0°	90.0°
N6	C17	C18	C19	122.5°	90.0°
N6	C17	C18	H25	119.0°	90.0°
N6	C17	C19	H25	118.4°	90.0°
N6	C17	C18	O5	26.0°	90.0°
N6	C17	C19	C20	67.3°	90.0°
N6	C17	C19	C21	59.4°	90.0°
N6	C17	C19	H26	177.7°	90.0°
N6	C17	C18	N7	163.5°	90.0°
H24	N6	C17	C18	68.5°	90.0°
H24	N6	C17	C19	55.5°	90.0°
H24	N6	C17	H25	172.8°	90.0°
C18	C17	C19	H25	119.1°	90.0°
C17	C18	O5	N7	169.2°	90.0°
C18	C17	C19	C20	170.1°	90.0°
C18	C17	C19	C21	63.2°	90.0°
C18	C17	C19	H26	55.1°	90.0°
C17	C18	N7	C22	173.2°	90.0°
C17	C18	N7	H34	6.8°	90.0°
C18	C17	N6	C12	111.5°	90.0°
C19	C17	C18	O5	96.5°	90.0°
C17	C19	C20	C21	124.3°	90.0°
C17	C19	C20	H26	115.2°	90.0°
C17	C19	C21	H26	118.1°	90.0°
C17	C19	C20	H27	180.0°	90.0°
C17	C19	C20	H28	60.0°	90.0°
C17	C19	C20	H29	60.0°	90.0°
C17	C19	C21	H30	180.0°	90.0°
C17	C19	C21	H31	60.0°	90.0°
C17	C19	C21	H32	60.0°	90.0°
C19	C17	N6	C12	124.4°	90.0°
C19	C17	C18	N7	74.0°	90.0°
H25	C17	C18	O5	145.0°	90.0°
H25	C17	C19	C20	51.0°	90.0°
H25	C17	C19	C21	177.7°	90.0°
H25	C17	C19	H26	64.0°	90.0°
H25	C17	N6	C12	7.1°	90.0°
H25	C17	C18	N7	44.4°	90.0°
O5	C18	N7	C22	3.0°	90.0°
O5	C18	N7	H34	177.0°	90.0°
C20	C19	C21	H26	120.1°	90.0°
C19	C20	H27	H28	120.0°	90.0°
C19	C20	H27	H29	120.0°	90.0°
C19	C20	H28	H29	120.0°	90.0°
C20	C19	C21	H30	58.2°	90.0°
C20	C19	C21	H31	61.8°	90.0°
C20	C19	C21	H32	178.2°	90.0°
C21	C19	C20	H27	55.7°	90.0°
C21	C19	C20	H28	175.7°	90.0°
C21	C19	C20	H29	64.3°	90.0°
C19	C21	H30	H31	120.0°	90.0°
C19	C21	H30	H32	120.0°	90.0°
C19	C21	H31	H32	120.0°	90.0°
H26	C19	C20	H27	64.8°	90.0°
H26	C19	C20	H28	55.2°	90.0°
H26	C19	C20	H29	175.2°	90.0°
H26	C19	C21	H30	62.0°	90.0°
H26	C19	C21	H31	178.1°	90.0°
H26	C19	C21	H32	58.0°	90.0°
H27	C20	H28	H29	120.0°	90.0°
H30	C21	H31	H32	120.0°	90.0°
N7	C22	C23	C24	121.3°	90.0°
N7	C22	C23	H35	117.8°	90.0°
N7	C22	C24	H35	124.8°	90.0°
N7	C22	C23	O6	63.8°	90.0°
N7	C22	C23	H33	116.2°	90.0°
N7	C22	C24	C25	64.2°	90.0°
C22	N7	H34	C18	180.0°	90.0°
N7	C22	C24	H36	54.8°	90.0°
N7	C22	C24	H37	176.8°	90.0°
C23	C22	C24	H35	120.8°	90.0°
C22	C23	O6	H33	180.0°	90.0°
C23	C22	C24	C25	178.6°	90.0°
C23	C22	N7	H34	94.9°	90.0°
C23	C22	C24	H36	59.6°	90.0°
C23	C22	C24	H37	62.4°	90.0°
C23	C22	N7	C18	85.1°	90.0°
C24	C22	C23	O6	57.5°	90.0°
C24	C22	C23	H33	122.5°	90.0°
C22	C24	C25	H36	119.0°	90.0°
C22	C24	C25	H37	119.0°	90.0°
C22	C24	C25	C26	178.2°	90.0°
C24	C22	N7	H34	23.7°	90.0°
C22	C24	H36	H37	122.8°	90.0°
C22	C24	C25	H38	58.7°	90.0°
C22	C24	C25	H39	62.3°	90.0°
C24	C22	N7	C18	156.3°	90.0°
O6	C23	C22	H35	178.4°	90.0°
H33	C23	C22	H35	1.6°	90.0°
C24	C25	C26	H38	119.5°	90.0°
C24	C25	C26	H39	119.5°	90.0°
C24	C25	C26	N8	160.4°	90.0°
C25	C24	C22	H35	60.6°	90.0°
C25	C24	H36	H37	122.8°	90.0°
C24	C25	H38	H39	121.5°	90.0°
C24	C25	C26	H40	40.3°	90.0°
C24	C25	C26	H41	79.4°	90.0°
C25	C26	N8	H40	120.2°	90.0°
C25	C26	N8	H41	120.2°	90.0°
C25	C26	N8	C27	100.4°	90.0°
C26	C25	C24	H36	62.8°	90.0°
C26	C25	C24	H37	59.2°	90.0°
C26	C25	H38	H39	121.6°	90.0°
C25	C26	H40	H41	119.5°	90.0°
C25	C26	N8	H42	79.5°	90.0°
C26	N8	C27	H42	180.0°	90.0°
C26	N8	C27	N9	12.9°	90.0°
C26	N8	C27	N10	167.2°	90.0°
N8	C26	C25	H38	80.1°	90.0°
N8	C26	C25	H39	41.0°	90.0°
N8	C26	H40	H41	119.5°	90.0°
N8	C27	N9	N10	179.8°	90.0°
C27	N8	C26	H40	139.4°	90.0°
C27	N8	C26	H41	19.7°	90.0°
N8	C27	N9	H43	179.8°	90.0°
N8	C27	N9	H44	0.2°	90.0°
N8	C27	N10	H45	179.8°	90.0°
N8	C27	N10	H46	0.2°	90.0°
N9	C27	N8	H42	167.0°	90.0°
C27	N9	H43	H44	180.0°	90.0°
N9	C27	N10	H45	0.0°	90.0°
N9	C27	N10	H46	180.0°	90.0°
N10	C27	N8	H42	12.8°	90.0°
N10	C27	N9	H43	0.0°	90.0°
N10	C27	N9	H44	180.0°	90.0°
C27	N10	H45	H46	180.0°	90.0°
H34	N7	C22	H35	148.1°	90.0°
H35	C22	C24	H36	179.6°	90.0°
H35	C22	C24	H37	58.4°	90.0°
H35	C22	N7	C18	31.9°	90.0°
H36	C24	C25	H38	177.8°	90.0°
H36	C24	C25	H39	56.7°	90.0°
H37	C24	C25	H38	60.3°	90.0°
H37	C24	C25	H39	178.7°	90.0°
H38	C25	C26	H40	159.7°	90.0°
H38	C25	C26	H41	40.1°	90.0°
H39	C25	C26	H40	79.2°	90.0°
H39	C25	C26	H41	161.1°	90.0°
H40	C26	N8	H42	40.6°	90.0°
H41	C26	N8	H42	160.3°	90.0°

Release date:	2013-08-07
Last modified:	2022-10-20
Processing site:	RCSB