0K8

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C33	C34	doub	0.00Å	1.35Å	Aromatic
C33	C32	sing	0.00Å	1.44Å	Aromatic
C30	C32	sing	0.00Å	1.41Å	Aromatic
C30	C29	doub	0.00Å	1.38Å	Aromatic
C34	C35	sing	0.00Å	1.43Å	Aromatic
C32	C31	doub	0.00Å	1.40Å	Aromatic
C29	C28	sing	0.00Å	1.40Å	Aromatic
C35	C36	sing	0.00Å	1.41Å	Aromatic
C35	C39	doub	0.00Å	1.41Å	Aromatic
C31	C39	sing	0.00Å	1.42Å	Aromatic
C31	N5	sing	0.00Å	1.36Å	Aromatic
C36	C37	doub	0.00Å	1.38Å	Aromatic
C28	N5	doub	0.00Å	1.34Å	Aromatic
C39	N6	sing	0.00Å	1.35Å	Aromatic
N5	RU1	sing	0.00Å	2.11Å
C26	C25	sing	0.00Å	1.39Å	Aromatic
C26	C27	doub	0.00Å	1.38Å	Aromatic
C25	N4	doub	0.00Å	1.33Å	Aromatic
C37	C38	sing	0.00Å	1.39Å	Aromatic
N6	C38	doub	0.00Å	1.31Å	Aromatic
N6	RU1	sing	0.00Å	2.10Å
C27	C24	sing	0.00Å	1.40Å	Aromatic
N4	RU1	sing	0.00Å	2.09Å
N4	C23	sing	0.00Å	1.34Å	Aromatic
RU1	N8	sing	0.00Å	2.10Å
RU1	N7	sing	0.00Å	2.11Å
RU1	N3	sing	0.00Å	2.10Å
C51	N8	doub	0.00Å	1.33Å	Aromatic
C51	C50	sing	0.00Å	1.40Å	Aromatic
N8	C48	sing	0.00Å	1.35Å	Aromatic
C24	C23	doub	0.00Å	1.39Å	Aromatic
C24	C17	sing	0.00Å	1.45Å	Aromatic
C23	C22	sing	0.00Å	1.44Å	Aromatic
C50	C49	doub	0.00Å	1.38Å	Aromatic
N7	C40	doub	0.00Å	1.32Å	Aromatic
N7	C44	sing	0.00Å	1.36Å	Aromatic
C40	C41	sing	0.00Å	1.39Å	Aromatic
C48	C44	sing	0.00Å	1.43Å	Aromatic
C48	C47	doub	0.00Å	1.40Å	Aromatic
C44	C43	doub	0.00Å	1.39Å	Aromatic
C49	C47	sing	0.00Å	1.41Å	Aromatic
C47	C46	sing	0.00Å	1.44Å	Aromatic
C41	C42	doub	0.00Å	1.39Å	Aromatic
N2	C17	sing	0.00Å	1.32Å	Aromatic
N2	C15	doub	0.00Å	1.33Å	Aromatic
N3	C22	sing	0.00Å	1.35Å	Aromatic
N3	C21	doub	0.00Å	1.34Å	Aromatic
C17	C16	doub	0.00Å	1.42Å	Aromatic
C22	C18	doub	0.00Å	1.39Å	Aromatic
C43	C42	sing	0.00Å	1.40Å	Aromatic
C43	C45	sing	0.00Å	1.43Å	Aromatic
C46	C45	doub	0.00Å	1.36Å	Aromatic
C21	C20	sing	0.00Å	1.39Å	Aromatic
C12	C15	sing	0.00Å	1.43Å	Aromatic
C12	C11	doub	0.00Å	1.37Å	Aromatic
C15	C14	sing	0.00Å	1.45Å	Aromatic
C18	C16	sing	0.00Å	1.47Å	Aromatic
C18	C19	sing	0.00Å	1.40Å	Aromatic
C16	N1	sing	0.00Å	1.32Å	Aromatic
C11	C10	sing	0.00Å	1.43Å	Aromatic
C20	C19	doub	0.00Å	1.39Å	Aromatic
C14	N1	doub	0.00Å	1.34Å	Aromatic
C14	C13	sing	0.00Å	1.45Å	Aromatic
C10	C13	doub	0.00Å	1.40Å	Aromatic
C10	C9	sing	0.00Å	1.50Å
C13	C52	sing	0.00Å	1.49Å
O60	C9	doub	0.00Å	1.23Å
C9	C54	sing	0.00Å	1.47Å
C52	O59	doub	0.00Å	1.23Å
C52	C53	sing	0.00Å	1.49Å
C54	C53	doub	0.00Å	1.44Å	Aromatic
C54	C58	sing	0.00Å	1.40Å	Aromatic
C53	C55	sing	0.00Å	1.39Å	Aromatic
C58	C57	doub	0.00Å	1.39Å	Aromatic
C55	C56	doub	0.00Å	1.39Å	Aromatic
C57	C56	sing	0.00Å	1.39Å	Aromatic
C11	H62	sing	0.00Å	1.08Å
C12	H63	sing	0.00Å	1.08Å
C19	H64	sing	0.00Å	1.08Å
C20	H65	sing	0.00Å	1.08Å
C21	H66	sing	0.00Å	1.08Å
C25	H67	sing	0.00Å	1.08Å
C26	H68	sing	0.00Å	1.08Å
C27	H69	sing	0.00Å	1.08Å
C28	H70	sing	0.00Å	1.08Å
C29	H71	sing	0.00Å	1.08Å
C30	H72	sing	0.00Å	1.08Å
C33	H73	sing	0.00Å	1.08Å
C34	H74	sing	0.00Å	1.08Å
C36	H75	sing	0.00Å	1.08Å
C37	H76	sing	0.00Å	1.08Å
C38	H77	sing	0.00Å	1.08Å
C40	H78	sing	0.00Å	1.08Å
C41	H79	sing	0.00Å	1.08Å
C42	H80	sing	0.00Å	1.08Å
C45	H81	sing	0.00Å	1.08Å
C46	H82	sing	0.00Å	1.08Å
C49	H83	sing	0.00Å	1.08Å
C50	H84	sing	0.00Å	1.08Å
C51	H85	sing	0.00Å	1.08Å
C55	H86	sing	0.00Å	1.08Å
C56	H87	sing	0.00Å	1.08Å
C57	H88	sing	0.00Å	1.08Å
C58	H89	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C34	C33	C32	122.2°	90.0°
C33	C34	C35	120.2°	90.0°
C34	C33	H73	118.9°	90.0°
C33	C34	H74	119.9°	90.0°
C33	C32	C30	123.8°	90.0°
C33	C32	C31	118.7°	90.0°
C32	C33	H73	118.9°	90.0°
C32	C30	C29	119.2°	90.0°
C30	C32	C31	117.5°	90.0°
C32	C30	H72	120.4°	90.0°
C30	C29	C28	119.8°	90.0°
C30	C29	H71	120.1°	90.0°
C29	C30	H72	120.4°	90.0°
C34	C35	C36	124.1°	90.0°
C34	C35	C39	118.4°	90.0°
C35	C34	H74	119.9°	90.0°
C32	C31	C39	118.8°	90.0°
C32	C31	N5	123.0°	90.0°
C29	C28	N5	121.8°	90.0°
C29	C28	H70	119.1°	90.0°
C28	C29	H71	120.1°	90.0°
C36	C35	C39	117.5°	90.0°
C35	C36	C37	119.4°	90.0°
C35	C36	H75	120.3°	90.0°
C35	C39	C31	121.8°	90.0°
C35	C39	N6	120.7°	90.0°
C39	C31	N5	118.2°	90.0°
C31	C39	N6	117.5°	90.0°
C31	N5	C28	118.6°	90.0°
C31	N5	RU1	111.9°	90.0°
C36	C37	C38	119.5°	90.0°
C37	C36	H75	120.3°	90.0°
C36	C37	H76	120.2°	90.0°
C28	N5	RU1	129.4°	90.0°
N5	C28	H70	119.1°	90.0°
C39	N6	C38	121.8°	90.0°
C39	N6	RU1	112.9°	90.0°
N5	RU1	N6	79.4°	90.0°
N5	RU1	N4	92.9°	90.0°
N5	RU1	N8	93.1°	90.0°
N5	RU1	N7	94.9°	90.0°
N5	RU1	N3	169.3°	90.0°
C25	C26	C27	119.4°	90.0°
C26	C25	N4	121.5°	90.0°
C26	C25	H67	119.2°	90.0°
C25	C26	H68	120.3°	90.0°
C26	C27	C24	119.0°	90.0°
C27	C26	H68	120.3°	90.0°
C26	C27	H69	120.5°	90.0°
C25	N4	RU1	126.7°	90.0°
C25	N4	C23	119.7°	90.0°
N4	C25	H67	119.3°	90.0°
C37	C38	N6	121.0°	90.0°
C38	C37	H76	120.2°	90.0°
C37	C38	H77	119.5°	90.0°
C38	N6	RU1	125.2°	90.0°
N6	C38	H77	119.5°	90.0°
N6	RU1	N4	91.1°	90.0°
N6	RU1	N8	94.1°	90.0°
N6	RU1	N7	171.5°	90.0°
N6	RU1	N3	93.7°	90.0°
C27	C24	C23	118.4°	90.0°
C27	C24	C17	122.3°	90.0°
C24	C27	H69	120.5°	90.0°
RU1	N4	C23	113.6°	90.0°
N4	RU1	N8	172.7°	90.0°
N4	RU1	N7	95.5°	90.0°
N4	RU1	N3	78.9°	90.0°
N4	C23	C24	122.0°	90.0°
N4	C23	C22	117.2°	90.0°
N8	RU1	N7	79.7°	90.0°
N8	RU1	N3	95.6°	90.0°
RU1	N8	C51	127.1°	90.0°
RU1	N8	C48	112.6°	90.0°
N7	RU1	N3	92.7°	90.0°
RU1	N7	C40	127.8°	90.0°
RU1	N7	C44	112.1°	90.0°
RU1	N3	C22	113.3°	90.0°
RU1	N3	C21	127.6°	90.0°
N8	C51	C50	122.2°	90.0°
C51	N8	C48	120.3°	90.0°
N8	C51	H85	118.9°	90.0°
C51	C50	C49	118.4°	90.0°
C51	C50	H84	120.8°	90.0°
C50	C51	H85	118.9°	90.0°
N8	C48	C44	117.9°	90.0°
N8	C48	C47	121.2°	90.0°
C23	C24	C17	119.3°	90.0°
C24	C23	C22	120.8°	90.0°
C24	C17	N2	118.9°	90.0°
C24	C17	C16	120.4°	90.0°
C23	C22	N3	116.9°	90.0°
C23	C22	C18	121.0°	90.0°
C50	C49	C47	119.8°	90.0°
C50	C49	H83	120.1°	90.0°
C49	C50	H84	120.8°	90.0°
C40	N7	C44	120.1°	90.0°
N7	C40	C41	121.1°	90.0°
N7	C40	H78	119.4°	90.0°
N7	C44	C48	117.7°	90.0°
N7	C44	C43	122.5°	90.0°
C40	C41	C42	119.4°	90.0°
C41	C40	H78	119.4°	90.0°
C40	C41	H79	120.3°	90.0°
C44	C48	C47	121.0°	90.0°
C48	C44	C43	119.9°	90.0°
C48	C47	C49	118.0°	90.0°
C48	C47	C46	117.9°	90.0°
C44	C43	C42	117.1°	90.0°
C44	C43	C45	118.9°	90.0°
C49	C47	C46	124.1°	90.0°
C47	C49	H83	120.1°	90.0°
C47	C46	C45	121.0°	90.0°
C47	C46	H82	119.5°	90.0°
C41	C42	C43	119.8°	90.0°
C42	C41	H79	120.3°	90.0°
C41	C42	H80	120.1°	90.0°
C17	N2	C15	115.8°	90.0°
N2	C17	C16	120.7°	90.0°
N2	C15	C12	116.6°	90.0°
N2	C15	C14	124.3°	90.0°
C22	N3	C21	119.0°	90.0°
N3	C22	C18	122.1°	90.0°
N3	C21	C20	122.3°	90.0°
N3	C21	H66	118.8°	90.0°
C17	C16	C18	118.8°	90.0°
C17	C16	N1	123.9°	90.0°
C22	C18	C16	119.7°	90.0°
C22	C18	C19	119.3°	90.0°
C42	C43	C45	124.0°	90.0°
C43	C42	H80	120.1°	90.0°
C43	C45	C46	121.4°	90.0°
C43	C45	H81	119.3°	90.0°
C46	C45	H81	119.3°	90.0°
C45	C46	H82	119.5°	90.0°
C21	C20	C19	119.3°	90.0°
C21	C20	H65	120.3°	90.0°
C20	C21	H66	118.9°	90.0°
C15	C12	C11	120.5°	90.0°
C12	C15	C14	119.1°	90.0°
C15	C12	H63	119.8°	90.0°
C12	C11	C10	121.0°	90.0°
C12	C11	H62	119.5°	90.0°
C11	C12	H63	119.7°	90.0°
C15	C14	N1	118.3°	90.0°
C15	C14	C13	119.6°	90.0°
C16	C18	C19	121.0°	90.0°
C18	C16	N1	117.3°	90.0°
C18	C19	C20	117.9°	90.0°
C18	C19	H64	121.0°	90.0°
C16	N1	C14	117.0°	90.0°
C11	C10	C13	121.3°	90.0°
C11	C10	C9	115.5°	90.0°
C10	C11	H62	119.5°	90.0°
C20	C19	H64	121.1°	90.0°
C19	C20	H65	120.3°	90.0°
N1	C14	C13	122.1°	90.0°
C14	C13	C10	118.5°	90.0°
C14	C13	C52	120.7°	90.0°
C13	C10	C9	123.1°	90.0°
C10	C13	C52	120.6°	90.0°
C10	C9	O60	122.3°	90.0°
C10	C9	C54	115.4°	90.0°
C13	C52	O59	121.1°	90.0°
C13	C52	C53	115.7°	90.0°
O60	C9	C54	121.3°	90.0°
C9	C54	C53	120.6°	90.0°
C9	C54	C58	120.8°	90.0°
O59	C52	C53	122.3°	90.0°
C52	C53	C54	122.4°	90.0°
C52	C53	C55	117.8°	90.0°
C53	C54	C58	118.6°	90.0°
C54	C53	C55	119.8°	90.0°
C54	C58	C57	120.2°	90.0°
C54	C58	H89	119.9°	90.0°
C53	C55	C56	120.4°	90.0°
C53	C55	H86	119.8°	90.0°
C58	C57	C56	121.0°	90.0°
C58	C57	H88	119.5°	90.0°
C57	C58	H89	119.9°	90.0°
C55	C56	C57	120.1°	90.0°
C56	C55	H86	119.8°	90.0°
C55	C56	H87	120.0°	90.0°
C57	C56	H87	119.9°	90.0°
C56	C57	H88	119.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C34	C33	C32	H73	180.0°	90.0°
C34	C33	C32	C30	179.9°	90.0°
C33	C34	C35	H74	180.0°	90.0°
C34	C33	C32	C31	1.7°	90.0°
C33	C34	C35	C36	179.9°	90.0°
C33	C34	C35	C39	1.7°	90.0°
C33	C32	C30	C31	178.5°	90.0°
C33	C32	C30	C29	179.4°	90.0°
C32	C33	C34	C35	2.0°	90.0°
C33	C32	C31	C39	1.2°	90.0°
C33	C32	C31	N5	179.8°	90.0°
C33	C32	C30	H72	0.6°	90.0°
C32	C33	C34	H74	178.1°	90.0°
C32	C30	C29	H72	180.0°	90.0°
C32	C30	C29	C28	0.4°	90.0°
C30	C32	C31	C39	179.7°	90.0°
C30	C32	C31	N5	1.6°	90.0°
C32	C30	C29	H71	179.6°	90.0°
C30	C32	C33	H73	0.1°	90.0°
C29	C30	C32	C31	0.9°	90.0°
C30	C29	C28	H71	180.0°	90.0°
C30	C29	C28	N5	0.5°	90.0°
C30	C29	C28	H70	179.5°	90.0°
C34	C35	C36	C39	178.4°	90.0°
C34	C35	C39	C31	1.3°	90.0°
C34	C35	C36	C37	179.7°	90.0°
C34	C35	C39	N6	179.9°	90.0°
C35	C34	C33	H73	178.0°	90.0°
C34	C35	C36	H75	0.3°	90.0°
C32	C31	C39	C35	1.0°	90.0°
C32	C31	C39	N5	178.7°	90.0°
C32	C31	N5	C28	1.7°	90.0°
C32	C31	C39	N6	179.7°	90.0°
C32	C31	N5	RU1	179.9°	90.0°
C31	C32	C30	H72	179.0°	90.0°
C31	C32	C33	H73	178.3°	90.0°
C29	C28	N5	C31	1.1°	90.0°
C29	C28	N5	H70	180.0°	90.0°
C29	C28	N5	RU1	179.2°	90.0°
C28	C29	C30	H72	179.6°	90.0°
C36	C35	C39	C31	179.8°	90.0°
C35	C36	C37	H75	180.0°	90.0°
C36	C35	C39	N6	1.6°	90.0°
C35	C36	C37	C38	1.2°	90.0°
C36	C35	C34	H74	0.1°	90.0°
C35	C36	C37	H76	178.8°	90.0°
C35	C39	C31	N6	178.6°	90.0°
C35	C39	C31	N5	179.8°	90.0°
C39	C35	C36	C37	1.3°	90.0°
C35	C39	N6	C38	1.9°	90.0°
C35	C39	N6	RU1	179.8°	90.0°
C39	C35	C34	H74	178.3°	90.0°
C39	C35	C36	H75	178.7°	90.0°
C39	C31	N5	C28	179.6°	90.0°
C39	C31	N5	RU1	1.2°	90.0°
C31	C39	N6	C38	179.5°	90.0°
C31	C39	N6	RU1	1.1°	90.0°
C31	N5	C28	RU1	178.1°	90.0°
N5	C31	C39	N6	1.6°	90.0°
C31	N5	RU1	N6	0.5°	90.0°
C31	N5	RU1	N4	90.2°	90.0°
C31	N5	RU1	N8	94.1°	90.0°
C31	N5	RU1	N7	174.0°	90.0°
C31	N5	RU1	N3	50.6°	90.0°
C31	N5	C28	H70	178.9°	90.0°
C36	C37	C38	H76	180.0°	90.0°
C36	C37	C38	N6	1.4°	90.0°
C36	C37	C38	H77	178.6°	90.0°
C28	N5	RU1	N6	178.6°	90.0°
C28	N5	RU1	N4	88.0°	90.0°
C28	N5	RU1	N8	87.8°	90.0°
C28	N5	RU1	N7	7.8°	90.0°
C28	N5	RU1	N3	127.6°	90.0°
N5	C28	C29	H71	179.5°	90.0°
C39	N6	RU1	N5	0.3°	90.0°
C39	N6	C38	C37	1.7°	90.0°
C39	N6	C38	RU1	178.1°	90.0°
C39	N6	RU1	N4	93.1°	90.0°
C39	N6	RU1	N8	92.1°	90.0°
C39	N6	RU1	N7	48.5°	90.0°
C39	N6	RU1	N3	172.0°	90.0°
C39	N6	C38	H77	178.3°	90.0°
N5	RU1	N4	C25	7.6°	90.0°
N5	RU1	N6	C38	178.6°	90.0°
N5	RU1	N6	N4	92.7°	90.0°
N5	RU1	N6	N8	92.4°	90.0°
N5	RU1	N6	N7	48.9°	90.0°
N5	RU1	N6	N3	171.7°	90.0°
N5	RU1	N4	N8	145.0°	90.0°
N5	RU1	N4	N7	95.2°	90.0°
N5	RU1	N4	N3	173.1°	90.0°
N5	RU1	N4	C23	171.9°	90.0°
N5	RU1	N8	N7	94.4°	90.0°
N5	RU1	N8	N3	173.8°	90.0°
N5	RU1	N7	N3	172.5°	90.0°
N5	RU1	N8	C51	86.2°	90.0°
N5	RU1	N8	C48	96.0°	90.0°
N5	RU1	N7	C40	86.8°	90.0°
N5	RU1	N7	C44	93.7°	90.0°
N5	RU1	N3	C22	38.7°	90.0°
N5	RU1	N3	C21	139.0°	90.0°
RU1	N5	C28	H70	0.8°	90.0°
C25	C26	C27	H68	180.0°	90.0°
C26	C25	N4	H67	180.0°	90.0°
C25	C26	C27	C24	0.3°	90.0°
C26	C25	N4	RU1	178.6°	90.0°
C26	C25	N4	C23	0.8°	90.0°
C25	C26	C27	H69	179.7°	90.0°
C27	C26	C25	N4	0.7°	90.0°
C26	C27	C24	H69	180.0°	90.0°
C26	C27	C24	C23	0.0°	90.0°
C26	C27	C24	C17	179.9°	90.0°
C27	C26	C25	H67	179.2°	90.0°
C25	N4	RU1	N6	87.1°	90.0°
C25	N4	RU1	C23	179.5°	90.0°
C25	N4	RU1	N8	137.4°	90.0°
C25	N4	RU1	N7	87.6°	90.0°
C25	N4	RU1	N3	179.3°	90.0°
C25	N4	C23	C24	0.5°	90.0°
C25	N4	C23	C22	179.9°	90.0°
N4	C25	C26	H68	179.2°	90.0°
C37	C38	N6	H77	180.0°	90.0°
C37	C38	N6	RU1	179.9°	90.0°
C38	C37	C36	H75	178.8°	90.0°
C38	N6	RU1	N4	88.7°	90.0°
C38	N6	RU1	N8	86.2°	90.0°
C38	N6	RU1	N7	129.7°	90.0°
C38	N6	RU1	N3	9.7°	90.0°
N6	C38	C37	H76	178.6°	90.0°
N6	RU1	N4	N8	135.5°	90.0°
N6	RU1	N4	N7	174.7°	90.0°
N6	RU1	N4	N3	93.6°	90.0°
N6	RU1	N4	C23	92.4°	90.0°
N6	RU1	N8	N7	174.0°	90.0°
N6	RU1	N8	N3	94.2°	90.0°
N6	RU1	N7	N3	139.5°	90.0°
N6	RU1	N8	C51	6.6°	90.0°
N6	RU1	N8	C48	175.6°	90.0°
N6	RU1	N7	C40	134.8°	90.0°
N6	RU1	N7	C44	45.7°	90.0°
N6	RU1	N3	C22	88.7°	90.0°
N6	RU1	N3	C21	89.0°	90.0°
RU1	N6	C38	H77	0.1°	90.0°
C27	C24	C23	N4	0.1°	90.0°
C27	C24	C23	C17	179.8°	90.0°
C27	C24	C23	C22	179.7°	90.0°
C27	C24	C17	N2	0.6°	90.0°
C27	C24	C17	C16	179.8°	90.0°
C24	C27	C26	H68	179.6°	90.0°
N4	RU1	N8	N7	50.6°	90.0°
N4	RU1	N8	N3	41.2°	90.0°
N4	RU1	N7	N3	79.1°	90.0°
N4	RU1	N8	C51	128.8°	90.0°
N4	RU1	N8	C48	49.0°	90.0°
RU1	N4	C23	C24	179.0°	90.0°
RU1	N4	C23	C22	0.5°	90.0°
N4	RU1	N7	C40	6.6°	90.0°
N4	RU1	N7	C44	173.0°	90.0°
N4	RU1	N3	C22	1.7°	90.0°
N4	RU1	N3	C21	179.4°	90.0°
RU1	N4	C25	H67	1.4°	90.0°
C23	N4	RU1	N8	43.1°	90.0°
C23	N4	RU1	N7	92.9°	90.0°
C23	N4	RU1	N3	1.2°	90.0°
N4	C23	C24	C22	179.5°	90.0°
N4	C23	C24	C17	180.0°	90.0°
N4	C23	C22	N3	1.0°	90.0°
N4	C23	C22	C18	179.9°	90.0°
C23	N4	C25	H67	179.2°	90.0°
N8	RU1	N7	N3	95.2°	90.0°
RU1	N8	C51	C48	177.7°	90.0°
RU1	N8	C51	C50	178.5°	90.0°
N8	RU1	N7	C40	179.1°	90.0°
N8	RU1	N7	C44	1.4°	90.0°
RU1	N8	C48	C44	1.5°	90.0°
RU1	N8	C48	C47	179.1°	90.0°
N8	RU1	N3	C22	176.8°	90.0°
N8	RU1	N3	C21	5.5°	90.0°
RU1	N8	C51	H85	1.5°	90.0°
N7	RU1	N8	C51	179.4°	90.0°
N7	RU1	N8	C48	1.5°	90.0°
RU1	N7	C40	C44	179.5°	90.0°
RU1	N7	C40	C41	179.1°	90.0°
RU1	N7	C44	C48	1.0°	90.0°
RU1	N7	C44	C43	179.8°	90.0°
N7	RU1	N3	C22	96.8°	90.0°
N7	RU1	N3	C21	85.5°	90.0°
RU1	N7	C40	H78	0.9°	90.0°
N3	RU1	N8	C51	87.6°	90.0°
N3	RU1	N8	C48	90.2°	90.0°
RU1	N3	C22	C23	2.0°	90.0°
N3	RU1	N7	C40	85.7°	90.0°
N3	RU1	N7	C44	93.8°	90.0°
RU1	N3	C22	C21	177.9°	90.0°
RU1	N3	C22	C18	179.1°	90.0°
RU1	N3	C21	C20	177.9°	90.0°
RU1	N3	C21	H66	2.1°	90.0°
N8	C51	C50	H85	180.0°	90.0°
N8	C51	C50	C49	0.1°	90.0°
C51	N8	C48	C44	179.5°	90.0°
C51	N8	C48	C47	1.1°	90.0°
N8	C51	C50	H84	179.9°	90.0°
C50	C51	N8	C48	0.8°	90.0°
C51	C50	C49	H84	180.0°	90.0°
C51	C50	C49	C47	0.7°	90.0°
C51	C50	C49	H83	179.3°	90.0°
N8	C48	C44	N7	0.4°	90.0°
N8	C48	C44	C47	179.4°	90.0°
N8	C48	C44	C43	178.5°	90.0°
N8	C48	C47	C49	0.5°	90.0°
N8	C48	C47	C46	178.7°	90.0°
C48	N8	C51	H85	179.2°	90.0°
C23	C24	C17	N2	179.6°	90.0°
C24	C23	C22	N3	179.4°	90.0°
C23	C24	C17	C16	0.0°	90.0°
C24	C23	C22	C18	0.5°	90.0°
C23	C24	C27	H69	180.0°	90.0°
C17	C24	C23	C22	0.5°	90.0°
C24	C17	N2	C16	179.6°	90.0°
C24	C17	N2	C15	179.6°	90.0°
C24	C17	C16	C18	0.6°	90.0°
C24	C17	C16	N1	178.6°	90.0°
C17	C24	C27	H69	0.1°	90.0°
C23	C22	N3	C18	178.9°	90.0°
C23	C22	N3	C21	179.9°	90.0°
C23	C22	C18	C16	0.0°	90.0°
C23	C22	C18	C19	179.4°	90.0°
C50	C49	C47	C48	0.5°	90.0°
C50	C49	C47	H83	180.0°	90.0°
C50	C49	C47	C46	179.5°	90.0°
C49	C50	C51	H85	179.8°	90.0°
N7	C40	C41	H78	180.0°	90.0°
C40	N7	C44	C48	179.4°	90.0°
C40	N7	C44	C43	0.6°	90.0°
N7	C40	C41	C42	0.8°	90.0°
N7	C40	C41	H79	179.2°	90.0°
C44	N7	C40	C41	0.4°	90.0°
N7	C44	C48	C43	178.9°	90.0°
N7	C44	C48	C47	179.7°	90.0°
N7	C44	C43	C42	1.1°	90.0°
N7	C44	C43	C45	179.1°	90.0°
C44	N7	C40	H78	179.6°	90.0°
C40	C41	C42	H79	180.0°	90.0°
C40	C41	C42	C43	0.2°	90.0°
C40	C41	C42	H80	179.8°	90.0°
C44	C48	C47	C49	179.8°	90.0°
C44	C48	C47	C46	0.7°	90.0°
C48	C44	C43	C42	180.0°	90.0°
C48	C44	C43	C45	0.3°	90.0°
C47	C48	C44	C43	0.9°	90.0°
C48	C47	C49	C46	179.1°	90.0°
C48	C47	C46	C45	0.0°	90.0°
C48	C47	C46	H82	180.0°	90.0°
C48	C47	C49	H83	179.5°	90.0°
C44	C43	C42	C41	0.7°	90.0°
C44	C43	C42	C45	179.7°	90.0°
C44	C43	C45	C46	0.4°	90.0°
C44	C43	C42	H80	179.3°	90.0°
C44	C43	C45	H81	179.6°	90.0°
C49	C47	C46	C45	179.0°	90.0°
C49	C47	C46	H82	1.0°	90.0°
C47	C49	C50	H84	179.2°	90.0°
C47	C46	C45	C43	0.6°	90.0°
C47	C46	C45	H82	180.0°	90.0°
C47	C46	C45	H81	179.4°	90.0°
C46	C47	C49	H83	0.5°	90.0°
C41	C42	C43	H80	180.0°	90.0°
C41	C42	C43	C45	179.5°	90.0°
C42	C41	C40	H78	179.2°	90.0°
C17	N2	C15	C12	179.4°	90.0°
C17	N2	C15	C14	0.6°	90.0°
N2	C17	C16	C18	179.0°	90.0°
N2	C17	C16	N1	1.0°	90.0°
C15	N2	C17	C16	0.0°	90.0°
N2	C15	C12	C14	180.0°	90.0°
N2	C15	C12	C11	179.6°	90.0°
N2	C15	C14	N1	0.3°	90.0°
N2	C15	C14	C13	179.3°	90.0°
N2	C15	C12	H63	0.4°	90.0°
C22	N3	C21	C20	0.4°	90.0°
N3	C22	C18	C16	178.9°	90.0°
N3	C22	C18	C19	1.7°	90.0°
C22	N3	C21	H66	179.6°	90.0°
C21	N3	C22	C18	1.2°	90.0°
N3	C21	C20	H66	180.0°	90.0°
N3	C21	C20	C19	0.1°	90.0°
N3	C21	C20	H65	179.9°	90.0°
C17	C16	C18	C22	0.6°	90.0°
C17	C16	C18	N1	178.1°	90.0°
C17	C16	C18	C19	178.9°	90.0°
C17	C16	N1	C14	1.3°	90.0°
C22	C18	C16	C19	179.4°	90.0°
C22	C18	C16	N1	178.7°	90.0°
C22	C18	C19	C20	1.4°	90.0°
C22	C18	C19	H64	178.6°	90.0°
C42	C43	C45	C46	179.3°	90.0°
C43	C42	C41	H79	179.8°	90.0°
C42	C43	C45	H81	0.7°	90.0°
C43	C45	C46	H81	180.0°	90.0°
C45	C43	C42	H80	0.5°	90.0°
C43	C45	C46	H82	179.4°	90.0°
C21	C20	C19	C18	0.6°	90.0°
C21	C20	C19	H65	180.0°	90.0°
C21	C20	C19	H64	179.4°	90.0°
C15	C12	C11	H63	180.0°	90.0°
C15	C12	C11	C10	0.8°	90.0°
C12	C15	C14	N1	179.7°	90.0°
C12	C15	C14	C13	0.7°	90.0°
C15	C12	C11	H62	179.2°	90.0°
C11	C12	C15	C14	0.4°	90.0°
C12	C11	C10	H62	180.0°	90.0°
C12	C11	C10	C13	0.1°	90.0°
C12	C11	C10	C9	176.2°	90.0°
C15	C14	N1	C16	0.6°	90.0°
C15	C14	N1	C13	178.9°	90.0°
C15	C14	C13	C10	1.5°	90.0°
C15	C14	C13	C52	178.0°	90.0°
C14	C15	C12	H63	179.6°	90.0°
C16	C18	C19	C20	179.2°	90.0°
C18	C16	N1	C14	179.3°	90.0°
C16	C18	C19	H64	0.8°	90.0°
C19	C18	C16	N1	0.7°	90.0°
C18	C19	C20	H64	180.0°	90.0°
C18	C19	C20	H65	179.4°	90.0°
C16	N1	C14	C13	178.3°	90.0°
C11	C10	C13	C14	1.1°	90.0°
C11	C10	C13	C9	175.9°	90.0°
C11	C10	C13	C52	177.6°	90.0°
C11	C10	C9	O60	0.4°	90.0°
C11	C10	C9	C54	168.2°	90.0°
C10	C11	C12	H63	179.2°	90.0°
C19	C20	C21	H66	179.9°	90.0°
N1	C14	C13	C10	179.6°	90.0°
N1	C14	C13	C52	3.2°	90.0°
C14	C13	C10	C52	176.5°	90.0°
C14	C13	C10	C9	177.0°	90.0°
C14	C13	C52	O59	0.3°	90.0°
C14	C13	C52	C53	169.9°	90.0°
C13	C10	C9	O60	175.8°	90.0°
C13	C10	C9	C54	15.7°	90.0°
C10	C13	C52	O59	176.1°	90.0°
C10	C13	C52	C53	6.5°	90.0°
C13	C10	C11	H62	179.9°	90.0°
C9	C10	C13	C52	6.5°	90.0°
C10	C9	O60	C54	167.9°	90.0°
C10	C9	C54	C53	11.7°	90.0°
C10	C9	C54	C58	168.7°	90.0°
C9	C10	C11	H62	3.8°	90.0°
C13	C52	O59	C53	169.0°	90.0°
C13	C52	C53	C54	10.2°	90.0°
C13	C52	C53	C55	168.8°	90.0°
O60	C9	C54	C53	179.6°	90.0°
O60	C9	C54	C58	0.0°	90.0°
C9	C54	C53	C52	0.8°	90.0°
C9	C54	C53	C58	179.6°	90.0°
C9	C54	C53	C55	178.2°	90.0°
C9	C54	C58	C57	178.6°	90.0°
C9	C54	C58	H89	1.4°	90.0°
O59	C52	C53	C54	179.7°	90.0°
O59	C52	C53	C55	0.7°	90.0°
C52	C53	C54	C55	179.0°	90.0°
C52	C53	C54	C58	178.8°	90.0°
C52	C53	C55	C56	179.3°	90.0°
C52	C53	C55	H86	0.7°	90.0°
C53	C54	C58	C57	1.8°	90.0°
C54	C53	C55	C56	1.6°	90.0°
C54	C53	C55	H86	178.4°	90.0°
C53	C54	C58	H89	178.2°	90.0°
C58	C54	C53	C55	2.2°	90.0°
C54	C58	C57	H89	180.0°	90.0°
C54	C58	C57	C56	0.9°	90.0°
C54	C58	C57	H88	179.1°	90.0°
C53	C55	C56	H86	180.0°	90.0°
C53	C55	C56	C57	0.7°	90.0°
C53	C55	C56	H87	179.3°	90.0°
C58	C57	C56	C55	0.3°	90.0°
C58	C57	C56	H88	180.0°	90.0°
C58	C57	C56	H87	179.7°	90.0°
C55	C56	C57	H87	180.0°	90.0°
C55	C56	C57	H88	179.7°	90.0°
C57	C56	C55	H86	179.3°	90.0°
C56	C57	C58	H89	179.1°	90.0°
H62	C11	C12	H63	0.8°	90.0°
H64	C19	C20	H65	0.6°	90.0°
H65	C20	C21	H66	0.1°	90.0°
H67	C25	C26	H68	0.8°	90.0°
H68	C26	C27	H69	0.3°	90.0°
H70	C28	C29	H71	0.5°	90.0°
H71	C29	C30	H72	0.4°	90.0°
H73	C33	C34	H74	1.9°	90.0°
H75	C36	C37	H76	1.2°	90.0°
H76	C37	C38	H77	1.4°	90.0°
H78	C40	C41	H79	0.8°	90.0°
H79	C41	C42	H80	0.2°	90.0°
H81	C45	C46	H82	0.6°	90.0°
H83	C49	C50	H84	0.7°	90.0°
H84	C50	C51	H85	0.2°	90.0°
H86	C55	C56	H87	0.7°	90.0°
H87	C56	C57	H88	0.3°	90.0°
H88	C57	C58	H89	0.9°	90.0°

Release date:	2022-04-06
Definition date:	2021-06-07
Last modified:	2022-04-01
Release status:	REL
Processing site:	PDBE
Derived from:	7OTB