YIA

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C6	N1	sing	0.00Å	1.46Å
C6	C5	sing	0.00Å	1.51Å
N1	C7	sing	0.00Å	1.34Å
C12	C11	sing	0.00Å	1.48Å
C12	N2	sing	0.00Å	1.46Å
O2	C11	sing	0.00Å	1.37Å	Aromatic
O2	C8	sing	0.00Å	1.37Å	Aromatic
C11	C10	doub	0.00Å	1.34Å	Aromatic
C7	C8	sing	0.00Å	1.47Å
C7	O3	doub	0.00Å	1.24Å
C8	C9	doub	0.00Å	1.35Å	Aromatic
C10	C9	sing	0.00Å	1.41Å	Aromatic
O1	C19	doub	0.00Å	1.23Å
C5	C4	sing	0.00Å	1.51Å
N2	C19	sing	0.00Å	1.38Å
N2	C13	sing	0.00Å	1.44Å
C19	N3	sing	0.00Å	1.37Å
C33	N3	sing	0.00Å	1.46Å
C33	C32	sing	0.00Å	1.51Å
C4	C3	doub	0.00Å	1.39Å	Aromatic
C4	C34	sing	0.00Å	1.39Å	Aromatic
N3	C20	sing	0.00Å	1.47Å
C3	C2	sing	0.00Å	1.38Å	Aromatic
C13	C14	doub	0.00Å	1.39Å	Aromatic
C13	C18	sing	0.00Å	1.39Å	Aromatic
C14	C15	sing	0.00Å	1.39Å	Aromatic
C34	C35	doub	0.00Å	1.39Å	Aromatic
C20	C21	sing	0.00Å	1.51Å
C32	N4	sing	0.00Å	1.52Å
C18	C17	doub	0.00Å	1.39Å	Aromatic
C2	C1	doub	0.00Å	1.36Å	Aromatic
C29	C28	doub	0.00Å	1.38Å	Aromatic
C29	C30	sing	0.00Å	1.39Å	Aromatic
C31	N4	sing	0.00Å	1.51Å
C35	C1	sing	0.00Å	1.37Å	Aromatic
C15	C16	doub	0.00Å	1.37Å	Aromatic
C28	C27	sing	0.00Å	1.38Å	Aromatic
C1	F1	sing	0.00Å	1.36Å
C30	C25	doub	0.00Å	1.39Å	Aromatic
N4	C21	sing	0.00Å	1.51Å
N4	C22	sing	0.00Å	1.53Å
C17	C16	sing	0.00Å	1.37Å	Aromatic
C16	F2	sing	0.00Å	1.36Å
C27	C26	doub	0.00Å	1.39Å	Aromatic
C25	C26	sing	0.00Å	1.39Å	Aromatic
C25	C24	sing	0.00Å	1.52Å
C22	C23	sing	0.00Å	1.54Å
C23	C24	sing	0.00Å	1.55Å
C2	H1	sing	0.00Å	1.08Å
C3	H2	sing	0.00Å	1.08Å
C5	H3	sing	0.00Å	1.10Å
C5	H4	sing	0.00Å	1.10Å
C6	H5	sing	0.00Å	1.10Å
C6	H6	sing	0.00Å	1.10Å
N1	H7	sing	0.00Å	1.00Å
C9	H8	sing	0.00Å	1.08Å
C10	H9	sing	0.00Å	1.08Å
C12	H10	sing	0.00Å	1.10Å
C12	H11	sing	0.00Å	1.10Å
C14	H12	sing	0.00Å	1.08Å
C15	H13	sing	0.00Å	1.08Å
C17	H14	sing	0.00Å	1.08Å
C18	H15	sing	0.00Å	1.08Å
C20	H16	sing	0.00Å	1.10Å
C20	H17	sing	0.00Å	1.10Å
C21	H18	sing	0.00Å	1.10Å
C21	H19	sing	0.00Å	1.10Å
C22	H20	sing	0.00Å	1.10Å
C22	H21	sing	0.00Å	1.10Å
C23	H22	sing	0.00Å	1.10Å
C23	H23	sing	0.00Å	1.10Å
C24	H24	sing	0.00Å	1.10Å
C24	H25	sing	0.00Å	1.10Å
C26	H26	sing	0.00Å	1.08Å
C27	H27	sing	0.00Å	1.08Å
C28	H28	sing	0.00Å	1.08Å
C29	H29	sing	0.00Å	1.08Å
C30	H30	sing	0.00Å	1.08Å
C31	H31	sing	0.00Å	1.10Å
C31	H32	sing	0.00Å	1.10Å
C31	H33	sing	0.00Å	1.10Å
C32	H34	sing	0.00Å	1.10Å
C32	H35	sing	0.00Å	1.10Å
C33	H36	sing	0.00Å	1.10Å
C33	H37	sing	0.00Å	1.10Å
C34	H38	sing	0.00Å	1.08Å
C35	H39	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N1	C6	C5	111.1°	90.0°
C6	N1	C7	124.7°	90.0°
N1	C6	H5	109.1°	90.0°
N1	C6	H6	109.1°	90.0°
C6	N1	H7	117.7°	90.0°
C6	C5	C4	110.5°	90.0°
C6	C5	H3	109.2°	90.0°
C6	C5	H4	109.2°	90.0°
C5	C6	H5	109.1°	90.0°
C5	C6	H6	109.1°	90.0°
N1	C7	C8	115.6°	90.0°
N1	C7	O3	122.5°	90.0°
C7	N1	H7	117.6°	90.0°
C11	C12	N2	111.6°	90.0°
C12	C11	O2	117.2°	90.0°
C12	C11	C10	133.1°	90.0°
C11	C12	H10	108.9°	90.0°
C11	C12	H11	108.9°	90.0°
C12	N2	C19	120.6°	90.0°
C12	N2	C13	118.1°	90.0°
N2	C12	H10	109.0°	90.0°
N2	C12	H11	108.9°	90.0°
C11	O2	C8	106.7°	90.0°
O2	C11	C10	109.7°	90.0°
O2	C8	C7	117.9°	90.0°
O2	C8	C9	109.3°	90.0°
C11	C10	C9	107.3°	90.0°
C11	C10	H9	126.4°	90.0°
C8	C7	O3	121.9°	90.0°
C7	C8	C9	132.8°	90.0°
C8	C9	C10	107.0°	90.0°
C8	C9	H8	126.5°	90.0°
C10	C9	H8	126.5°	90.0°
C9	C10	H9	126.3°	90.0°
O1	C19	N2	118.5°	90.0°
O1	C19	N3	119.5°	90.0°
C5	C4	C3	120.0°	90.0°
C5	C4	C34	121.6°	90.0°
C4	C5	H3	109.2°	90.0°
C4	C5	H4	109.2°	90.0°
C19	N2	C13	121.1°	90.0°
N2	C19	N3	121.9°	90.0°
N2	C13	C14	121.4°	90.0°
N2	C13	C18	120.1°	90.0°
C19	N3	C33	118.3°	90.0°
C19	N3	C20	128.6°	90.0°
N3	C33	C32	111.8°	90.0°
C33	N3	C20	112.7°	90.0°
N3	C33	H36	108.9°	90.0°
N3	C33	H37	108.9°	90.0°
C33	C32	N4	113.0°	90.0°
C33	C32	H34	108.6°	90.0°
C33	C32	H35	108.6°	90.0°
C32	C33	H36	108.9°	90.0°
C32	C33	H37	108.9°	90.0°
C3	C4	C34	118.4°	90.0°
C4	C3	C2	121.3°	90.0°
C4	C3	H2	119.3°	90.0°
C4	C34	C35	121.0°	90.0°
C4	C34	H38	119.5°	90.0°
N3	C20	C21	112.1°	90.0°
N3	C20	H16	108.8°	90.0°
N3	C20	H17	108.8°	90.0°
C3	C2	C1	118.0°	90.0°
C3	C2	H1	121.0°	90.0°
C2	C3	H2	119.3°	90.0°
C14	C13	C18	118.6°	90.0°
C13	C14	C15	120.8°	90.0°
C13	C14	H12	119.6°	90.0°
C13	C18	C17	121.0°	90.0°
C13	C18	H15	119.5°	90.0°
C14	C15	C16	118.3°	90.0°
C15	C14	H12	119.6°	90.0°
C14	C15	H13	120.8°	90.0°
C34	C35	C1	117.7°	90.0°
C35	C34	H38	119.5°	90.0°
C34	C35	H39	121.1°	90.0°
C20	C21	N4	111.9°	90.0°
C21	C20	H16	108.8°	90.0°
C21	C20	H17	108.8°	90.0°
C20	C21	H18	108.9°	90.0°
C20	C21	H19	108.9°	90.0°
C32	N4	C31	112.2°	90.0°
C32	N4	C21	106.9°	90.0°
C32	N4	C22	108.8°	90.0°
N4	C32	H34	108.6°	90.0°
N4	C32	H35	108.6°	90.0°
C18	C17	C16	118.3°	90.0°
C18	C17	H14	120.8°	90.0°
C17	C18	H15	119.5°	90.0°
C2	C1	C35	123.5°	90.0°
C2	C1	F1	117.6°	90.0°
C1	C2	H1	121.0°	90.0°
C28	C29	C30	120.3°	90.0°
C29	C28	C27	119.7°	90.0°
C29	C28	H28	120.2°	90.0°
C28	C29	H29	119.8°	90.0°
C29	C30	C25	120.7°	90.0°
C30	C29	H29	119.9°	90.0°
C29	C30	H30	119.6°	90.0°
C31	N4	C21	110.5°	90.0°
C31	N4	C22	108.6°	90.0°
N4	C31	H31	109.5°	90.0°
N4	C31	H32	109.5°	90.0°
N4	C31	H33	109.4°	90.0°
C35	C1	F1	119.0°	90.0°
C1	C35	H39	121.1°	90.0°
C15	C16	C17	123.0°	90.0°
C15	C16	F2	118.8°	90.0°
C16	C15	H13	120.9°	90.0°
C28	C27	C26	120.3°	90.0°
C28	C27	H27	119.9°	90.0°
C27	C28	H28	120.2°	90.0°
C30	C25	C26	118.2°	90.0°
C30	C25	C24	122.3°	90.0°
C25	C30	H30	119.6°	90.0°
C21	N4	C22	109.8°	90.0°
N4	C21	H18	108.9°	90.0°
N4	C21	H19	108.9°	90.0°
N4	C22	C23	115.5°	90.0°
N4	C22	H20	107.9°	90.0°
N4	C22	H21	107.9°	90.0°
C17	C16	F2	118.2°	90.0°
C16	C17	H14	120.8°	90.0°
C27	C26	C25	120.9°	90.0°
C27	C26	H26	119.5°	90.0°
C26	C27	H27	119.9°	90.0°
C26	C25	C24	119.5°	90.0°
C25	C26	H26	119.6°	90.0°
C25	C24	C23	119.4°	90.0°
C25	C24	H24	106.9°	90.0°
C25	C24	H25	106.9°	90.0°
C22	C23	C24	112.9°	90.0°
C23	C22	H20	107.9°	90.0°
C23	C22	H21	107.9°	90.0°
C22	C23	H22	108.6°	90.0°
C22	C23	H23	108.6°	90.0°
C24	C23	H22	108.6°	90.0°
C24	C23	H23	108.6°	90.0°
C23	C24	H24	106.9°	90.0°
C23	C24	H25	106.9°	90.0°
H3	C5	H4	109.5°	90.0°
H5	C6	H6	109.5°	90.0°
H10	C12	H11	109.5°	90.0°
H16	C20	H17	109.5°	90.0°
H18	C21	H19	109.5°	90.0°
H20	C22	H21	109.5°	90.0°
H22	C23	H23	109.5°	90.0°
H24	C24	H25	109.5°	90.0°
H31	C31	H32	109.5°	90.0°
H31	C31	H33	109.5°	90.0°
H32	C31	H33	109.5°	90.0°
H34	C32	H35	109.4°	90.0°
H36	C33	H37	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	C6	C5	H5	120.2°	90.0°
N1	C6	C5	H6	120.3°	90.0°
C6	N1	C7	H7	180.0°	90.0°
C6	N1	C7	C8	175.0°	90.0°
C6	N1	C7	O3	4.2°	90.0°
N1	C6	C5	C4	60.4°	90.0°
N1	C6	C5	H3	59.7°	90.0°
N1	C6	C5	H4	179.5°	90.0°
N1	C6	H5	H6	119.3°	90.0°
C5	C6	N1	C7	102.2°	90.0°
C6	C5	C4	H3	120.1°	90.0°
C6	C5	C4	H4	120.2°	90.0°
C6	C5	C4	C3	93.3°	90.0°
C6	C5	C4	C34	85.2°	90.0°
C6	C5	H3	H4	119.6°	90.0°
C5	C6	H5	H6	119.3°	90.0°
C5	C6	N1	H7	77.8°	90.0°
N1	C7	C8	O2	9.4°	90.0°
N1	C7	C8	O3	179.2°	90.0°
N1	C7	C8	C9	170.5°	90.0°
C7	N1	C6	H5	137.6°	90.0°
C7	N1	C6	H6	18.1°	90.0°
C11	C12	N2	H10	120.3°	90.0°
C11	C12	N2	H11	120.3°	90.0°
C12	C11	O2	C10	178.4°	90.0°
C12	C11	O2	C8	179.3°	90.0°
C12	C11	C10	C9	178.4°	90.0°
C11	C12	N2	C19	139.1°	90.0°
C11	C12	N2	C13	35.5°	90.0°
C12	C11	C10	H9	1.6°	90.0°
C11	C12	H10	H11	119.0°	90.0°
N2	C12	C11	O2	110.7°	90.0°
N2	C12	C11	C10	67.3°	90.0°
C12	N2	C19	O1	39.4°	90.0°
C12	N2	C19	C13	174.5°	90.0°
C12	N2	C19	N3	137.1°	90.0°
C12	N2	C13	C14	56.5°	90.0°
C12	N2	C13	C18	125.3°	90.0°
N2	C12	H10	H11	119.0°	90.0°
C11	O2	C8	C7	178.8°	90.0°
C11	O2	C8	C9	1.2°	90.0°
O2	C11	C10	C9	0.4°	90.0°
O2	C11	C10	H9	179.7°	90.0°
O2	C11	C12	H10	129.0°	90.0°
O2	C11	C12	H11	9.7°	90.0°
C8	O2	C11	C10	0.9°	90.0°
O2	C8	C7	C9	179.9°	90.0°
O2	C8	C7	O3	171.4°	90.0°
O2	C8	C9	C10	0.9°	90.0°
O2	C8	C9	H8	179.1°	90.0°
C11	C10	C9	C8	0.3°	90.0°
C11	C10	C9	H9	180.0°	90.0°
C11	C10	C9	H8	179.6°	90.0°
C10	C11	C12	H10	53.1°	90.0°
C10	C11	C12	H11	172.4°	90.0°
C7	C8	C9	C10	179.0°	90.0°
C8	C7	N1	H7	5.0°	90.0°
C7	C8	C9	H8	1.0°	90.0°
O3	C7	C8	C9	8.6°	90.0°
O3	C7	N1	H7	175.8°	90.0°
C8	C9	C10	H8	180.0°	90.0°
C8	C9	C10	H9	179.6°	90.0°
O1	C19	N2	N3	176.6°	90.0°
O1	C19	N2	C13	135.0°	90.0°
O1	C19	N3	C33	1.6°	90.0°
O1	C19	N3	C20	171.5°	90.0°
C5	C4	C3	C34	178.5°	90.0°
C5	C4	C3	C2	179.1°	90.0°
C5	C4	C34	C35	179.5°	90.0°
C5	C4	C3	H2	0.9°	90.0°
C4	C5	H3	H4	119.5°	90.0°
C4	C5	C6	H5	179.4°	90.0°
C4	C5	C6	H6	59.9°	90.0°
C5	C4	C34	H38	0.5°	90.0°
N2	C19	N3	C33	178.2°	90.0°
N2	C19	N3	C20	5.1°	90.0°
C19	N2	C13	C14	128.9°	90.0°
C19	N2	C13	C18	49.3°	90.0°
C19	N2	C12	H10	18.8°	90.0°
C19	N2	C12	H11	100.5°	90.0°
C13	N2	C19	N3	48.4°	90.0°
N2	C13	C14	C18	178.2°	90.0°
N2	C13	C14	C15	179.0°	90.0°
N2	C13	C18	C17	178.4°	90.0°
C13	N2	C12	H10	155.8°	90.0°
C13	N2	C12	H11	84.8°	90.0°
N2	C13	C14	H12	1.0°	90.0°
N2	C13	C18	H15	1.6°	90.0°
C19	N3	C33	C20	174.1°	90.0°
C19	N3	C33	C32	134.0°	90.0°
C19	N3	C20	C21	133.7°	90.0°
C19	N3	C20	H16	106.0°	90.0°
C19	N3	C20	H17	13.2°	90.0°
C19	N3	C33	H36	13.6°	90.0°
C19	N3	C33	H37	105.7°	90.0°
N3	C33	C32	H36	120.4°	90.0°
N3	C33	C32	H37	120.3°	90.0°
C33	N3	C20	C21	53.0°	90.0°
N3	C33	C32	N4	55.0°	90.0°
C33	N3	C20	H16	67.4°	90.0°
C33	N3	C20	H17	173.4°	90.0°
N3	C33	C32	H34	65.5°	90.0°
N3	C33	C32	H35	175.6°	90.0°
N3	C33	H36	H37	118.9°	90.0°
C32	C33	N3	C20	51.9°	90.0°
C33	C32	N4	H34	120.5°	90.0°
C33	C32	N4	H35	120.6°	90.0°
C33	C32	N4	C31	65.0°	90.0°
C33	C32	N4	C21	56.2°	90.0°
C33	C32	N4	C22	174.7°	90.0°
C33	C32	H34	H35	118.4°	90.0°
C32	C33	H36	H37	118.9°	90.0°
C4	C3	C2	H2	180.0°	90.0°
C3	C4	C34	C35	2.0°	90.0°
C4	C3	C2	C1	0.2°	90.0°
C4	C3	C2	H1	179.8°	90.0°
C3	C4	C5	H3	146.6°	90.0°
C3	C4	C5	H4	26.9°	90.0°
C3	C4	C34	H38	178.0°	90.0°
C34	C4	C3	C2	0.6°	90.0°
C4	C34	C35	H38	180.0°	90.0°
C4	C34	C35	C1	2.5°	90.0°
C34	C4	C3	H2	179.4°	90.0°
C34	C4	C5	H3	34.9°	90.0°
C34	C4	C5	H4	154.6°	90.0°
C4	C34	C35	H39	177.5°	90.0°
N3	C20	C21	H16	120.4°	90.0°
N3	C20	C21	H17	120.4°	90.0°
N3	C20	C21	N4	56.5°	90.0°
N3	C20	H16	H17	118.8°	90.0°
N3	C20	C21	H18	176.9°	90.0°
N3	C20	C21	H19	63.9°	90.0°
C20	N3	C33	H36	172.2°	90.0°
C20	N3	C33	H37	68.5°	90.0°
C3	C2	C1	H1	180.0°	90.0°
C3	C2	C1	C35	0.4°	90.0°
C3	C2	C1	F1	180.0°	90.0°
C13	C14	C15	H12	180.0°	90.0°
C14	C13	C18	C17	0.2°	90.0°
C13	C14	C15	C16	0.9°	90.0°
C13	C14	C15	H13	179.0°	90.0°
C14	C13	C18	H15	179.8°	90.0°
C18	C13	C14	C15	0.8°	90.0°
C13	C18	C17	H15	180.0°	90.0°
C13	C18	C17	C16	0.3°	90.0°
C18	C13	C14	H12	179.2°	90.0°
C13	C18	C17	H14	179.7°	90.0°
C14	C15	C16	H13	180.0°	90.0°
C14	C15	C16	C17	0.5°	90.0°
C14	C15	C16	F2	179.2°	90.0°
C34	C35	C1	C2	1.7°	90.0°
C34	C35	C1	H39	180.0°	90.0°
C34	C35	C1	F1	178.6°	90.0°
C20	C21	N4	C32	56.5°	90.0°
C20	C21	N4	C31	65.9°	90.0°
C20	C21	N4	H18	120.4°	90.0°
C20	C21	N4	H19	120.4°	90.0°
C20	C21	N4	C22	174.4°	90.0°
C21	C20	H16	H17	118.8°	90.0°
C20	C21	H18	H19	118.9°	90.0°
C32	N4	C31	C21	119.2°	90.0°
C32	N4	C31	C22	120.4°	90.0°
C32	N4	C21	C22	117.9°	90.0°
C32	N4	C22	C23	42.1°	90.0°
C32	N4	C21	H18	176.8°	90.0°
C32	N4	C21	H19	63.9°	90.0°
C32	N4	C22	H20	162.9°	90.0°
C32	N4	C22	H21	78.8°	90.0°
C32	N4	C31	H31	180.0°	90.0°
C32	N4	C31	H32	60.0°	90.0°
C32	N4	C31	H33	60.0°	90.0°
N4	C32	H34	H35	118.4°	90.0°
N4	C32	C33	H36	175.4°	90.0°
N4	C32	C33	H37	65.3°	90.0°
C18	C17	C16	C15	0.1°	90.0°
C18	C17	C16	H14	180.0°	90.0°
C18	C17	C16	F2	179.8°	90.0°
C2	C1	C35	F1	179.6°	90.0°
C1	C2	C3	H2	179.8°	90.0°
C2	C1	C35	H39	178.3°	90.0°
C28	C29	C30	H29	180.0°	90.0°
C29	C28	C27	H28	180.0°	90.0°
C28	C29	C30	C25	0.2°	90.0°
C29	C28	C27	C26	0.3°	90.0°
C29	C28	C27	H27	179.7°	90.0°
C28	C29	C30	H30	179.8°	90.0°
C30	C29	C28	C27	0.5°	90.0°
C29	C30	C25	H30	180.0°	90.0°
C29	C30	C25	C26	0.3°	90.0°
C29	C30	C25	C24	179.2°	90.0°
C30	C29	C28	H28	179.5°	90.0°
C31	N4	C21	C22	119.8°	90.0°
C31	N4	C22	C23	80.3°	90.0°
C31	N4	C21	H18	54.5°	90.0°
C31	N4	C21	H19	173.8°	90.0°
C31	N4	C22	H20	40.5°	90.0°
C31	N4	C22	H21	158.8°	90.0°
N4	C31	H31	H32	120.0°	90.0°
N4	C31	H31	H33	120.0°	90.0°
N4	C31	H32	H33	120.0°	90.0°
C31	N4	C32	H34	174.4°	90.0°
C31	N4	C32	H35	55.5°	90.0°
C35	C1	C2	H1	179.6°	90.0°
C1	C35	C34	H38	177.5°	90.0°
C15	C16	C17	F2	179.7°	90.0°
C16	C15	C14	H12	179.1°	90.0°
C15	C16	C17	H14	179.8°	90.0°
C28	C27	C26	H27	180.0°	90.0°
C28	C27	C26	C25	0.2°	90.0°
C28	C27	C26	H26	179.8°	90.0°
C27	C28	C29	H29	179.5°	90.0°
F1	C1	C2	H1	0.0°	90.0°
F1	C1	C35	H39	1.3°	90.0°
C30	C25	C26	C27	0.5°	90.0°
C30	C25	C26	C24	179.0°	90.0°
C30	C25	C24	C23	14.5°	90.0°
C30	C25	C24	H24	106.9°	90.0°
C30	C25	C24	H25	135.9°	90.0°
C30	C25	C26	H26	179.5°	90.0°
C25	C30	C29	H29	179.8°	90.0°
C21	N4	C22	C23	158.8°	90.0°
N4	C21	C20	H16	63.9°	90.0°
N4	C21	C20	H17	176.9°	90.0°
N4	C21	H18	H19	118.9°	90.0°
C21	N4	C22	H20	80.4°	90.0°
C21	N4	C22	H21	37.9°	90.0°
C21	N4	C31	H31	60.8°	90.0°
C21	N4	C31	H32	179.2°	90.0°
C21	N4	C31	H33	59.2°	90.0°
C21	N4	C32	H34	64.3°	90.0°
C21	N4	C32	H35	176.8°	90.0°
N4	C22	C23	H20	120.9°	90.0°
N4	C22	C23	H21	120.9°	90.0°
N4	C22	C23	C24	98.3°	90.0°
C22	N4	C21	H18	65.3°	90.0°
C22	N4	C21	H19	54.0°	90.0°
N4	C22	H20	H21	117.3°	90.0°
N4	C22	C23	H22	22.2°	90.0°
N4	C22	C23	H23	141.2°	90.0°
C22	N4	C31	H31	59.7°	90.0°
C22	N4	C31	H32	60.3°	90.0°
C22	N4	C31	H33	179.7°	90.0°
C22	N4	C32	H34	54.2°	90.0°
C22	N4	C32	H35	64.7°	90.0°
C17	C16	C15	H13	179.5°	90.0°
C16	C17	C18	H15	179.7°	90.0°
F2	C16	C15	H13	0.8°	90.0°
F2	C16	C17	H14	0.1°	90.0°
C27	C26	C25	H26	180.0°	90.0°
C27	C26	C25	C24	179.4°	90.0°
C26	C27	C28	H28	179.7°	90.0°
C26	C25	C24	C23	166.5°	90.0°
C26	C25	C24	H24	72.0°	90.0°
C26	C25	C24	H25	45.2°	90.0°
C25	C26	C27	H27	179.8°	90.0°
C26	C25	C30	H30	179.7°	90.0°
C25	C24	C23	C22	149.8°	90.0°
C25	C24	C23	H24	121.4°	90.0°
C25	C24	C23	H25	121.4°	90.0°
C25	C24	C23	H22	29.2°	90.0°
C25	C24	C23	H23	89.7°	90.0°
C25	C24	H24	H25	115.5°	90.0°
C24	C25	C26	H26	0.5°	90.0°
C24	C25	C30	H30	0.8°	90.0°
C22	C23	C24	H22	120.5°	90.0°
C22	C23	C24	H23	120.5°	90.0°
C23	C22	H20	H21	117.2°	90.0°
C22	C23	H22	H23	118.4°	90.0°
C22	C23	C24	H24	28.4°	90.0°
C22	C23	C24	H25	88.8°	90.0°
C24	C23	C22	H20	140.8°	90.0°
C24	C23	C22	H21	22.6°	90.0°
C24	C23	H22	H23	118.4°	90.0°
C23	C24	H24	H25	115.5°	90.0°
H1	C2	C3	H2	0.2°	90.0°
H3	C5	C6	H5	60.5°	90.0°
H3	C5	C6	H6	180.0°	90.0°
H4	C5	C6	H5	59.2°	90.0°
H4	C5	C6	H6	60.3°	90.0°
H5	C6	N1	H7	42.4°	90.0°
H6	C6	N1	H7	161.9°	90.0°
H8	C9	C10	H9	0.4°	90.0°
H12	C14	C15	H13	1.0°	90.0°
H14	C17	C18	H15	0.3°	90.0°
H16	C20	C21	H18	56.5°	90.0°
H16	C20	C21	H19	175.7°	90.0°
H17	C20	C21	H18	62.8°	90.0°
H17	C20	C21	H19	56.5°	90.0°
H20	C22	C23	H22	98.6°	90.0°
H20	C22	C23	H23	20.3°	90.0°
H21	C22	C23	H22	143.1°	90.0°
H21	C22	C23	H23	97.9°	90.0°
H22	C23	C24	H24	92.1°	90.0°
H22	C23	C24	H25	150.7°	90.0°
H23	C23	C24	H24	148.9°	90.0°
H23	C23	C24	H25	31.7°	90.0°
H26	C26	C27	H27	0.2°	90.0°
H27	C27	C28	H28	0.3°	90.0°
H28	C28	C29	H29	0.5°	90.0°
H29	C29	C30	H30	0.2°	90.0°
H31	C31	H32	H33	120.0°	90.0°
H34	C32	C33	H36	54.9°	90.0°
H34	C32	C33	H37	174.2°	90.0°
H35	C32	C33	H36	64.0°	90.0°
H35	C32	C33	H37	55.3°	90.0°
H38	C34	C35	H39	2.5°	90.0°

Release date:	2024-04-03
Definition date:	2023-06-19
Last modified:	2024-03-29
Release status:	REL
Processing site:	PDBE
Derived from:	8PF4