R1Z

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C21	C22	doub	0.00Å	1.46Å	Aromatic
C21	C20	sing	0.00Å	1.33Å	Aromatic
C22	C23	sing	0.00Å	1.36Å	Aromatic
C25	C26	doub	0.00Å	1.38Å	Aromatic
C25	C24	sing	0.00Å	1.37Å	Aromatic
C26	C27	sing	0.00Å	1.38Å	Aromatic
C20	C19	doub	0.00Å	1.48Å	Aromatic
C23	C24	sing	0.00Å	1.47Å
C23	N5	doub	0.00Å	1.43Å	Aromatic
C24	N6	doub	0.00Å	1.34Å	Aromatic
C27	C28	doub	0.00Å	1.38Å	Aromatic
C19	N5	sing	0.00Å	1.32Å	Aromatic
N5	RU1	sing	0.00Å	2.02Å
N6	C28	sing	0.00Å	1.34Å	Aromatic
N6	RU1	sing	0.00Å	2.07Å
C14	C15	doub	0.00Å	1.38Å	Aromatic
C14	C13	sing	0.00Å	1.40Å	Aromatic
C15	N1	sing	0.00Å	1.33Å	Aromatic
C13	C1	doub	0.00Å	1.42Å	Aromatic
N1	RU1	sing	0.00Å	2.05Å
N1	C2	doub	0.00Å	1.34Å	Aromatic
RU1	N8	sing	0.00Å	2.02Å
RU1	N2	sing	0.00Å	2.06Å
RU1	N7	sing	0.00Å	2.06Å
C1	C2	sing	0.00Å	1.40Å	Aromatic
C1	C12	sing	0.00Å	1.43Å	Aromatic
C38	N8	doub	0.00Å	1.32Å	Aromatic
C38	C37	sing	0.00Å	1.49Å	Aromatic
C2	C3	sing	0.00Å	1.40Å	Aromatic
N8	C34	sing	0.00Å	1.42Å	Aromatic
N4	C12	doub	0.00Å	1.34Å	Aromatic
N4	C11	sing	0.00Å	1.36Å	Aromatic
C37	C36	doub	0.00Å	1.33Å	Aromatic
C12	C5	sing	0.00Å	1.42Å	Aromatic
C3	N2	doub	0.00Å	1.36Å	Aromatic
C3	C4	sing	0.00Å	1.38Å	Aromatic
N2	C16	sing	0.00Å	1.33Å	Aromatic
C10	C11	doub	0.00Å	1.40Å	Aromatic
C10	C9	sing	0.00Å	1.38Å	Aromatic
C11	C6	sing	0.00Å	1.42Å	Aromatic
N7	C29	doub	0.00Å	1.34Å	Aromatic
N7	C33	sing	0.00Å	1.36Å	Aromatic
C5	C4	sing	0.00Å	1.42Å	Aromatic
C5	N3	doub	0.00Å	1.34Å	Aromatic
C34	C33	sing	0.00Å	1.48Å
C34	C35	doub	0.00Å	1.36Å	Aromatic
C36	C35	sing	0.00Å	1.45Å	Aromatic
C4	C18	doub	0.00Å	1.43Å	Aromatic
C29	C30	sing	0.00Å	1.39Å	Aromatic
C16	C17	doub	0.00Å	1.38Å	Aromatic
C9	C8	doub	0.00Å	1.38Å	Aromatic
C33	C32	doub	0.00Å	1.38Å	Aromatic
C6	N3	sing	0.00Å	1.36Å	Aromatic
C6	C7	doub	0.00Å	1.40Å	Aromatic
C18	C17	sing	0.00Å	1.40Å	Aromatic
C8	C7	sing	0.00Å	1.38Å	Aromatic
C30	C31	doub	0.00Å	1.38Å	Aromatic
C32	C31	sing	0.00Å	1.39Å	Aromatic
C29	H291	sing	0.00Å	1.08Å
C30	H301	sing	0.00Å	1.08Å
C31	H311	sing	0.00Å	1.08Å
C32	H321	sing	0.00Å	1.08Å
C38	H381	sing	0.00Å	1.08Å
C37	H371	sing	0.00Å	1.08Å
C36	H361	sing	0.00Å	1.08Å
C35	H351	sing	0.00Å	1.08Å
C28	H281	sing	0.00Å	1.08Å
C27	H271	sing	0.00Å	1.08Å
C26	H261	sing	0.00Å	1.08Å
C25	H251	sing	0.00Å	1.08Å
C19	H191	sing	0.00Å	1.08Å
C20	H201	sing	0.00Å	1.08Å
C21	H211	sing	0.00Å	1.08Å
C22	H221	sing	0.00Å	1.08Å
C10	H101	sing	0.00Å	1.08Å
C13	H131	sing	0.00Å	1.08Å
C14	H141	sing	0.00Å	1.08Å
C15	H151	sing	0.00Å	1.08Å
C9	H91	sing	0.00Å	1.08Å
C8	H81	sing	0.00Å	1.08Å
C7	H71	sing	0.00Å	1.08Å
C18	H181	sing	0.00Å	1.08Å
C17	H171	sing	0.00Å	1.08Å
C16	H161	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C22	C21	C20	119.0°	90.0°
C21	C22	C23	119.2°	90.0°
C22	C21	H211	120.5°	90.0°
C21	C22	H221	120.4°	90.0°
C21	C20	C19	120.0°	90.0°
C21	C20	H201	120.0°	90.0°
C20	C21	H211	120.5°	90.0°
C22	C23	C24	125.0°	90.0°
C22	C23	N5	122.1°	90.0°
C23	C22	H221	120.4°	90.0°
C26	C25	C24	116.9°	90.0°
C25	C26	C27	120.3°	90.0°
C25	C26	H261	119.9°	90.0°
C26	C25	H251	121.6°	90.0°
C25	C24	C23	120.6°	90.0°
C25	C24	N6	124.3°	90.0°
C24	C25	H251	121.5°	90.0°
C26	C27	C28	118.5°	90.0°
C26	C27	H271	120.7°	90.0°
C27	C26	H261	119.9°	90.0°
C20	C19	N5	121.5°	90.0°
C20	C19	H191	119.3°	90.0°
C19	C20	H201	120.0°	90.0°
C24	C23	N5	113.0°	90.0°
C23	C24	N6	115.1°	90.0°
C23	N5	C19	118.2°	90.0°
C23	N5	RU1	116.1°	90.0°
C24	N6	C28	117.8°	90.0°
C24	N6	RU1	116.9°	90.0°
C27	C28	N6	122.1°	90.0°
C27	C28	H281	118.9°	90.0°
C28	C27	H271	120.7°	90.0°
C19	N5	RU1	125.7°	90.0°
N5	C19	H191	119.3°	90.0°
N5	RU1	N6	78.7°	90.0°
N5	RU1	N1	93.0°	90.0°
N5	RU1	N8	94.7°	90.0°
N5	RU1	N2	93.5°	90.0°
N5	RU1	N7	173.0°	90.0°
C28	N6	RU1	125.2°	90.0°
N6	C28	H281	118.9°	90.0°
N6	RU1	N1	98.2°	90.0°
N6	RU1	N8	86.7°	90.0°
N6	RU1	N2	171.7°	90.0°
N6	RU1	N7	96.3°	90.0°
C15	C14	C13	117.8°	90.0°
C14	C15	N1	124.2°	90.0°
C15	C14	H141	121.1°	90.0°
C14	C15	H151	117.9°	90.0°
C14	C13	C1	119.1°	90.0°
C14	C13	H131	120.4°	90.0°
C13	C14	H141	121.1°	90.0°
C15	N1	RU1	127.3°	90.0°
C15	N1	C2	119.1°	90.0°
N1	C15	H151	117.9°	90.0°
C13	C1	C2	117.7°	90.0°
C13	C1	C12	122.3°	90.0°
C1	C13	H131	120.5°	90.0°
RU1	N1	C2	113.6°	90.0°
N1	RU1	N8	171.6°	90.0°
N1	RU1	N2	79.3°	90.0°
N1	RU1	N7	92.7°	90.0°
N1	C2	C1	122.0°	90.0°
N1	C2	C3	117.5°	90.0°
N8	RU1	N2	96.8°	90.0°
N8	RU1	N7	80.0°	90.0°
RU1	N8	C38	126.0°	90.0°
RU1	N8	C34	115.5°	90.0°
N2	RU1	N7	91.7°	90.0°
RU1	N2	C3	113.2°	90.0°
RU1	N2	C16	127.4°	90.0°
RU1	N7	C29	126.2°	90.0°
RU1	N7	C33	115.1°	90.0°
C2	C1	C12	120.0°	90.0°
C1	C2	C3	120.5°	90.0°
C1	C12	N4	120.0°	90.0°
C1	C12	C5	118.4°	90.0°
N8	C38	C37	120.5°	90.0°
C38	N8	C34	118.4°	90.0°
N8	C38	H381	119.8°	90.0°
C38	C37	C36	120.4°	90.0°
C37	C38	H381	119.7°	90.0°
C38	C37	H371	119.8°	90.0°
C2	C3	N2	116.4°	90.0°
C2	C3	C4	121.2°	90.0°
N8	C34	C33	112.8°	90.0°
N8	C34	C35	122.7°	90.0°
C12	N4	C11	117.2°	90.0°
N4	C12	C5	121.7°	90.0°
N4	C11	C10	118.7°	90.0°
N4	C11	C6	121.5°	90.0°
C37	C36	C35	119.1°	90.0°
C36	C37	H371	119.8°	90.0°
C37	C36	H361	120.4°	90.0°
C12	C5	C4	120.7°	90.0°
C12	C5	N3	121.3°	90.0°
N2	C3	C4	122.4°	90.0°
C3	N2	C16	119.4°	90.0°
C3	C4	C5	119.2°	90.0°
C3	C4	C18	116.9°	90.0°
N2	C16	C17	123.6°	90.0°
N2	C16	H161	118.2°	90.0°
C11	C10	C9	119.1°	90.0°
C10	C11	C6	119.8°	90.0°
C11	C10	H101	120.4°	90.0°
C10	C9	C8	120.9°	90.0°
C9	C10	H101	120.4°	90.0°
C10	C9	H91	119.6°	90.0°
C11	C6	N3	120.4°	90.0°
C11	C6	C7	119.8°	90.0°
C29	N7	C33	118.5°	90.0°
N7	C29	C30	121.7°	90.0°
N7	C29	H291	119.2°	90.0°
N7	C33	C34	116.0°	90.0°
N7	C33	C32	123.0°	90.0°
C4	C5	N3	118.0°	90.0°
C5	C4	C18	123.9°	90.0°
C5	N3	C6	117.8°	90.0°
C33	C34	C35	124.4°	90.0°
C34	C33	C32	121.0°	90.0°
C34	C35	C36	118.9°	90.0°
C34	C35	H351	120.6°	90.0°
C35	C36	H361	120.4°	90.0°
C36	C35	H351	120.5°	90.0°
C4	C18	C17	120.3°	90.0°
C4	C18	H181	119.9°	90.0°
C29	C30	C31	119.3°	90.0°
C30	C29	H291	119.1°	90.0°
C29	C30	H301	120.3°	90.0°
C16	C17	C18	117.5°	90.0°
C16	C17	H171	121.2°	90.0°
C17	C16	H161	118.2°	90.0°
C9	C8	C7	121.6°	90.0°
C8	C9	H91	119.5°	90.0°
C9	C8	H81	119.2°	90.0°
C33	C32	C31	117.8°	90.0°
C33	C32	H321	121.1°	90.0°
N3	C6	C7	119.7°	90.0°
C6	C7	C8	118.7°	90.0°
C6	C7	H71	120.7°	90.0°
C17	C18	H181	119.9°	90.0°
C18	C17	H171	121.3°	90.0°
C7	C8	H81	119.2°	90.0°
C8	C7	H71	120.7°	90.0°
C30	C31	C32	119.6°	90.0°
C31	C30	H301	120.3°	90.0°
C30	C31	H311	120.2°	90.0°
C32	C31	H311	120.2°	90.0°
C31	C32	H321	121.1°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C22	C21	C20	H211	180.0°	90.0°
C21	C22	C23	H221	180.0°	90.0°
C22	C21	C20	C19	1.5°	90.0°
C21	C22	C23	C24	179.0°	90.0°
C21	C22	C23	N5	0.6°	90.0°
C22	C21	C20	H201	178.5°	90.0°
C20	C21	C22	C23	1.3°	90.0°
C21	C20	C19	H201	180.0°	90.0°
C21	C20	C19	N5	0.2°	90.0°
C21	C20	C19	H191	179.9°	90.0°
C20	C21	C22	H221	178.7°	90.0°
C22	C23	C24	C25	1.7°	90.0°
C22	C23	C24	N5	179.6°	90.0°
C22	C23	C24	N6	180.0°	90.0°
C22	C23	N5	C19	2.2°	90.0°
C22	C23	N5	RU1	176.6°	90.0°
C23	C22	C21	H211	178.7°	90.0°
C26	C25	C24	H251	180.0°	90.0°
C25	C26	C27	H261	180.0°	90.0°
C26	C25	C24	C23	179.3°	90.0°
C26	C25	C24	N6	1.2°	90.0°
C25	C26	C27	C28	0.2°	90.0°
C25	C26	C27	H271	179.8°	90.0°
C24	C25	C26	C27	0.7°	90.0°
C25	C24	C23	N6	178.3°	90.0°
C25	C24	C23	N5	177.9°	90.0°
C25	C24	N6	C28	1.0°	90.0°
C25	C24	N6	RU1	178.6°	90.0°
C24	C25	C26	H261	179.3°	90.0°
C26	C27	C28	H271	180.0°	90.0°
C26	C27	C28	N6	0.1°	90.0°
C26	C27	C28	H281	180.0°	90.0°
C27	C26	C25	H251	179.3°	90.0°
C20	C19	N5	C23	2.0°	90.0°
C20	C19	N5	H191	180.0°	90.0°
C20	C19	N5	RU1	176.7°	90.0°
C19	C20	C21	H211	178.5°	90.0°
C24	C23	N5	C19	177.4°	90.0°
C24	C23	N5	RU1	3.8°	90.0°
C23	C24	N6	C28	179.2°	90.0°
C23	C24	N6	RU1	3.2°	90.0°
C23	C24	C25	H251	0.7°	90.0°
C24	C23	C22	H221	1.0°	90.0°
N5	C23	C24	N6	0.4°	90.0°
C23	N5	C19	RU1	178.7°	90.0°
C23	N5	RU1	N6	4.1°	90.0°
C23	N5	RU1	N1	101.9°	90.0°
C23	N5	RU1	N8	81.5°	90.0°
C23	N5	RU1	N2	178.7°	90.0°
C23	N5	RU1	N7	41.3°	90.0°
C23	N5	C19	H191	178.0°	90.0°
N5	C23	C22	H221	179.4°	90.0°
C24	N6	C28	C27	0.5°	90.0°
C24	N6	RU1	N5	4.0°	90.0°
C24	N6	C28	RU1	177.4°	90.0°
C24	N6	RU1	N1	95.4°	90.0°
C24	N6	RU1	N8	91.4°	90.0°
C24	N6	RU1	N2	23.9°	90.0°
C24	N6	RU1	N7	170.9°	90.0°
C24	N6	C28	H281	179.6°	90.0°
N6	C24	C25	H251	178.9°	90.0°
C27	C28	N6	H281	180.0°	90.0°
C27	C28	N6	RU1	177.8°	90.0°
C28	C27	C26	H261	179.8°	90.0°
C19	N5	RU1	N6	177.2°	90.0°
C19	N5	RU1	N1	79.4°	90.0°
C19	N5	RU1	N8	97.2°	90.0°
C19	N5	RU1	N2	0.0°	90.0°
C19	N5	RU1	N7	137.4°	90.0°
N5	C19	C20	H201	179.8°	90.0°
N5	RU1	N6	C28	178.6°	90.0°
N5	RU1	N6	N1	91.4°	90.0°
N5	RU1	N6	N8	95.5°	90.0°
N5	RU1	N6	N2	19.8°	90.0°
N5	RU1	N6	N7	175.0°	90.0°
N5	RU1	N1	C15	87.6°	90.0°
N5	RU1	N1	N8	156.0°	90.0°
N5	RU1	N1	N2	93.0°	90.0°
N5	RU1	N1	N7	175.8°	90.0°
N5	RU1	N1	C2	94.5°	90.0°
N5	RU1	N8	N2	94.1°	90.0°
N5	RU1	N8	N7	175.4°	90.0°
N5	RU1	N2	N7	175.3°	90.0°
N5	RU1	N8	C38	6.3°	90.0°
N5	RU1	N8	C34	169.5°	90.0°
N5	RU1	N2	C3	92.9°	90.0°
N5	RU1	N2	C16	86.3°	90.0°
N5	RU1	N7	C29	140.9°	90.0°
N5	RU1	N7	C33	34.0°	90.0°
RU1	N5	C19	H191	3.3°	90.0°
C28	N6	RU1	N1	87.2°	90.0°
C28	N6	RU1	N8	86.0°	90.0°
C28	N6	RU1	N2	158.7°	90.0°
C28	N6	RU1	N7	6.5°	90.0°
N6	C28	C27	H271	179.9°	90.0°
N6	RU1	N1	C15	8.6°	90.0°
N6	RU1	N1	N8	125.0°	90.0°
N6	RU1	N1	N2	172.0°	90.0°
N6	RU1	N1	N7	96.8°	90.0°
N6	RU1	N1	C2	173.6°	90.0°
N6	RU1	N8	N2	172.5°	90.0°
N6	RU1	N8	N7	97.0°	90.0°
N6	RU1	N2	N7	165.3°	90.0°
N6	RU1	N8	C38	84.7°	90.0°
N6	RU1	N8	C34	91.1°	90.0°
N6	RU1	N2	C3	73.4°	90.0°
N6	RU1	N2	C16	105.8°	90.0°
N6	RU1	N7	C29	96.2°	90.0°
N6	RU1	N7	C33	78.6°	90.0°
RU1	N6	C28	H281	2.2°	90.0°
C15	C14	C13	H141	180.0°	90.0°
C14	C15	N1	H151	180.0°	90.0°
C15	C14	C13	C1	2.0°	90.0°
C14	C15	N1	RU1	177.3°	90.0°
C14	C15	N1	C2	0.5°	90.0°
C15	C14	C13	H131	178.0°	90.0°
C13	C14	C15	N1	0.3°	90.0°
C14	C13	C1	H131	180.0°	90.0°
C14	C13	C1	C2	2.9°	90.0°
C14	C13	C1	C12	177.3°	90.0°
C13	C14	C15	H151	179.7°	90.0°
C15	N1	RU1	C2	177.8°	90.0°
C15	N1	RU1	N8	116.4°	90.0°
C15	N1	RU1	N2	179.4°	90.0°
C15	N1	RU1	N7	88.2°	90.0°
C15	N1	C2	C1	0.5°	90.0°
C15	N1	C2	C3	179.6°	90.0°
N1	C15	C14	H141	179.7°	90.0°
C13	C1	C2	N1	2.2°	90.0°
C13	C1	C2	C12	179.7°	90.0°
C13	C1	C2	C3	178.7°	90.0°
C13	C1	C12	N4	0.5°	90.0°
C13	C1	C12	C5	179.2°	90.0°
C1	C13	C14	H141	178.0°	90.0°
N1	RU1	N8	N2	61.8°	90.0°
N1	RU1	N8	N7	28.7°	90.0°
N1	RU1	N2	N7	92.4°	90.0°
RU1	N1	C2	C1	178.6°	90.0°
N1	RU1	N8	C38	149.6°	90.0°
RU1	N1	C2	C3	2.4°	90.0°
N1	RU1	N8	C34	34.6°	90.0°
N1	RU1	N2	C3	0.5°	90.0°
N1	RU1	N2	C16	178.7°	90.0°
N1	RU1	N7	C29	2.3°	90.0°
N1	RU1	N7	C33	177.2°	90.0°
RU1	N1	C15	H151	2.7°	90.0°
C2	N1	RU1	N8	61.4°	90.0°
C2	N1	RU1	N2	1.6°	90.0°
C2	N1	RU1	N7	89.7°	90.0°
N1	C2	C1	C3	179.0°	90.0°
N1	C2	C1	C12	178.1°	90.0°
N1	C2	C3	N2	1.9°	90.0°
N1	C2	C3	C4	176.4°	90.0°
C2	N1	C15	H151	179.5°	90.0°
N8	RU1	N2	N7	80.1°	90.0°
RU1	N8	C38	C34	175.7°	90.0°
RU1	N8	C38	C37	178.0°	90.0°
N8	RU1	N2	C3	171.9°	90.0°
N8	RU1	N2	C16	8.8°	90.0°
N8	RU1	N7	C29	178.3°	90.0°
N8	RU1	N7	C33	6.8°	90.0°
RU1	N8	C34	C33	4.2°	90.0°
RU1	N8	C34	C35	178.9°	90.0°
RU1	N8	C38	H381	1.9°	90.0°
N2	RU1	N8	C38	87.8°	90.0°
RU1	N2	C3	C2	0.5°	90.0°
N2	RU1	N8	C34	96.4°	90.0°
RU1	N2	C3	C16	179.3°	90.0°
RU1	N2	C3	C4	177.8°	90.0°
N2	RU1	N7	C29	81.7°	90.0°
N2	RU1	N7	C33	103.5°	90.0°
RU1	N2	C16	C17	178.5°	90.0°
RU1	N2	C16	H161	1.5°	90.0°
N7	RU1	N8	C38	178.3°	90.0°
N7	RU1	N8	C34	5.9°	90.0°
N7	RU1	N2	C3	91.8°	90.0°
N7	RU1	N2	C16	88.9°	90.0°
RU1	N7	C29	C33	174.7°	90.0°
RU1	N7	C33	C34	6.6°	90.0°
RU1	N7	C29	C30	173.4°	90.0°
RU1	N7	C33	C32	174.1°	90.0°
RU1	N7	C29	H291	6.6°	90.0°
C2	C1	C12	N4	179.2°	90.0°
C2	C1	C12	C5	1.1°	90.0°
C1	C2	C3	N2	179.0°	90.0°
C1	C2	C3	C4	2.7°	90.0°
C2	C1	C13	H131	177.1°	90.0°
C12	C1	C2	C3	1.0°	90.0°
C1	C12	N4	C5	179.7°	90.0°
C1	C12	N4	C11	178.3°	90.0°
C1	C12	C5	C4	1.6°	90.0°
C1	C12	C5	N3	178.8°	90.0°
C12	C1	C13	H131	2.6°	90.0°
N8	C38	C37	H381	180.0°	90.0°
N8	C38	C37	C36	0.8°	90.0°
C38	N8	C34	C33	179.7°	90.0°
C38	N8	C34	C35	2.7°	90.0°
N8	C38	C37	H371	179.2°	90.0°
C37	C38	N8	C34	2.3°	90.0°
C38	C37	C36	H371	180.0°	90.0°
C38	C37	C36	C35	0.4°	90.0°
C38	C37	C36	H361	179.6°	90.0°
C2	C3	N2	C4	178.3°	90.0°
C2	C3	N2	C16	179.8°	90.0°
C2	C3	C4	C5	2.2°	90.0°
C2	C3	C4	C18	179.1°	90.0°
N8	C34	C33	N7	1.7°	90.0°
N8	C34	C33	C35	176.9°	90.0°
N8	C34	C35	C36	1.5°	90.0°
N8	C34	C33	C32	179.0°	90.0°
C34	N8	C38	H381	177.7°	90.0°
N8	C34	C35	H351	178.5°	90.0°
C12	N4	C11	C10	177.9°	90.0°
C12	N4	C11	C6	0.3°	90.0°
N4	C12	C5	C4	178.7°	90.0°
N4	C12	C5	N3	0.9°	90.0°
C11	N4	C12	C5	1.4°	90.0°
N4	C11	C10	C6	178.2°	90.0°
N4	C11	C10	C9	179.2°	90.0°
N4	C11	C6	N3	1.4°	90.0°
N4	C11	C6	C7	178.7°	90.0°
N4	C11	C10	H101	0.8°	90.0°
C37	C36	C35	C34	0.1°	90.0°
C37	C36	C35	H361	180.0°	90.0°
C36	C37	C38	H381	179.2°	90.0°
C37	C36	C35	H351	180.0°	90.0°
C12	C5	C4	C3	0.1°	90.0°
C12	C5	C4	N3	179.7°	90.0°
C12	C5	C4	C18	178.7°	90.0°
C12	C5	N3	C6	0.8°	90.0°
N2	C3	C4	C5	179.6°	90.0°
N2	C3	C4	C18	0.9°	90.0°
C3	N2	C16	C17	0.7°	90.0°
C3	N2	C16	H161	179.3°	90.0°
C4	C3	N2	C16	1.5°	90.0°
C3	C4	C5	C18	178.6°	90.0°
C3	C4	C5	N3	179.6°	90.0°
C3	C4	C18	C17	0.6°	90.0°
C3	C4	C18	H181	179.4°	90.0°
N2	C16	C17	H161	180.0°	90.0°
N2	C16	C17	C18	0.8°	90.0°
N2	C16	C17	H171	179.2°	90.0°
C11	C10	C9	H101	180.0°	90.0°
C11	C10	C9	C8	0.0°	90.0°
C10	C11	C6	N3	179.6°	90.0°
C10	C11	C6	C7	3.1°	90.0°
C11	C10	C9	H91	180.0°	90.0°
C9	C10	C11	C6	2.6°	90.0°
C10	C9	C8	H91	180.0°	90.0°
C10	C9	C8	C7	2.2°	90.0°
C10	C9	C8	H81	177.8°	90.0°
C11	C6	N3	C5	1.9°	90.0°
C11	C6	N3	C7	177.3°	90.0°
C11	C6	C7	C8	1.0°	90.0°
C6	C11	C10	H101	177.4°	90.0°
C11	C6	C7	H71	179.0°	90.0°
C29	N7	C33	C34	178.2°	90.0°
N7	C29	C30	H291	180.0°	90.0°
C29	N7	C33	C32	1.2°	90.0°
N7	C29	C30	C31	1.0°	90.0°
N7	C29	C30	H301	179.0°	90.0°
N7	C33	C34	C32	179.3°	90.0°
N7	C33	C34	C35	175.2°	90.0°
C33	N7	C29	C30	1.3°	90.0°
N7	C33	C32	C31	0.8°	90.0°
C33	N7	C29	H291	178.7°	90.0°
N7	C33	C32	H321	179.2°	90.0°
C4	C5	N3	C6	179.6°	90.0°
C5	C4	C18	C17	178.0°	90.0°
C5	C4	C18	H181	2.0°	90.0°
N3	C5	C4	C18	1.0°	90.0°
C5	N3	C6	C7	179.2°	90.0°
C33	C34	C35	C36	178.1°	90.0°
C34	C33	C32	C31	178.5°	90.0°
C34	C33	C32	H321	1.5°	90.0°
C33	C34	C35	H351	1.9°	90.0°
C34	C35	C36	H351	180.0°	90.0°
C35	C34	C33	C32	4.1°	90.0°
C34	C35	C36	H361	179.9°	90.0°
C35	C36	C37	H371	179.5°	90.0°
C4	C18	C17	C16	1.4°	90.0°
C4	C18	C17	H181	180.0°	90.0°
C4	C18	C17	H171	178.6°	90.0°
C29	C30	C31	H301	180.0°	90.0°
C29	C30	C31	C32	0.6°	90.0°
C29	C30	C31	H311	179.4°	90.0°
C16	C17	C18	H171	180.0°	90.0°
C16	C17	C18	H181	178.6°	90.0°
C9	C8	C7	C6	1.7°	90.0°
C9	C8	C7	H81	180.0°	90.0°
C8	C9	C10	H101	180.0°	90.0°
C9	C8	C7	H71	178.3°	90.0°
C33	C32	C31	C30	0.5°	90.0°
C33	C32	C31	H321	180.0°	90.0°
C33	C32	C31	H311	179.5°	90.0°
N3	C6	C7	C8	178.3°	90.0°
N3	C6	C7	H71	1.7°	90.0°
C6	C7	C8	H71	180.0°	90.0°
C6	C7	C8	H81	178.4°	90.0°
C18	C17	C16	H161	179.2°	90.0°
C7	C8	C9	H91	177.8°	90.0°
C30	C31	C32	H311	180.0°	90.0°
C31	C30	C29	H291	179.0°	90.0°
C30	C31	C32	H321	179.5°	90.0°
C32	C31	C30	H301	179.4°	90.0°
H291	C29	C30	H301	1.0°	90.0°
H301	C30	C31	H311	0.6°	90.0°
H311	C31	C32	H321	0.5°	90.0°
H381	C38	C37	H371	0.8°	90.0°
H371	C37	C36	H361	0.5°	90.0°
H361	C36	C35	H351	0.0°	90.0°
H281	C28	C27	H271	0.0°	90.0°
H271	C27	C26	H261	0.2°	90.0°
H261	C26	C25	H251	0.7°	90.0°
H191	C19	C20	H201	0.1°	90.0°
H201	C20	C21	H211	1.5°	90.0°
H211	C21	C22	H221	1.3°	90.0°
H101	C10	C9	H91	0.0°	90.0°
H131	C13	C14	H141	2.0°	90.0°
H141	C14	C15	H151	0.3°	90.0°
H91	C9	C8	H81	2.2°	90.0°
H81	C8	C7	H71	1.7°	90.0°
H181	C18	C17	H171	1.4°	90.0°
H171	C17	C16	H161	0.8°	90.0°

Definition date:	2012-03-15
Last modified:	2013-02-14
Release status:	REL
Processing site:	RCSB
Derived from:	4E1U