PRD_001188

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	0.00Å	1.50Å
C1	H1	sing	0.00Å	1.08Å
C2	C3	sing	0.00Å	1.46Å
C2	H2	sing	0.00Å	1.10Å
C2	H3	sing	0.00Å	1.10Å
C3	C4	sing	0.00Å	1.49Å
C3	H4	sing	0.00Å	1.10Å
C3	H5	sing	0.00Å	1.10Å
C4	O1	sing	0.00Å	1.29Å
O1	H6	sing	0.00Å	0.95Å
N1	C5	sing	0.00Å	1.46Å
N1	H7	sing	0.00Å	1.00Å
C5	C6	sing	0.00Å	1.53Å
C5	C7	sing	0.00Å	1.53Å
C5	H8	sing	0.00Å	1.10Å
C6	O2	doub	0.00Å	1.23Å
C7	C8	sing	0.00Å	1.52Å
C7	H9	sing	0.00Å	1.10Å
C7	H10	sing	0.00Å	1.10Å
C8	O3	doub	0.00Å	1.24Å
C8	N2	sing	0.00Å	1.33Å
N2	H11	sing	0.00Å	1.00Å
N2	H12	sing	0.00Å	1.00Å
N3	C9	sing	0.00Å	1.47Å
N3	H13	sing	0.00Å	1.00Å
C9	C10	sing	0.00Å	1.54Å
C9	C11	sing	0.00Å	1.55Å
C9	H14	sing	0.00Å	1.10Å
C10	O4	doub	0.00Å	1.22Å
C11	C12	sing	0.00Å	1.52Å
C11	C13	sing	0.00Å	1.51Å
C11	H15	sing	0.00Å	1.10Å
C12	C14	sing	0.00Å	1.54Å
C12	H16	sing	0.00Å	1.10Å
C12	H17	sing	0.00Å	1.10Å
C13	H18	sing	0.00Å	1.10Å
C13	H19	sing	0.00Å	1.10Å
C13	H20	sing	0.00Å	1.10Å
C14	H21	sing	0.00Å	1.10Å
C14	H22	sing	0.00Å	1.10Å
C14	H23	sing	0.00Å	1.10Å
C17	C18	sing	0.00Å	1.49Å
C18	N4	sing	0.00Å	1.46Å
N4	C15	sing	0.00Å	1.45Å
C16	C15	sing	0.00Å	1.52Å
C16	O5	doub	0.00Å	1.24Å
C15	H24	sing	0.00Å	1.10Å
C15	H25	sing	0.00Å	1.10Å
C18	H26	sing	0.00Å	1.10Å
C18	H27	sing	0.00Å	1.10Å
C17	H28	sing	0.00Å	1.08Å
N5	C19	sing	0.00Å	1.46Å
N5	H29	sing	0.00Å	1.00Å
C19	C20	sing	0.00Å	1.52Å
C19	C21	sing	0.00Å	1.53Å
C19	H30	sing	0.00Å	1.10Å
C20	O6	doub	0.00Å	1.22Å
C21	O7	sing	0.00Å	1.41Å
C21	H31	sing	0.00Å	1.10Å
C21	H32	sing	0.00Å	1.10Å
O7	H33	sing	0.00Å	0.95Å
N6	C22	sing	0.00Å	1.48Å
N6	H34	sing	0.00Å	1.00Å
C22	C23	sing	0.00Å	1.54Å
C22	C24	sing	0.00Å	1.54Å
C22	H35	sing	0.00Å	1.10Å
C23	O8	doub	0.00Å	1.26Å
C24	C25	sing	0.00Å	1.54Å
C24	H36	sing	0.00Å	1.10Å
C24	H37	sing	0.00Å	1.10Å
C25	C26	sing	0.00Å	1.54Å
C25	C27	sing	0.00Å	1.54Å
C25	H38	sing	0.00Å	1.10Å
C26	H39	sing	0.00Å	1.10Å
C26	H40	sing	0.00Å	1.10Å
C26	H41	sing	0.00Å	1.10Å
C27	H42	sing	0.00Å	1.10Å
C27	H43	sing	0.00Å	1.10Å
C27	H44	sing	0.00Å	1.10Å
N7	C28	sing	0.00Å	1.47Å
N7	H45	sing	0.00Å	1.00Å
C28	C29	sing	0.00Å	1.51Å
C28	C30	sing	0.00Å	1.53Å
C28	H46	sing	0.00Å	1.10Å
C29	O9	doub	0.00Å	1.23Å
C30	C31	sing	0.00Å	1.52Å
C30	H47	sing	0.00Å	1.10Å
C30	H48	sing	0.00Å	1.10Å
C31	C32	sing	0.00Å	1.51Å
C31	C33	sing	0.00Å	1.52Å
C31	H49	sing	0.00Å	1.10Å
C32	H50	sing	0.00Å	1.10Å
C32	H51	sing	0.00Å	1.10Å
C32	H52	sing	0.00Å	1.10Å
C33	H53	sing	0.00Å	1.10Å
C33	H54	sing	0.00Å	1.10Å
C33	H55	sing	0.00Å	1.10Å
N8	C34	sing	0.00Å	1.45Å
N8	H56	sing	0.00Å	1.00Å
C34	C35	sing	0.00Å	1.53Å
C34	C36	sing	0.00Å	1.54Å
C34	H57	sing	0.00Å	1.10Å
C35	O10	doub	0.00Å	1.24Å
C36	C37	sing	0.00Å	1.52Å
C36	H58	sing	0.00Å	1.10Å
C36	H59	sing	0.00Å	1.10Å
C37	C38	sing	0.00Å	1.49Å
C37	H60	sing	0.00Å	1.10Å
C37	H61	sing	0.00Å	1.10Å
C38	N9	sing	0.00Å	1.46Å
C38	H62	sing	0.00Å	1.10Å
C38	H63	sing	0.00Å	1.10Å
N9	C39	sing	0.00Å	1.33Å
N9	H64	sing	0.00Å	1.00Å
C39	N10	sing	0.00Å	1.33Å
C39	N11	doub	0.00Å	1.34Å
N10	H65	sing	0.00Å	1.00Å
N10	H66	sing	0.00Å	1.00Å
N11	H67	sing	0.00Å	1.00Å
N11	H68	sing	0.00Å	1.00Å
N12	C40	sing	0.00Å	1.47Å
N12	H69	sing	0.00Å	1.00Å
C40	C41	sing	0.00Å	1.53Å
C40	C42	sing	0.00Å	1.56Å
C40	H70	sing	0.00Å	1.10Å
C41	O11	doub	0.00Å	1.24Å
C42	C43	sing	0.00Å	1.52Å
C42	C44	sing	0.00Å	1.53Å
C42	H71	sing	0.00Å	1.10Å
C43	H72	sing	0.00Å	1.10Å
C43	H73	sing	0.00Å	1.10Å
C43	H74	sing	0.00Å	1.10Å
C44	H75	sing	0.00Å	1.10Å
C44	H76	sing	0.00Å	1.10Å
C44	H77	sing	0.00Å	1.10Å
N13	C45	sing	0.00Å	1.45Å
N13	H78	sing	0.00Å	1.00Å
C45	C46	sing	0.00Å	1.52Å
C45	C47	sing	0.00Å	1.54Å
C45	H79	sing	0.00Å	1.10Å
C46	O12	doub	0.00Å	1.23Å
C47	C48	sing	0.00Å	1.53Å
C47	H80	sing	0.00Å	1.10Å
C47	H81	sing	0.00Å	1.10Å
C48	C49	sing	0.00Å	1.52Å
C48	H82	sing	0.00Å	1.10Å
C48	H83	sing	0.00Å	1.10Å
C49	O13	doub	0.00Å	1.24Å
C49	N14	sing	0.00Å	1.35Å
N14	H84	sing	0.00Å	1.00Å
N14	H85	sing	0.00Å	1.00Å
N15	C50	sing	0.00Å	1.46Å
N15	H86	sing	0.00Å	1.00Å
C50	C51	sing	0.00Å	1.53Å
C50	C52	sing	0.00Å	1.51Å
C50	H87	sing	0.00Å	1.10Å
C51	O14	doub	0.00Å	1.25Å
C52	H88	sing	0.00Å	1.10Å
C52	H89	sing	0.00Å	1.10Å
C52	H90	sing	0.00Å	1.10Å
N16	C53	sing	0.00Å	1.47Å
N16	H91	sing	0.00Å	1.00Å
C53	C54	sing	0.00Å	1.50Å
C53	C55	sing	0.00Å	1.53Å
C53	H92	sing	0.00Å	1.10Å
C54	O15	doub	0.00Å	1.22Å
C55	C56	sing	0.00Å	1.49Å
C55	H93	sing	0.00Å	1.10Å
C55	H94	sing	0.00Å	1.10Å
C56	N17	sing	0.00Å	1.37Å	Aromatic
C56	C57	doub	0.00Å	1.35Å	Aromatic
N17	C58	doub	0.00Å	1.32Å	Aromatic
N17	H95	sing	0.00Å	1.00Å
C57	N18	sing	0.00Å	1.38Å	Aromatic
C57	H96	sing	0.00Å	1.08Å
C58	N18	sing	0.00Å	1.32Å	Aromatic
C58	H97	sing	0.00Å	1.08Å
N18	H98	sing	0.00Å	1.00Å
N19	C59	sing	0.00Å	1.46Å
N19	H99	sing	0.00Å	1.00Å
C59	C60	sing	0.00Å	1.53Å
C59	C61	sing	0.00Å	1.56Å
C59	H100	sing	0.00Å	1.10Å
C60	O16	doub	0.00Å	1.23Å
C61	C62	sing	0.00Å	1.52Å
C61	C63	sing	0.00Å	1.52Å
C61	H101	sing	0.00Å	1.10Å
C62	C64	sing	0.00Å	1.51Å
C62	H102	sing	0.00Å	1.10Å
C62	H103	sing	0.00Å	1.10Å
C63	H104	sing	0.00Å	1.10Å
C63	H105	sing	0.00Å	1.10Å
C63	H106	sing	0.00Å	1.10Å
C64	H107	sing	0.00Å	1.10Å
C64	H108	sing	0.00Å	1.10Å
C64	H109	sing	0.00Å	1.10Å
N20	C65	sing	0.00Å	1.46Å
N20	H110	sing	0.00Å	1.00Å
C65	C66	sing	0.00Å	1.51Å
C65	C67	sing	0.00Å	1.54Å
C65	H111	sing	0.00Å	1.10Å
C66	O17	doub	0.00Å	1.23Å
C67	C68	sing	0.00Å	1.54Å
C67	H112	sing	0.00Å	1.10Å
C67	H113	sing	0.00Å	1.10Å
C68	C69	sing	0.00Å	1.53Å
C68	H114	sing	0.00Å	1.10Å
C68	H115	sing	0.00Å	1.10Å
C69	N21	sing	0.00Å	1.46Å
C69	H116	sing	0.00Å	1.10Å
C69	H117	sing	0.00Å	1.10Å
N21	C70	sing	0.00Å	1.33Å
N21	H118	sing	0.00Å	1.00Å
C70	N22	sing	0.00Å	1.32Å
C70	N23	doub	0.00Å	1.33Å
N22	H119	sing	0.00Å	1.00Å
N22	H120	sing	0.00Å	1.00Å
N23	H121	sing	0.00Å	1.00Å
N23	H122	sing	0.00Å	1.00Å
N24	C71	sing	0.00Å	1.46Å
N24	H123	sing	0.00Å	1.00Å
C71	C72	sing	0.00Å	1.52Å
C71	C73	sing	0.00Å	1.53Å
C71	H124	sing	0.00Å	1.10Å
C72	O18	doub	0.00Å	1.22Å
C73	C74	sing	0.00Å	1.53Å
C73	H125	sing	0.00Å	1.10Å
C73	H126	sing	0.00Å	1.10Å
C74	C75	sing	0.00Å	1.55Å
C74	H127	sing	0.00Å	1.10Å
C74	H128	sing	0.00Å	1.10Å
C75	C76	sing	0.00Å	1.54Å
C75	H129	sing	0.00Å	1.10Å
C75	H130	sing	0.00Å	1.10Å
C76	N25	sing	0.00Å	1.50Å
C76	H131	sing	0.00Å	1.10Å
C76	H132	sing	0.00Å	1.10Å
N25	H133	sing	0.00Å	1.00Å
N25	H134	sing	0.00Å	1.00Å
N25	H135	sing	0.00Å	1.00Å
N26	C77	sing	0.00Å	1.47Å
N26	H136	sing	0.00Å	1.00Å
C77	C78	sing	0.00Å	1.54Å
C77	C79	sing	0.00Å	1.54Å
C77	H137	sing	0.00Å	1.10Å
C78	O19	doub	0.00Å	1.23Å
C79	C80	sing	0.00Å	1.52Å
C79	H138	sing	0.00Å	1.10Å
C79	H139	sing	0.00Å	1.10Å
C80	C81	sing	0.00Å	1.53Å
C80	H140	sing	0.00Å	1.10Å
C80	H141	sing	0.00Å	1.10Å
C81	C82	sing	0.00Å	17.40Å
C81	H142	sing	0.00Å	1.10Å
C81	H143	sing	0.00Å	1.10Å
C82	N27	sing	0.00Å	0.00Å
C82	H144	sing	0.00Å	0.00Å
C82	H145	sing	0.00Å	0.00Å
N27	H146	sing	0.00Å	0.00Å
N27	H147	sing	0.00Å	0.00Å
N27	H148	sing	0.00Å	0.00Å
N28	C83	sing	0.00Å	1.47Å
N28	H149	sing	0.00Å	1.00Å
C83	C84	sing	0.00Å	1.50Å
C83	C85	sing	0.00Å	1.53Å
C83	H150	sing	0.00Å	1.10Å
C84	O20	doub	0.00Å	1.23Å
C85	C86	sing	0.00Å	1.51Å
C85	H151	sing	0.00Å	1.10Å
C85	H152	sing	0.00Å	1.10Å
C86	S1	sing	0.00Å	1.82Å
C86	H153	sing	0.00Å	1.10Å
C86	H154	sing	0.00Å	1.10Å
S1	C87	sing	0.00Å	1.79Å
C87	H155	sing	0.00Å	1.10Å
C87	H156	sing	0.00Å	1.10Å
C87	H157	sing	0.00Å	1.10Å
N29	C88	sing	0.00Å	1.45Å
N29	H158	sing	0.00Å	1.00Å
C88	C89	sing	0.00Å	1.51Å
C88	C90	sing	0.00Å	1.52Å
C88	H159	sing	0.00Å	1.10Å
C89	O21	doub	0.00Å	1.23Å
C89	O22	sing	0.00Å	15.18Å
C90	C91	sing	0.00Å	1.50Å
C90	C92	sing	0.00Å	1.51Å
C90	H160	sing	0.00Å	1.10Å
C91	H161	sing	0.00Å	1.10Å
C91	H162	sing	0.00Å	1.10Å
C91	H163	sing	0.00Å	1.10Å
C92	H164	sing	0.00Å	1.10Å
C92	H165	sing	0.00Å	1.10Å
C92	H166	sing	0.00Å	1.10Å
O22	H167	sing	0.00Å	0.00Å
C1	C17	doub	0.00Å	1.33Å
C4	N1	sing	0.00Å	1.39Å
C6	N3	sing	0.00Å	1.33Å
C10	N4	sing	0.00Å	1.33Å
C16	N5	sing	0.00Å	1.33Å
C20	N6	sing	0.00Å	1.33Å
C23	N7	sing	0.00Å	1.33Å
C29	N8	sing	0.00Å	1.33Å
C35	N12	sing	0.00Å	1.33Å
C41	N13	sing	0.00Å	1.32Å
C46	N15	sing	0.00Å	1.33Å
C51	N16	sing	0.00Å	1.32Å
C54	N19	sing	0.00Å	1.33Å
C60	N20	sing	0.00Å	1.33Å
C66	N24	sing	0.00Å	1.32Å
C72	N26	sing	0.00Å	1.33Å
C78	N28	sing	0.00Å	1.34Å
C84	N29	sing	0.00Å	1.32Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	H1	119.5°	90.0°
C1	C2	C3	112.0°	90.0°
C1	C2	H2	108.9°	90.0°
C1	C2	H3	108.8°	90.0°
C2	C1	C17	120.8°	90.0°
H1	C1	C17	119.6°	90.0°
C3	C2	H2	108.8°	90.0°
C3	C2	H3	108.8°	90.0°
C2	C3	C4	108.5°	90.0°
C2	C3	H4	109.7°	90.0°
C2	C3	H5	109.7°	90.0°
H2	C2	H3	109.5°	90.0°
C4	C3	H4	109.7°	90.0°
C4	C3	H5	109.7°	90.0°
C3	C4	O1	119.9°	90.0°
C3	C4	N1	121.5°	90.0°
H4	C3	H5	109.5°	90.0°
C4	O1	H6	109.5°	90.0°
O1	C4	N1	118.5°	90.0°
C5	N1	H7	105.6°	90.0°
N1	C5	C6	114.3°	90.0°
N1	C5	C7	110.5°	90.0°
N1	C5	H8	108.2°	90.0°
C5	N1	C4	124.7°	90.0°
H7	N1	C4	105.5°	90.0°
C6	C5	C7	108.8°	90.0°
C6	C5	H8	107.4°	90.0°
C5	C6	O2	120.3°	90.0°
C5	C6	N3	117.1°	90.0°
C7	C5	H8	107.4°	90.0°
C5	C7	C8	112.7°	90.0°
C5	C7	H9	108.6°	90.0°
C5	C7	H10	108.6°	90.0°
O2	C6	N3	122.5°	90.0°
C8	C7	H9	108.7°	90.0°
C8	C7	H10	108.7°	90.0°
C7	C8	O3	120.8°	90.0°
C7	C8	N2	116.5°	90.0°
H9	C7	H10	109.5°	90.0°
O3	C8	N2	122.7°	90.0°
C8	N2	H11	120.0°	90.0°
C8	N2	H12	120.0°	90.0°
H11	N2	H12	120.0°	90.0°
C9	N3	H13	120.0°	90.0°
N3	C9	C10	111.3°	90.0°
N3	C9	C11	112.0°	90.0°
N3	C9	H14	107.3°	90.0°
C9	N3	C6	120.0°	90.0°
H13	N3	C6	120.0°	90.0°
C10	C9	C11	112.6°	90.0°
C10	C9	H14	106.6°	90.0°
C9	C10	O4	120.6°	90.0°
C9	C10	N4	117.4°	90.0°
C11	C9	H14	106.5°	90.0°
C9	C11	C12	109.3°	90.0°
C9	C11	C13	111.9°	90.0°
C9	C11	H15	109.5°	90.0°
O4	C10	N4	122.0°	90.0°
C12	C11	C13	106.4°	90.0°
C12	C11	H15	109.8°	90.0°
C11	C12	C14	113.8°	90.0°
C11	C12	H16	108.4°	90.0°
C11	C12	H17	108.4°	90.0°
C13	C11	H15	109.9°	90.0°
C11	C13	H18	109.5°	90.0°
C11	C13	H19	109.4°	90.0°
C11	C13	H20	109.5°	90.0°
C14	C12	H16	108.4°	90.0°
C14	C12	H17	108.4°	90.0°
C12	C14	H21	109.5°	90.0°
C12	C14	H22	109.5°	90.0°
C12	C14	H23	109.5°	90.0°
H16	C12	H17	109.5°	90.0°
H18	C13	H19	109.5°	90.0°
H18	C13	H20	109.5°	90.0°
H19	C13	H20	109.5°	90.0°
H21	C14	H22	109.5°	90.0°
H21	C14	H23	109.5°	90.0°
H22	C14	H23	109.5°	90.0°
C17	C18	N4	109.7°	90.0°
C17	C18	H26	109.4°	90.0°
C17	C18	H27	109.4°	90.0°
C18	C17	H28	120.0°	90.0°
C18	C17	C1	120.1°	90.0°
C18	N4	C15	104.0°	90.0°
N4	C18	H26	109.4°	90.0°
N4	C18	H27	109.4°	90.0°
C18	N4	C10	128.1°	90.0°
N4	C15	C16	112.8°	90.0°
N4	C15	H24	108.6°	90.0°
N4	C15	H25	108.7°	90.0°
C15	N4	C10	120.7°	90.0°
C15	C16	O5	121.0°	90.0°
C16	C15	H24	108.6°	90.0°
C16	C15	H25	108.6°	90.0°
C15	C16	N5	116.2°	90.0°
O5	C16	N5	122.8°	90.0°
H24	C15	H25	109.5°	90.0°
H26	C18	H27	109.5°	90.0°
H28	C17	C1	119.9°	90.0°
C19	N5	H29	119.9°	90.0°
N5	C19	C20	110.1°	90.0°
N5	C19	C21	112.2°	90.0°
N5	C19	H30	108.5°	90.0°
C19	N5	C16	120.3°	90.0°
H29	N5	C16	119.9°	90.0°
C20	C19	C21	110.4°	90.0°
C20	C19	H30	107.8°	90.0°
C19	C20	O6	119.6°	90.0°
C19	C20	N6	117.7°	90.0°
C21	C19	H30	107.6°	90.0°
C19	C21	O7	111.6°	90.0°
C19	C21	H31	108.9°	90.0°
C19	C21	H32	108.9°	90.0°
O6	C20	N6	122.7°	90.0°
O7	C21	H31	108.9°	90.0°
O7	C21	H32	108.9°	90.0°
C21	O7	H33	109.5°	90.0°
H31	C21	H32	109.5°	90.0°
C22	N6	H34	119.9°	90.0°
N6	C22	C23	113.0°	90.0°
N6	C22	C24	111.3°	90.0°
N6	C22	H35	107.5°	90.0°
C22	N6	C20	120.3°	90.0°
H34	N6	C20	119.8°	90.0°
C23	C22	C24	111.2°	90.0°
C23	C22	H35	106.7°	90.0°
C22	C23	O8	121.1°	90.0°
C22	C23	N7	116.9°	90.0°
C24	C22	H35	106.7°	90.0°
C22	C24	C25	114.6°	90.0°
C22	C24	H36	108.2°	90.0°
C22	C24	H37	108.2°	90.0°
O8	C23	N7	122.0°	90.0°
C25	C24	H36	108.2°	90.0°
C25	C24	H37	108.1°	90.0°
C24	C25	C26	111.0°	90.0°
C24	C25	C27	111.8°	90.0°
C24	C25	H38	108.1°	90.0°
H36	C24	H37	109.5°	90.0°
C26	C25	C27	109.7°	90.0°
C26	C25	H38	108.1°	90.0°
C25	C26	H39	109.5°	90.0°
C25	C26	H40	109.5°	90.0°
C25	C26	H41	109.4°	90.0°
C27	C25	H38	108.0°	90.0°
C25	C27	H42	109.5°	90.0°
C25	C27	H43	109.5°	90.0°
C25	C27	H44	109.5°	90.0°
H39	C26	H40	109.5°	90.0°
H39	C26	H41	109.4°	90.0°
H40	C26	H41	109.5°	90.0°
H42	C27	H43	109.5°	90.0°
H42	C27	H44	109.4°	90.0°
H43	C27	H44	109.5°	90.0°
C28	N7	H45	120.0°	90.0°
N7	C28	C29	112.4°	90.0°
N7	C28	C30	110.7°	90.0°
N7	C28	H46	108.8°	90.0°
C28	N7	C23	120.0°	90.0°
H45	N7	C23	120.0°	90.0°
C29	C28	C30	108.3°	90.0°
C29	C28	H46	108.3°	90.0°
C28	C29	O9	120.5°	90.0°
C28	C29	N8	117.0°	90.0°
C30	C28	H46	108.1°	90.0°
C28	C30	C31	113.6°	90.0°
C28	C30	H47	108.4°	90.0°
C28	C30	H48	108.4°	90.0°
O9	C29	N8	122.5°	90.0°
C31	C30	H47	108.4°	90.0°
C31	C30	H48	108.4°	90.0°
C30	C31	C32	111.1°	90.0°
C30	C31	C33	110.3°	90.0°
C30	C31	H49	108.3°	90.0°
H47	C30	H48	109.5°	90.0°
C32	C31	C33	110.4°	90.0°
C32	C31	H49	108.5°	90.0°
C31	C32	H50	109.5°	90.0°
C31	C32	H51	109.5°	90.0°
C31	C32	H52	109.5°	90.0°
C33	C31	H49	108.2°	90.0°
C31	C33	H53	109.5°	90.0°
C31	C33	H54	109.5°	90.0°
C31	C33	H55	109.5°	90.0°
H50	C32	H51	109.4°	90.0°
H50	C32	H52	109.5°	90.0°
H51	C32	H52	109.5°	90.0°
H53	C33	H54	109.4°	90.0°
H53	C33	H55	109.5°	90.0°
H54	C33	H55	109.5°	90.0°
C34	N8	H56	120.3°	90.0°
N8	C34	C35	110.0°	90.0°
N8	C34	C36	110.5°	90.0°
N8	C34	H57	108.9°	90.0°
C34	N8	C29	119.4°	90.0°
H56	N8	C29	120.3°	90.0°
C35	C34	C36	111.5°	90.0°
C35	C34	H57	108.0°	90.0°
C34	C35	O10	120.6°	90.0°
C34	C35	N12	116.8°	90.0°
C36	C34	H57	107.8°	90.0°
C34	C36	C37	113.9°	90.0°
C34	C36	H58	108.4°	90.0°
C34	C36	H59	108.4°	90.0°
O10	C35	N12	122.5°	90.0°
C37	C36	H58	108.4°	90.0°
C37	C36	H59	108.4°	90.0°
C36	C37	C38	110.5°	90.0°
C36	C37	H60	109.2°	90.0°
C36	C37	H61	109.2°	90.0°
H58	C36	H59	109.4°	90.0°
C38	C37	H60	109.2°	90.0°
C38	C37	H61	109.2°	90.0°
C37	C38	N9	110.1°	90.0°
C37	C38	H62	109.3°	90.0°
C37	C38	H63	109.3°	90.0°
H60	C37	H61	109.5°	90.0°
N9	C38	H62	109.3°	90.0°
N9	C38	H63	109.3°	90.0°
C38	N9	C39	125.0°	90.0°
C38	N9	H64	117.5°	90.0°
H62	C38	H63	109.4°	90.0°
C39	N9	H64	117.5°	90.0°
N9	C39	N10	119.5°	90.0°
N9	C39	N11	119.6°	90.0°
N10	C39	N11	120.9°	90.0°
C39	N10	H65	120.0°	90.0°
C39	N10	H66	120.0°	90.0°
C39	N11	H67	120.0°	90.0°
C39	N11	H68	120.0°	90.0°
H65	N10	H66	120.0°	90.0°
H67	N11	H68	120.0°	90.0°
C40	N12	H69	119.3°	90.0°
N12	C40	C41	111.3°	90.0°
N12	C40	C42	110.8°	90.0°
N12	C40	H70	108.9°	90.0°
C40	N12	C35	121.4°	90.0°
H69	N12	C35	119.3°	90.0°
C41	C40	C42	109.7°	90.0°
C41	C40	H70	108.2°	90.0°
C40	C41	O11	121.5°	90.0°
C40	C41	N13	116.1°	90.0°
C42	C40	H70	107.8°	90.0°
C40	C42	C43	111.3°	90.0°
C40	C42	C44	110.7°	90.0°
C40	C42	H71	108.0°	90.0°
O11	C41	N13	122.4°	90.0°
C43	C42	C44	109.9°	90.0°
C43	C42	H71	108.5°	90.0°
C42	C43	H72	109.5°	90.0°
C42	C43	H73	109.5°	90.0°
C42	C43	H74	109.5°	90.0°
C44	C42	H71	108.3°	90.0°
C42	C44	H75	109.5°	90.0°
C42	C44	H76	109.5°	90.0°
C42	C44	H77	109.5°	90.0°
H72	C43	H73	109.4°	90.0°
H72	C43	H74	109.4°	90.0°
H73	C43	H74	109.5°	90.0°
H75	C44	H76	109.5°	90.0°
H75	C44	H77	109.5°	90.0°
H76	C44	H77	109.5°	90.0°
C45	N13	H78	119.6°	90.0°
N13	C45	C46	108.5°	90.0°
N13	C45	C47	110.3°	90.0°
N13	C45	H79	109.4°	90.0°
C45	N13	C41	120.8°	90.0°
H78	N13	C41	119.6°	90.0°
C46	C45	C47	111.9°	90.0°
C46	C45	H79	108.5°	90.0°
C45	C46	O12	120.6°	90.0°
C45	C46	N15	116.7°	90.0°
C47	C45	H79	108.3°	90.0°
C45	C47	C48	112.9°	90.0°
C45	C47	H80	108.6°	90.0°
C45	C47	H81	108.6°	90.0°
O12	C46	N15	122.6°	90.0°
C48	C47	H80	108.6°	90.0°
C48	C47	H81	108.6°	90.0°
C47	C48	C49	113.3°	90.0°
C47	C48	H82	108.5°	90.0°
C47	C48	H83	108.5°	90.0°
H80	C47	H81	109.5°	90.0°
C49	C48	H82	108.5°	90.0°
C49	C48	H83	108.5°	90.0°
C48	C49	O13	120.8°	90.0°
C48	C49	N14	116.6°	90.0°
H82	C48	H83	109.5°	90.0°
O13	C49	N14	122.6°	90.0°
C49	N14	H84	120.0°	90.0°
C49	N14	H85	120.0°	90.0°
H84	N14	H85	120.0°	90.0°
C50	N15	H86	119.9°	90.0°
N15	C50	C51	111.5°	90.0°
N15	C50	C52	110.5°	90.0°
N15	C50	H87	108.1°	90.0°
C50	N15	C46	120.2°	90.0°
H86	N15	C46	119.9°	90.0°
C51	C50	C52	111.8°	90.0°
C51	C50	H87	107.3°	90.0°
C50	C51	O14	121.7°	90.0°
C50	C51	N16	116.3°	90.0°
C52	C50	H87	107.4°	90.0°
C50	C52	H88	109.5°	90.0°
C50	C52	H89	109.4°	90.0°
C50	C52	H90	109.5°	90.0°
O14	C51	N16	121.9°	90.0°
H88	C52	H89	109.5°	90.0°
H88	C52	H90	109.4°	90.0°
H89	C52	H90	109.5°	90.0°
C53	N16	H91	120.3°	90.0°
N16	C53	C54	110.4°	90.0°
N16	C53	C55	111.7°	90.0°
N16	C53	H92	107.9°	90.0°
C53	N16	C51	119.4°	90.0°
H91	N16	C51	120.3°	90.0°
C54	C53	C55	112.0°	90.0°
C54	C53	H92	107.5°	90.0°
C53	C54	O15	120.2°	90.0°
C53	C54	N19	117.1°	90.0°
C55	C53	H92	107.1°	90.0°
C53	C55	C56	112.4°	90.0°
C53	C55	H93	108.8°	90.0°
C53	C55	H94	108.8°	90.0°
O15	C54	N19	122.7°	90.0°
C56	C55	H93	108.7°	90.0°
C56	C55	H94	108.7°	90.0°
C55	C56	N17	121.8°	90.0°
C55	C56	C57	131.3°	90.0°
H93	C55	H94	109.4°	90.0°
N17	C56	C57	106.9°	90.0°
C56	N17	C58	109.0°	90.0°
C56	N17	H95	125.5°	90.0°
C56	C57	N18	106.6°	90.0°
C56	C57	H96	126.7°	90.0°
C58	N17	H95	125.5°	90.0°
N17	C58	N18	108.5°	90.0°
N17	C58	H97	125.8°	90.0°
N18	C57	H96	126.7°	90.0°
C57	N18	C58	109.1°	90.0°
C57	N18	H98	125.5°	90.0°
N18	C58	H97	125.8°	90.0°
C58	N18	H98	125.4°	90.0°
C59	N19	H99	120.2°	90.0°
N19	C59	C60	109.8°	90.0°
N19	C59	C61	112.0°	90.0°
N19	C59	H100	108.3°	90.0°
C59	N19	C54	119.6°	90.0°
H99	N19	C54	120.2°	90.0°
C60	C59	C61	112.0°	90.0°
C60	C59	H100	107.4°	90.0°
C59	C60	O16	120.5°	90.0°
C59	C60	N20	117.9°	90.0°
C61	C59	H100	107.2°	90.0°
C59	C61	C62	110.5°	90.0°
C59	C61	C63	111.4°	90.0°
C59	C61	H101	108.4°	90.0°
O16	C60	N20	121.6°	90.0°
C62	C61	C63	108.9°	90.0°
C62	C61	H101	108.8°	90.0°
C61	C62	C64	112.9°	90.0°
C61	C62	H102	108.6°	90.0°
C61	C62	H103	108.6°	90.0°
C63	C61	H101	108.8°	90.0°
C61	C63	H104	109.5°	90.0°
C61	C63	H105	109.5°	90.0°
C61	C63	H106	109.5°	90.0°
C64	C62	H102	108.6°	90.0°
C64	C62	H103	108.6°	90.0°
C62	C64	H107	109.5°	90.0°
C62	C64	H108	109.5°	90.0°
C62	C64	H109	109.5°	90.0°
H102	C62	H103	109.5°	90.0°
H104	C63	H105	109.5°	90.0°
H104	C63	H106	109.5°	90.0°
H105	C63	H106	109.4°	90.0°
H107	C64	H108	109.4°	90.0°
H107	C64	H109	109.5°	90.0°
H108	C64	H109	109.5°	90.0°
C65	N20	H110	120.2°	90.0°
N20	C65	C66	111.7°	90.0°
N20	C65	C67	110.8°	90.0°
N20	C65	H111	108.1°	90.0°
C65	N20	C60	119.4°	90.0°
H110	N20	C60	120.3°	90.0°
C66	C65	C67	111.5°	90.0°
C66	C65	H111	107.4°	90.0°
C65	C66	O17	121.3°	90.0°
C65	C66	N24	115.3°	90.0°
C67	C65	H111	107.1°	90.0°
C65	C67	C68	113.5°	90.0°
C65	C67	H112	108.4°	90.0°
C65	C67	H113	108.4°	90.0°
O17	C66	N24	123.4°	90.0°
C68	C67	H112	108.5°	90.0°
C68	C67	H113	108.5°	90.0°
C67	C68	C69	111.1°	90.0°
C67	C68	H114	109.1°	90.0°
C67	C68	H115	109.1°	90.0°
H112	C67	H113	109.5°	90.0°
C69	C68	H114	109.1°	90.0°
C69	C68	H115	109.0°	90.0°
C68	C69	N21	110.2°	90.0°
C68	C69	H116	109.3°	90.0°
C68	C69	H117	109.3°	90.0°
H114	C68	H115	109.5°	90.0°
N21	C69	H116	109.3°	90.0°
N21	C69	H117	109.3°	90.0°
C69	N21	C70	124.3°	90.0°
C69	N21	H118	117.9°	90.0°
H116	C69	H117	109.5°	90.0°
C70	N21	H118	117.9°	90.0°
N21	C70	N22	119.5°	90.0°
N21	C70	N23	120.3°	90.0°
N22	C70	N23	120.2°	90.0°
C70	N22	H119	120.0°	90.0°
C70	N22	H120	120.0°	90.0°
C70	N23	H121	120.0°	90.0°
C70	N23	H122	120.0°	90.0°
H119	N22	H120	120.0°	90.0°
H121	N23	H122	120.0°	90.0°
C71	N24	H123	119.0°	90.0°
N24	C71	C72	111.8°	90.0°
N24	C71	C73	109.8°	90.0°
N24	C71	H124	109.4°	90.0°
C71	N24	C66	122.0°	90.0°
H123	N24	C66	119.0°	90.0°
C72	C71	C73	108.9°	90.0°
C72	C71	H124	108.5°	90.0°
C71	C72	O18	120.2°	90.0°
C71	C72	N26	117.4°	90.0°
C73	C71	H124	108.4°	90.0°
C71	C73	C74	113.3°	90.0°
C71	C73	H125	108.5°	90.0°
C71	C73	H126	108.5°	90.0°
O18	C72	N26	122.4°	90.0°
C74	C73	H125	108.5°	90.0°
C74	C73	H126	108.5°	90.0°
C73	C74	C75	111.2°	90.0°
C73	C74	H127	109.0°	90.0°
C73	C74	H128	109.0°	90.0°
H125	C73	H126	109.5°	90.0°
C75	C74	H127	109.0°	90.0°
C75	C74	H128	109.0°	90.0°
C74	C75	C76	111.4°	90.0°
C74	C75	H129	109.0°	90.0°
C74	C75	H130	109.0°	90.0°
H127	C74	H128	109.5°	90.0°
C76	C75	H129	109.0°	90.0°
C76	C75	H130	109.0°	90.0°
C75	C76	N25	112.2°	90.0°
C75	C76	H131	108.8°	90.0°
C75	C76	H132	108.8°	90.0°
H129	C75	H130	109.4°	90.0°
N25	C76	H131	108.8°	90.0°
N25	C76	H132	108.8°	90.0°
C76	N25	H133	109.5°	90.0°
C76	N25	H134	109.5°	90.0°
C76	N25	H135	109.5°	90.0°
H131	C76	H132	109.5°	90.0°
H133	N25	H134	109.5°	90.0°
H133	N25	H135	109.4°	90.0°
H134	N25	H135	109.5°	90.0°
C77	N26	H136	119.2°	90.0°
N26	C77	C78	113.9°	90.0°
N26	C77	C79	110.0°	90.0°
N26	C77	H137	108.3°	90.0°
C77	N26	C72	121.6°	90.0°
H136	N26	C72	119.2°	90.0°
C78	C77	C79	109.3°	90.0°
C78	C77	H137	107.5°	90.0°
C77	C78	O19	119.8°	90.0°
C77	C78	N28	117.6°	90.0°
C79	C77	H137	107.5°	90.0°
C77	C79	C80	115.0°	90.0°
C77	C79	H138	108.1°	90.0°
C77	C79	H139	108.1°	90.0°
O19	C78	N28	122.6°	90.0°
C80	C79	H138	108.1°	90.0°
C80	C79	H139	108.1°	90.0°
C79	C80	C81	111.0°	90.0°
C79	C80	H140	109.1°	90.0°
C79	C80	H141	109.1°	90.0°
H138	C79	H139	109.4°	90.0°
C81	C80	H140	109.1°	90.0°
C81	C80	H141	109.1°	90.0°
C80	C81	C82	134.8°	90.0°
C80	C81	H142	102.8°	90.0°
C80	C81	H143	102.8°	90.0°
H140	C80	H141	109.5°	90.0°
C82	C81	H142	102.9°	90.0°
C82	C81	H143	102.8°	90.0°
C81	C82	N27	90.0°	90.0°
C81	C82	H144	90.0°	90.0°
C81	C82	H145	90.0°	90.0°
H142	C81	H143	109.5°	90.0°
N27	C82	H144	90.0°	90.0°
N27	C82	H145	90.0°	90.0°
C82	N27	H146	90.0°	90.0°
C82	N27	H147	90.0°	90.0°
C82	N27	H148	90.0°	90.0°
H144	C82	H145	90.0°	90.0°
H146	N27	H147	90.0°	90.0°
H146	N27	H148	90.0°	90.0°
H147	N27	H148	90.0°	90.0°
C83	N28	H149	119.1°	90.0°
N28	C83	C84	108.9°	90.0°
N28	C83	C85	111.2°	90.0°
N28	C83	H150	110.5°	90.0°
C83	N28	C78	121.8°	90.0°
H149	N28	C78	119.1°	90.0°
C84	C83	C85	106.2°	90.0°
C84	C83	H150	110.1°	90.0°
C83	C84	O20	122.0°	90.0°
C83	C84	N29	114.4°	90.0°
C85	C83	H150	109.7°	90.0°
C83	C85	C86	116.8°	90.0°
C83	C85	H151	107.6°	90.0°
C83	C85	H152	107.6°	90.0°
O20	C84	N29	123.7°	90.0°
C86	C85	H151	107.6°	90.0°
C86	C85	H152	107.6°	90.0°
C85	C86	S1	108.1°	90.0°
C85	C86	H153	109.8°	90.0°
C85	C86	H154	109.8°	90.0°
H151	C85	H152	109.4°	90.0°
S1	C86	H153	109.8°	90.0°
S1	C86	H154	109.8°	90.0°
C86	S1	C87	100.4°	90.0°
H153	C86	H154	109.5°	90.0°
S1	C87	H155	109.5°	90.0°
S1	C87	H156	109.5°	90.0°
S1	C87	H157	109.5°	90.0°
H155	C87	H156	109.5°	90.0°
H155	C87	H157	109.5°	90.0°
H156	C87	H157	109.5°	90.0°
C88	N29	H158	118.8°	90.0°
N29	C88	C89	109.8°	90.0°
N29	C88	C90	110.0°	90.0°
N29	C88	H159	110.5°	90.0°
C88	N29	C84	122.3°	90.0°
H158	N29	C84	118.9°	90.0°
C89	C88	C90	107.1°	90.0°
C89	C88	H159	109.7°	90.0°
C88	C89	O21	120.3°	90.0°
C88	C89	O22	147.9°	90.0°
C90	C88	H159	109.6°	90.0°
C88	C90	C91	110.5°	90.0°
C88	C90	C92	109.6°	90.0°
C88	C90	H160	108.6°	90.0°
O21	C89	O22	53.9°	90.0°
C89	O22	H167	90.0°	90.0°
C91	C90	C92	110.6°	90.0°
C91	C90	H160	108.9°	90.0°
C90	C91	H161	109.5°	90.0°
C90	C91	H162	109.5°	90.0°
C90	C91	H163	109.5°	90.0°
C92	C90	H160	108.6°	90.0°
C90	C92	H164	109.5°	90.0°
C90	C92	H165	109.5°	90.0°
C90	C92	H166	109.5°	90.0°
H161	C91	H162	109.5°	90.0°
H161	C91	H163	109.5°	90.0°
H162	C91	H163	109.5°	90.0°
H164	C92	H165	109.5°	90.0°
H164	C92	H166	109.5°	90.0°
H165	C92	H166	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	H1	C17	180.0°	90.0°
C1	C2	C3	H2	120.4°	90.0°
C1	C2	C3	H3	120.3°	90.0°
C1	C2	H2	H3	118.9°	90.0°
C1	C2	C3	C4	52.5°	90.0°
C1	C2	C3	H4	172.3°	90.0°
C1	C2	C3	H5	67.4°	90.0°
C2	C1	C17	C18	179.8°	90.0°
C2	C1	C17	H28	0.2°	90.0°
H1	C1	C2	C3	61.3°	90.0°
H1	C1	C2	H2	178.3°	90.0°
H1	C1	C2	H3	59.0°	90.0°
H1	C1	C17	C18	0.2°	90.0°
H1	C1	C17	H28	179.8°	90.0°
C3	C2	H2	H3	118.8°	90.0°
C2	C3	C4	H4	119.8°	90.0°
C2	C3	C4	H5	119.9°	90.0°
C2	C3	H4	H5	120.4°	90.0°
C2	C3	C4	O1	69.4°	90.0°
C3	C2	C1	C17	118.7°	90.0°
C2	C3	C4	N1	106.5°	90.0°
H2	C2	C3	C4	67.9°	90.0°
H2	C2	C3	H4	51.9°	90.0°
H2	C2	C3	H5	172.2°	90.0°
H2	C2	C1	C17	1.7°	90.0°
H3	C2	C3	C4	172.8°	90.0°
H3	C2	C3	H4	67.3°	90.0°
H3	C2	C3	H5	53.0°	90.0°
H3	C2	C1	C17	121.0°	90.0°
C4	C3	H4	H5	120.5°	90.0°
C3	C4	O1	N1	176.0°	90.0°
C3	C4	O1	H6	180.0°	90.0°
C3	C4	N1	C5	172.6°	90.0°
C3	C4	N1	H7	50.5°	90.0°
H4	C3	C4	O1	50.4°	90.0°
H4	C3	C4	N1	133.7°	90.0°
H5	C3	C4	O1	170.7°	90.0°
H5	C3	C4	N1	13.4°	90.0°
O1	C4	N1	C5	3.4°	90.0°
O1	C4	N1	H7	125.5°	90.0°
H6	O1	C4	N1	4.0°	90.0°
C5	N1	H7	C4	133.7°	90.0°
N1	C5	C6	C7	124.1°	90.0°
N1	C5	C6	H8	120.0°	90.0°
N1	C5	C7	H8	117.8°	90.0°
N1	C5	C6	O2	139.5°	90.0°
N1	C5	C7	C8	69.9°	90.0°
N1	C5	C7	H9	50.6°	90.0°
N1	C5	C7	H10	169.6°	90.0°
N1	C5	C6	N3	41.4°	90.0°
H7	N1	C5	C6	33.6°	90.0°
H7	N1	C5	C7	89.6°	90.0°
H7	N1	C5	H8	153.1°	90.0°
C6	C5	C7	H8	115.9°	90.0°
C5	C6	O2	N3	179.0°	90.0°
C6	C5	C7	C8	163.9°	90.0°
C6	C5	C7	H9	75.6°	90.0°
C6	C5	C7	H10	43.4°	90.0°
C5	C6	N3	C9	171.1°	90.0°
C5	C6	N3	H13	8.9°	90.0°
C6	C5	N1	C4	88.5°	90.0°
C7	C5	C6	O2	96.4°	90.0°
C5	C7	C8	H9	120.5°	90.0°
C5	C7	C8	H10	120.5°	90.0°
C5	C7	H9	H10	118.5°	90.0°
C5	C7	C8	O3	25.4°	90.0°
C5	C7	C8	N2	153.7°	90.0°
C7	C5	N1	C4	148.4°	90.0°
C7	C5	C6	N3	82.6°	90.0°
H8	C5	C6	O2	19.6°	90.0°
H8	C5	C7	C8	47.9°	90.0°
H8	C5	C7	H9	168.4°	90.0°
H8	C5	C7	H10	72.6°	90.0°
H8	C5	N1	C4	31.0°	90.0°
H8	C5	C6	N3	161.4°	90.0°
O2	C6	N3	C9	7.8°	90.0°
O2	C6	N3	H13	172.1°	90.0°
C8	C7	H9	H10	118.5°	90.0°
C7	C8	O3	N2	179.0°	90.0°
C7	C8	N2	H11	179.0°	90.0°
C7	C8	N2	H12	1.0°	90.0°
H9	C7	C8	O3	145.8°	90.0°
H9	C7	C8	N2	33.2°	90.0°
H10	C7	C8	O3	95.1°	90.0°
H10	C7	C8	N2	85.8°	90.0°
O3	C8	N2	H11	0.0°	90.0°
O3	C8	N2	H12	180.0°	90.0°
C8	N2	H11	H12	180.0°	90.0°
C9	N3	H13	C6	180.0°	90.0°
N3	C9	C10	C11	126.8°	90.0°
N3	C9	C10	H14	116.8°	90.0°
N3	C9	C11	H14	117.1°	90.0°
N3	C9	C10	O4	135.8°	90.0°
N3	C9	C11	C12	76.1°	90.0°
N3	C9	C11	C13	166.3°	90.0°
N3	C9	C11	H15	44.2°	90.0°
N3	C9	C10	N4	42.4°	90.0°
H13	N3	C9	C10	114.3°	90.0°
H13	N3	C9	C11	12.9°	90.0°
H13	N3	C9	H14	129.4°	90.0°
C10	C9	C11	H14	116.5°	90.0°
C9	C10	O4	N4	178.0°	90.0°
C10	C9	C11	C12	157.5°	90.0°
C10	C9	C11	C13	39.9°	90.0°
C10	C9	C11	H15	82.2°	90.0°
C9	C10	N4	C18	36.8°	90.0°
C9	C10	N4	C15	177.9°	90.0°
C10	C9	N3	C6	65.7°	90.0°
C11	C9	C10	O4	97.4°	90.0°
C9	C11	C12	C13	121.0°	90.0°
C9	C11	C12	H15	120.1°	90.0°
C9	C11	C13	H15	121.8°	90.0°
C9	C11	C12	C14	65.1°	90.0°
C9	C11	C12	H16	55.6°	90.0°
C9	C11	C12	H17	174.3°	90.0°
C9	C11	C13	H18	180.0°	90.0°
C9	C11	C13	H19	60.0°	90.0°
C9	C11	C13	H20	60.0°	90.0°
C11	C9	N3	C6	167.1°	90.0°
C11	C9	C10	N4	84.4°	90.0°
H14	C9	C10	O4	19.0°	90.0°
H14	C9	C11	C12	41.0°	90.0°
H14	C9	C11	C13	76.6°	90.0°
H14	C9	C11	H15	161.3°	90.0°
H14	C9	N3	C6	50.6°	90.0°
H14	C9	C10	N4	159.1°	90.0°
O4	C10	N4	C18	145.1°	90.0°
O4	C10	N4	C15	0.2°	90.0°
C12	C11	C13	H15	118.9°	90.0°
C11	C12	C14	H16	120.6°	90.0°
C11	C12	C14	H17	120.6°	90.0°
C11	C12	H16	H17	118.0°	90.0°
C12	C11	C13	H18	60.7°	90.0°
C12	C11	C13	H19	179.3°	90.0°
C12	C11	C13	H20	59.3°	90.0°
C11	C12	C14	H21	180.0°	90.0°
C11	C12	C14	H22	60.0°	90.0°
C11	C12	C14	H23	60.0°	90.0°
C13	C11	C12	C14	55.9°	90.0°
C13	C11	C12	H16	176.5°	90.0°
C13	C11	C12	H17	64.8°	90.0°
C11	C13	H18	H19	120.0°	90.0°
C11	C13	H18	H20	120.0°	90.0°
C11	C13	H19	H20	120.0°	90.0°
H15	C11	C12	C14	174.8°	90.0°
H15	C11	C12	H16	64.5°	90.0°
H15	C11	C12	H17	54.1°	90.0°
H15	C11	C13	H18	58.2°	90.0°
H15	C11	C13	H19	61.8°	90.0°
H15	C11	C13	H20	178.2°	90.0°
C14	C12	H16	H17	118.1°	90.0°
C12	C14	H21	H22	120.0°	90.0°
C12	C14	H21	H23	120.0°	90.0°
C12	C14	H22	H23	120.0°	90.0°
H16	C12	C14	H21	59.4°	90.0°
H16	C12	C14	H22	179.4°	90.0°
H16	C12	C14	H23	60.6°	90.0°
H17	C12	C14	H21	59.4°	90.0°
H17	C12	C14	H22	60.6°	90.0°
H17	C12	C14	H23	179.4°	90.0°
H18	C13	H19	H20	120.0°	90.0°
H21	C14	H22	H23	120.0°	90.0°
C17	C18	N4	H26	120.1°	90.0°
C17	C18	N4	H27	120.0°	90.0°
C17	C18	N4	C15	77.7°	90.0°
C17	C18	H26	H27	119.9°	90.0°
C18	C17	H28	C1	180.0°	90.0°
C17	C18	N4	C10	132.5°	90.0°
C18	N4	C15	C10	152.6°	90.0°
C18	N4	C15	C16	146.4°	90.0°
C18	N4	C15	H24	93.1°	90.0°
C18	N4	C15	H25	25.9°	90.0°
N4	C18	H26	H27	119.9°	90.0°
N4	C18	C17	H28	46.9°	90.0°
N4	C18	C17	C1	133.1°	90.0°
N4	C15	C16	H24	120.5°	90.0°
N4	C15	C16	H25	120.5°	90.0°
N4	C15	C16	O5	141.1°	90.0°
N4	C15	H24	H25	118.5°	90.0°
C15	N4	C18	H26	162.3°	90.0°
C15	N4	C18	H27	42.3°	90.0°
N4	C15	C16	N5	38.9°	90.0°
C15	C16	O5	N5	180.0°	90.0°
C16	C15	H24	H25	118.5°	90.0°
C15	C16	N5	C19	175.3°	90.0°
C15	C16	N5	H29	4.7°	90.0°
C16	C15	N4	C10	61.1°	90.0°
O5	C16	C15	H24	20.7°	90.0°
O5	C16	C15	H25	98.3°	90.0°
O5	C16	N5	C19	4.7°	90.0°
O5	C16	N5	H29	175.3°	90.0°
H24	C15	N4	C10	59.4°	90.0°
H24	C15	C16	N5	159.3°	90.0°
H25	C15	N4	C10	178.4°	90.0°
H25	C15	C16	N5	81.7°	90.0°
H26	C18	C17	H28	167.0°	90.0°
H26	C18	C17	C1	13.0°	90.0°
H26	C18	N4	C10	12.5°	90.0°
H27	C18	C17	H28	73.1°	90.0°
H27	C18	C17	C1	106.9°	90.0°
H27	C18	N4	C10	107.4°	90.0°
C19	N5	H29	C16	180.0°	90.0°
N5	C19	C20	C21	124.4°	90.0°
N5	C19	C20	H30	118.2°	90.0°
N5	C19	C21	H30	119.3°	90.0°
N5	C19	C20	O6	140.8°	90.0°
N5	C19	C21	O7	76.5°	90.0°
N5	C19	C21	H31	163.2°	90.0°
N5	C19	C21	H32	43.8°	90.0°
N5	C19	C20	N6	39.7°	90.0°
H29	N5	C19	C20	115.1°	90.0°
H29	N5	C19	C21	8.4°	90.0°
H29	N5	C19	H30	127.2°	90.0°
C20	C19	C21	H30	117.4°	90.0°
C19	C20	O6	N6	179.4°	90.0°
C20	C19	C21	O7	46.8°	90.0°
C20	C19	C21	H31	73.6°	90.0°
C20	C19	C21	H32	167.1°	90.0°
C19	C20	N6	C22	175.9°	90.0°
C19	C20	N6	H34	4.1°	90.0°
C20	C19	N5	C16	64.9°	90.0°
C21	C19	C20	O6	94.7°	90.0°
C19	C21	O7	H31	120.3°	90.0°
C19	C21	O7	H32	120.3°	90.0°
C19	C21	H31	H32	119.0°	90.0°
C19	C21	O7	H33	44.2°	90.0°
C21	C19	N5	C16	171.6°	90.0°
C21	C19	C20	N6	84.7°	90.0°
H30	C19	C20	O6	22.6°	90.0°
H30	C19	C21	O7	164.2°	90.0°
H30	C19	C21	H31	43.9°	90.0°
H30	C19	C21	H32	75.5°	90.0°
H30	C19	N5	C16	52.9°	90.0°
H30	C19	C20	N6	157.9°	90.0°
O6	C20	N6	C22	4.7°	90.0°
O6	C20	N6	H34	175.3°	90.0°
O7	C21	H31	H32	119.0°	90.0°
H31	C21	O7	H33	164.5°	90.0°
H32	C21	O7	H33	76.1°	90.0°
C22	N6	H34	C20	180.0°	90.0°
N6	C22	C23	C24	126.0°	90.0°
N6	C22	C23	H35	118.0°	90.0°
N6	C22	C24	H35	117.0°	90.0°
N6	C22	C23	O8	138.1°	90.0°
N6	C22	C24	C25	177.7°	90.0°
N6	C22	C24	H36	56.9°	90.0°
N6	C22	C24	H37	61.6°	90.0°
N6	C22	C23	N7	41.3°	90.0°
H34	N6	C22	C23	122.8°	90.0°
H34	N6	C22	C24	3.1°	90.0°
H34	N6	C22	H35	119.7°	90.0°
C23	C22	C24	H35	116.0°	90.0°
C22	C23	O8	N7	179.4°	90.0°
C23	C22	C24	C25	55.4°	90.0°
C23	C22	C24	H36	176.1°	90.0°
C23	C22	C24	H37	65.4°	90.0°
C22	C23	N7	C28	176.9°	90.0°
C22	C23	N7	H45	3.1°	90.0°
C23	C22	N6	C20	57.2°	90.0°
C24	C22	C23	O8	95.9°	90.0°
C22	C24	C25	H36	120.8°	90.0°
C22	C24	C25	H37	120.8°	90.0°
C22	C24	H36	H37	117.7°	90.0°
C22	C24	C25	C26	64.9°	90.0°
C22	C24	C25	C27	172.2°	90.0°
C22	C24	C25	H38	53.4°	90.0°
C24	C22	N6	C20	176.9°	90.0°
C24	C22	C23	N7	84.7°	90.0°
H35	C22	C23	O8	20.1°	90.0°
H35	C22	C24	C25	60.7°	90.0°
H35	C22	C24	H36	60.1°	90.0°
H35	C22	C24	H37	178.6°	90.0°
H35	C22	N6	C20	60.3°	90.0°
H35	C22	C23	N7	159.3°	90.0°
O8	C23	N7	C28	2.5°	90.0°
O8	C23	N7	H45	177.4°	90.0°
C25	C24	H36	H37	117.6°	90.0°
C24	C25	C26	C27	124.0°	90.0°
C24	C25	C26	H38	118.4°	90.0°
C24	C25	C27	H38	118.8°	90.0°
C24	C25	C26	H39	180.0°	90.0°
C24	C25	C26	H40	60.0°	90.0°
C24	C25	C26	H41	60.0°	90.0°
C24	C25	C27	H42	180.0°	90.0°
C24	C25	C27	H43	60.0°	90.0°
C24	C25	C27	H44	60.0°	90.0°
H36	C24	C25	C26	55.8°	90.0°
H36	C24	C25	C27	67.0°	90.0°
H36	C24	C25	H38	174.2°	90.0°
H37	C24	C25	C26	174.3°	90.0°
H37	C24	C25	C27	51.5°	90.0°
H37	C24	C25	H38	67.3°	90.0°
C26	C25	C27	H38	117.6°	90.0°
C25	C26	H39	H40	120.0°	90.0°
C25	C26	H39	H41	120.0°	90.0°
C25	C26	H40	H41	120.0°	90.0°
C26	C25	C27	H42	56.4°	90.0°
C26	C25	C27	H43	63.6°	90.0°
C26	C25	C27	H44	176.4°	90.0°
C27	C25	C26	H39	55.9°	90.0°
C27	C25	C26	H40	175.9°	90.0°
C27	C25	C26	H41	64.0°	90.0°
C25	C27	H42	H43	120.0°	90.0°
C25	C27	H42	H44	120.0°	90.0°
C25	C27	H43	H44	120.0°	90.0°
H38	C25	C26	H39	61.6°	90.0°
H38	C25	C26	H40	58.4°	90.0°
H38	C25	C26	H41	178.4°	90.0°
H38	C25	C27	H42	61.2°	90.0°
H38	C25	C27	H43	178.8°	90.0°
H38	C25	C27	H44	58.8°	90.0°
H39	C26	H40	H41	120.0°	90.0°
H42	C27	H43	H44	120.0°	90.0°
C28	N7	H45	C23	180.0°	90.0°
N7	C28	C29	C30	122.7°	90.0°
N7	C28	C29	H46	120.3°	90.0°
N7	C28	C30	H46	119.1°	90.0°
N7	C28	C29	O9	146.6°	90.0°
N7	C28	C30	C31	98.4°	90.0°
N7	C28	C30	H47	22.3°	90.0°
N7	C28	C30	H48	141.1°	90.0°
N7	C28	C29	N8	34.9°	90.0°
H45	N7	C28	C29	120.3°	90.0°
H45	N7	C28	C30	1.0°	90.0°
H45	N7	C28	H46	119.7°	90.0°
C29	C28	C30	H46	117.2°	90.0°
C28	C29	O9	N8	178.4°	90.0°
C29	C28	C30	C31	137.9°	90.0°
C29	C28	C30	H47	101.5°	90.0°
C29	C28	C30	H48	17.3°	90.0°
C28	C29	N8	C34	179.6°	90.0°
C28	C29	N8	H56	0.4°	90.0°
C29	C28	N7	C23	59.7°	90.0°
C30	C28	C29	O9	90.7°	90.0°
C28	C30	C31	H47	120.6°	90.0°
C28	C30	C31	H48	120.6°	90.0°
C28	C30	H47	H48	118.1°	90.0°
C28	C30	C31	C32	65.4°	90.0°
C28	C30	C31	C33	171.9°	90.0°
C28	C30	C31	H49	53.6°	90.0°
C30	C28	N7	C23	179.0°	90.0°
C30	C28	C29	N8	87.7°	90.0°
H46	C28	C29	O9	26.4°	90.0°
H46	C28	C30	C31	20.7°	90.0°
H46	C28	C30	H47	141.3°	90.0°
H46	C28	C30	H48	99.9°	90.0°
H46	C28	N7	C23	60.3°	90.0°
H46	C28	C29	N8	155.2°	90.0°
O9	C29	N8	C34	2.0°	90.0°
O9	C29	N8	H56	178.0°	90.0°
C31	C30	H47	H48	118.1°	90.0°
C30	C31	C32	C33	122.7°	90.0°
C30	C31	C32	H49	118.9°	90.0°
C30	C31	C33	H49	118.3°	90.0°
C30	C31	C32	H50	180.0°	90.0°
C30	C31	C32	H51	60.0°	90.0°
C30	C31	C32	H52	60.0°	90.0°
C30	C31	C33	H53	180.0°	90.0°
C30	C31	C33	H54	60.0°	90.0°
C30	C31	C33	H55	60.0°	90.0°
H47	C30	C31	C32	55.2°	90.0°
H47	C30	C31	C33	67.5°	90.0°
H47	C30	C31	H49	174.2°	90.0°
H48	C30	C31	C32	174.0°	90.0°
H48	C30	C31	C33	51.3°	90.0°
H48	C30	C31	H49	67.0°	90.0°
C32	C31	C33	H49	118.6°	90.0°
C31	C32	H50	H51	120.0°	90.0°
C31	C32	H50	H52	120.0°	90.0°
C31	C32	H51	H52	120.0°	90.0°
C32	C31	C33	H53	56.9°	90.0°
C32	C31	C33	H54	63.1°	90.0°
C32	C31	C33	H55	176.9°	90.0°
C33	C31	C32	H50	57.4°	90.0°
C33	C31	C32	H51	177.3°	90.0°
C33	C31	C32	H52	62.6°	90.0°
C31	C33	H53	H54	120.0°	90.0°
C31	C33	H53	H55	120.0°	90.0°
C31	C33	H54	H55	120.0°	90.0°
H49	C31	C32	H50	61.1°	90.0°
H49	C31	C32	H51	58.9°	90.0°
H49	C31	C32	H52	178.9°	90.0°
H49	C31	C33	H53	61.7°	90.0°
H49	C31	C33	H54	178.3°	90.0°
H49	C31	C33	H55	58.4°	90.0°
H50	C32	H51	H52	120.0°	90.0°
H53	C33	H54	H55	120.0°	90.0°
C34	N8	H56	C29	180.0°	90.0°
N8	C34	C35	C36	122.9°	90.0°
N8	C34	C35	H57	118.8°	90.0°
N8	C34	C36	H57	118.9°	90.0°
N8	C34	C35	O10	142.9°	90.0°
N8	C34	C36	C37	54.8°	90.0°
N8	C34	C36	H58	65.8°	90.0°
N8	C34	C36	H59	175.5°	90.0°
N8	C34	C35	N12	35.9°	90.0°
H56	N8	C34	C35	109.0°	90.0°
H56	N8	C34	C36	14.5°	90.0°
H56	N8	C34	H57	132.8°	90.0°
C35	C34	C36	H57	118.4°	90.0°
C34	C35	O10	N12	178.8°	90.0°
C35	C34	C36	C37	177.5°	90.0°
C35	C34	C36	H58	56.8°	90.0°
C35	C34	C36	H59	61.8°	90.0°
C34	C35	N12	C40	174.4°	90.0°
C34	C35	N12	H69	5.6°	90.0°
C35	C34	N8	C29	71.0°	90.0°
C36	C34	C35	O10	94.2°	90.0°
C34	C36	C37	H58	120.7°	90.0°
C34	C36	C37	H59	120.7°	90.0°
C34	C36	H58	H59	118.0°	90.0°
C34	C36	C37	C38	54.9°	90.0°
C34	C36	C37	H60	65.3°	90.0°
C34	C36	C37	H61	175.0°	90.0°
C36	C34	N8	C29	165.5°	90.0°
C36	C34	C35	N12	87.0°	90.0°
H57	C34	C35	O10	24.2°	90.0°
H57	C34	C36	C37	64.1°	90.0°
H57	C34	C36	H58	175.2°	90.0°
H57	C34	C36	H59	56.6°	90.0°
H57	C34	N8	C29	47.2°	90.0°
H57	C34	C35	N12	154.7°	90.0°
O10	C35	N12	C40	4.4°	90.0°
O10	C35	N12	H69	175.6°	90.0°
C37	C36	H58	H59	118.0°	90.0°
C36	C37	C38	H60	120.2°	90.0°
C36	C37	C38	H61	120.1°	90.0°
C36	C37	H60	H61	119.5°	90.0°
C36	C37	C38	N9	45.8°	90.0°
C36	C37	C38	H62	74.3°	90.0°
C36	C37	C38	H63	165.9°	90.0°
H58	C36	C37	C38	175.5°	90.0°
H58	C36	C37	H60	55.4°	90.0°
H58	C36	C37	H61	64.3°	90.0°
H59	C36	C37	C38	65.8°	90.0°
H59	C36	C37	H60	174.0°	90.0°
H59	C36	C37	H61	54.4°	90.0°
C38	C37	H60	H61	119.5°	90.0°
C37	C38	N9	H62	120.1°	90.0°
C37	C38	N9	H63	120.1°	90.0°
C37	C38	H62	H63	119.7°	90.0°
C37	C38	N9	C39	148.0°	90.0°
C37	C38	N9	H64	32.0°	90.0°
H60	C37	C38	N9	166.0°	90.0°
H60	C37	C38	H62	45.9°	90.0°
H60	C37	C38	H63	73.9°	90.0°
H61	C37	C38	N9	74.3°	90.0°
H61	C37	C38	H62	165.6°	90.0°
H61	C37	C38	H63	45.8°	90.0°
N9	C38	H62	H63	119.7°	90.0°
C38	N9	C39	H64	180.0°	90.0°
C38	N9	C39	N10	1.2°	90.0°
C38	N9	C39	N11	179.0°	90.0°
H62	C38	N9	C39	27.9°	90.0°
H62	C38	N9	H64	152.2°	90.0°
H63	C38	N9	C39	91.9°	90.0°
H63	C38	N9	H64	88.1°	90.0°
N9	C39	N10	N11	179.8°	90.0°
N9	C39	N10	H65	179.8°	90.0°
N9	C39	N10	H66	0.2°	90.0°
N9	C39	N11	H67	179.8°	90.0°
N9	C39	N11	H68	0.2°	90.0°
H64	N9	C39	N10	178.8°	90.0°
H64	N9	C39	N11	1.0°	90.0°
C39	N10	H65	H66	180.0°	90.0°
N10	C39	N11	H67	0.0°	90.0°
N10	C39	N11	H68	180.0°	90.0°
N11	C39	N10	H65	0.0°	90.0°
N11	C39	N10	H66	180.0°	90.0°
C39	N11	H67	H68	180.0°	90.0°
C40	N12	H69	C35	180.0°	90.0°
N12	C40	C41	C42	123.0°	90.0°
N12	C40	C41	H70	119.7°	90.0°
N12	C40	C42	H70	119.1°	90.0°
N12	C40	C41	O11	131.9°	90.0°
N12	C40	C42	C43	174.6°	90.0°
N12	C40	C42	C44	62.8°	90.0°
N12	C40	C42	H71	55.6°	90.0°
N12	C40	C41	N13	46.8°	90.0°
H69	N12	C40	C41	117.4°	90.0°
H69	N12	C40	C42	4.9°	90.0°
H69	N12	C40	H70	123.4°	90.0°
C41	C40	C42	H70	117.6°	90.0°
C40	C41	O11	N13	178.6°	90.0°
C41	C40	C42	C43	51.4°	90.0°
C41	C40	C42	C44	173.9°	90.0°
C41	C40	C42	H71	67.6°	90.0°
C40	C41	N13	C45	176.8°	90.0°
C40	C41	N13	H78	3.2°	90.0°
C41	C40	N12	C35	62.6°	90.0°
C42	C40	C41	O11	105.1°	90.0°
C40	C42	C43	C44	123.0°	90.0°
C40	C42	C43	H71	118.7°	90.0°
C40	C42	C44	H71	118.3°	90.0°
C40	C42	C43	H72	180.0°	90.0°
C40	C42	C43	H73	60.0°	90.0°
C40	C42	C43	H74	60.0°	90.0°
C40	C42	C44	H75	180.0°	90.0°
C40	C42	C44	H76	60.0°	90.0°
C40	C42	C44	H77	60.0°	90.0°
C42	C40	N12	C35	175.1°	90.0°
C42	C40	C41	N13	76.2°	90.0°
H70	C40	C41	O11	12.3°	90.0°
H70	C40	C42	C43	66.3°	90.0°
H70	C40	C42	C44	56.3°	90.0°
H70	C40	C42	H71	174.7°	90.0°
H70	C40	N12	C35	56.6°	90.0°
H70	C40	C41	N13	166.4°	90.0°
O11	C41	N13	C45	4.5°	90.0°
O11	C41	N13	H78	175.5°	90.0°
C43	C42	C44	H71	118.3°	90.0°
C42	C43	H72	H73	120.0°	90.0°
C42	C43	H72	H74	120.0°	90.0°
C42	C43	H73	H74	120.0°	90.0°
C43	C42	C44	H75	56.6°	90.0°
C43	C42	C44	H76	63.4°	90.0°
C43	C42	C44	H77	176.6°	90.0°
C44	C42	C43	H72	57.0°	90.0°
C44	C42	C43	H73	177.0°	90.0°
C44	C42	C43	H74	63.0°	90.0°
C42	C44	H75	H76	120.0°	90.0°
C42	C44	H75	H77	120.0°	90.0°
C42	C44	H76	H77	120.0°	90.0°
H71	C42	C43	H72	61.3°	90.0°
H71	C42	C43	H73	58.7°	90.0°
H71	C42	C43	H74	178.8°	90.0°
H71	C42	C44	H75	61.7°	90.0°
H71	C42	C44	H76	178.3°	90.0°
H71	C42	C44	H77	58.3°	90.0°
H72	C43	H73	H74	119.9°	90.0°
H75	C44	H76	H77	120.0°	90.0°
C45	N13	H78	C41	180.0°	90.0°
N13	C45	C46	C47	121.9°	90.0°
N13	C45	C46	H79	118.8°	90.0°
N13	C45	C47	H79	119.6°	90.0°
N13	C45	C46	O12	144.5°	90.0°
N13	C45	C47	C48	68.9°	90.0°
N13	C45	C47	H80	51.6°	90.0°
N13	C45	C47	H81	170.6°	90.0°
N13	C45	C46	N15	32.6°	90.0°
H78	N13	C45	C46	111.3°	90.0°
H78	N13	C45	C47	11.5°	90.0°
H78	N13	C45	H79	130.5°	90.0°
C46	C45	C47	H79	119.5°	90.0°
C45	C46	O12	N15	176.9°	90.0°
C46	C45	C47	C48	170.2°	90.0°
C46	C45	C47	H80	69.3°	90.0°
C46	C45	C47	H81	49.7°	90.0°
C45	C46	N15	C50	179.5°	90.0°
C45	C46	N15	H86	0.5°	90.0°
C46	C45	N13	C41	68.7°	90.0°
C47	C45	C46	O12	93.6°	90.0°
C45	C47	C48	H80	120.5°	90.0°
C45	C47	C48	H81	120.5°	90.0°
C45	C47	H80	H81	118.4°	90.0°
C45	C47	C48	C49	159.6°	90.0°
C45	C47	C48	H82	79.8°	90.0°
C45	C47	C48	H83	39.0°	90.0°
C47	C45	N13	C41	168.5°	90.0°
C47	C45	C46	N15	89.3°	90.0°
H79	C45	C46	O12	25.8°	90.0°
H79	C45	C47	C48	50.8°	90.0°
H79	C45	C47	H80	171.3°	90.0°
H79	C45	C47	H81	69.8°	90.0°
H79	C45	N13	C41	49.5°	90.0°
H79	C45	C46	N15	151.4°	90.0°
O12	C46	N15	C50	2.5°	90.0°
O12	C46	N15	H86	177.5°	90.0°
C48	C47	H80	H81	118.4°	90.0°
C47	C48	C49	H82	120.6°	90.0°
C47	C48	C49	H83	120.6°	90.0°
C47	C48	H82	H83	118.3°	90.0°
C47	C48	C49	O13	35.6°	90.0°
C47	C48	C49	N14	144.5°	90.0°
H80	C47	C48	C49	39.1°	90.0°
H80	C47	C48	H82	159.7°	90.0°
H80	C47	C48	H83	81.5°	90.0°
H81	C47	C48	C49	79.9°	90.0°
H81	C47	C48	H82	40.7°	90.0°
H81	C47	C48	H83	159.6°	90.0°
C49	C48	H82	H83	118.3°	90.0°
C48	C49	O13	N14	179.9°	90.0°
C48	C49	N14	H84	179.9°	90.0°
C48	C49	N14	H85	0.1°	90.0°
H82	C48	C49	O13	156.2°	90.0°
H82	C48	C49	N14	23.9°	90.0°
H83	C48	C49	O13	84.9°	90.0°
H83	C48	C49	N14	95.0°	90.0°
O13	C49	N14	H84	0.0°	90.0°
O13	C49	N14	H85	180.0°	90.0°
C49	N14	H84	H85	180.0°	90.0°
C50	N15	H86	C46	180.0°	90.0°
N15	C50	C51	C52	124.4°	90.0°
N15	C50	C51	H87	118.1°	90.0°
N15	C50	C52	H87	117.7°	90.0°
N15	C50	C51	O14	138.5°	90.0°
N15	C50	C52	H88	180.0°	90.0°
N15	C50	C52	H89	60.0°	90.0°
N15	C50	C52	H90	60.0°	90.0°
N15	C50	C51	N16	41.6°	90.0°
H86	N15	C50	C51	113.3°	90.0°
H86	N15	C50	C52	11.7°	90.0°
H86	N15	C50	H87	129.0°	90.0°
C51	C50	C52	H87	117.4°	90.0°
C50	C51	O14	N16	179.9°	90.0°
C51	C50	C52	H88	55.1°	90.0°
C51	C50	C52	H89	175.1°	90.0°
C51	C50	C52	H90	64.9°	90.0°
C50	C51	N16	C53	179.4°	90.0°
C50	C51	N16	H91	0.6°	90.0°
C51	C50	N15	C46	66.7°	90.0°
C52	C50	C51	O14	97.1°	90.0°
C50	C52	H88	H89	120.0°	90.0°
C50	C52	H88	H90	120.0°	90.0°
C50	C52	H89	H90	120.0°	90.0°
C52	C50	N15	C46	168.2°	90.0°
C52	C50	C51	N16	82.8°	90.0°
H87	C50	C51	O14	20.4°	90.0°
H87	C50	C52	H88	62.3°	90.0°
H87	C50	C52	H89	57.7°	90.0°
H87	C50	C52	H90	177.7°	90.0°
H87	C50	N15	C46	51.0°	90.0°
H87	C50	C51	N16	159.7°	90.0°
O14	C51	N16	C53	0.5°	90.0°
O14	C51	N16	H91	179.5°	90.0°
H88	C52	H89	H90	120.0°	90.0°
C53	N16	H91	C51	180.0°	90.0°
N16	C53	C54	C55	125.1°	90.0°
N16	C53	C54	H92	117.5°	90.0°
N16	C53	C55	H92	118.0°	90.0°
N16	C53	C54	O15	148.0°	90.0°
N16	C53	C55	C56	76.5°	90.0°
N16	C53	C55	H93	43.9°	90.0°
N16	C53	C55	H94	163.0°	90.0°
N16	C53	C54	N19	31.3°	90.0°
H91	N16	C53	C54	107.6°	90.0°
H91	N16	C53	C55	17.7°	90.0°
H91	N16	C53	H92	135.2°	90.0°
C54	C53	C55	H92	117.6°	90.0°
C53	C54	O15	N19	179.2°	90.0°
C54	C53	C55	C56	159.1°	90.0°
C54	C53	C55	H93	80.5°	90.0°
C54	C53	C55	H94	38.7°	90.0°
C53	C54	N19	C59	175.1°	90.0°
C53	C54	N19	H99	4.9°	90.0°
C54	C53	N16	C51	72.4°	90.0°
C55	C53	C54	O15	86.9°	90.0°
C53	C55	C56	H93	120.5°	90.0°
C53	C55	C56	H94	120.5°	90.0°
C53	C55	H93	H94	118.7°	90.0°
C53	C55	C56	N17	81.5°	90.0°
C53	C55	C56	C57	95.4°	90.0°
C55	C53	N16	C51	162.4°	90.0°
C55	C53	C54	N19	93.9°	90.0°
H92	C53	C54	O15	30.5°	90.0°
H92	C53	C55	C56	41.5°	90.0°
H92	C53	C55	H93	162.0°	90.0°
H92	C53	C55	H94	78.9°	90.0°
H92	C53	N16	C51	44.8°	90.0°
H92	C53	C54	N19	148.7°	90.0°
O15	C54	N19	C59	4.1°	90.0°
O15	C54	N19	H99	175.9°	90.0°
C56	C55	H93	H94	118.6°	90.0°
C55	C56	N17	C57	177.6°	90.0°
C55	C56	N17	C58	178.6°	90.0°
C55	C56	N17	H95	1.4°	90.0°
C55	C56	C57	N18	179.1°	90.0°
C55	C56	C57	H96	0.9°	90.0°
H93	C55	C56	N17	158.0°	90.0°
H93	C55	C56	C57	25.1°	90.0°
H94	C55	C56	N17	38.9°	90.0°
H94	C55	C56	C57	144.2°	90.0°
C56	N17	C58	H95	180.0°	90.0°
N17	C56	C57	N18	1.9°	90.0°
N17	C56	C57	H96	178.1°	90.0°
C56	N17	C58	N18	0.3°	90.0°
C56	N17	C58	H97	179.7°	90.0°
C57	C56	N17	C58	1.0°	90.0°
C57	C56	N17	H95	179.0°	90.0°
C56	C57	N18	H96	180.0°	90.0°
C56	C57	N18	C58	2.1°	90.0°
C56	C57	N18	H98	177.9°	90.0°
N17	C58	N18	C57	1.5°	90.0°
N17	C58	N18	H97	180.0°	90.0°
N17	C58	N18	H98	178.5°	90.0°
H95	N17	C58	N18	179.7°	90.0°
H95	N17	C58	H97	0.3°	90.0°
C57	N18	C58	H98	180.0°	90.0°
C57	N18	C58	H97	178.5°	90.0°
H96	C57	N18	C58	177.9°	90.0°
H96	C57	N18	H98	2.2°	90.0°
H97	C58	N18	H98	1.5°	90.0°
C59	N19	H99	C54	180.0°	90.0°
N19	C59	C60	C61	125.1°	90.0°
N19	C59	C60	H100	117.6°	90.0°
N19	C59	C61	H100	118.6°	90.0°
N19	C59	C60	O16	138.9°	90.0°
N19	C59	C61	C62	73.3°	90.0°
N19	C59	C61	C63	165.5°	90.0°
N19	C59	C61	H101	45.8°	90.0°
N19	C59	C60	N20	40.7°	90.0°
H99	N19	C59	C60	114.3°	90.0°
H99	N19	C59	C61	10.8°	90.0°
H99	N19	C59	H100	128.7°	90.0°
C60	C59	C61	H100	117.5°	90.0°
C59	C60	O16	N20	179.6°	90.0°
C60	C59	C61	C62	162.9°	90.0°
C60	C59	C61	C63	41.7°	90.0°
C60	C59	C61	H101	78.0°	90.0°
C59	C60	N20	C65	179.4°	90.0°
C59	C60	N20	H110	0.6°	90.0°
C60	C59	N19	C54	65.7°	90.0°
C61	C59	C60	O16	96.0°	90.0°
C59	C61	C62	C63	122.7°	90.0°
C59	C61	C62	H101	118.9°	90.0°
C59	C61	C63	H101	119.4°	90.0°
C59	C61	C62	C64	170.0°	90.0°
C59	C61	C62	H102	69.5°	90.0°
C59	C61	C62	H103	49.5°	90.0°
C59	C61	C63	H104	180.0°	90.0°
C59	C61	C63	H105	60.0°	90.0°
C59	C61	C63	H106	60.0°	90.0°
C61	C59	N19	C54	169.3°	90.0°
C61	C59	C60	N20	84.3°	90.0°
H100	C59	C60	O16	21.3°	90.0°
H100	C59	C61	C62	45.3°	90.0°
H100	C59	C61	C63	75.9°	90.0°
H100	C59	C61	H101	164.4°	90.0°
H100	C59	N19	C54	51.3°	90.0°
H100	C59	C60	N20	158.3°	90.0°
O16	C60	N20	C65	0.9°	90.0°
O16	C60	N20	H110	179.1°	90.0°
C62	C61	C63	H101	118.4°	90.0°
C61	C62	C64	H102	120.5°	90.0°
C61	C62	C64	H103	120.5°	90.0°
C61	C62	H102	H103	118.4°	90.0°
C62	C61	C63	H104	57.9°	90.0°
C62	C61	C63	H105	177.9°	90.0°
C62	C61	C63	H106	62.2°	90.0°
C61	C62	C64	H107	180.0°	90.0°
C61	C62	C64	H108	60.0°	90.0°
C61	C62	C64	H109	60.0°	90.0°
C63	C61	C62	C64	67.3°	90.0°
C63	C61	C62	H102	53.2°	90.0°
C63	C61	C62	H103	172.2°	90.0°
C61	C63	H104	H105	120.0°	90.0°
C61	C63	H104	H106	120.0°	90.0°
C61	C63	H105	H106	120.0°	90.0°
H101	C61	C62	C64	51.1°	90.0°
H101	C61	C62	H102	171.6°	90.0°
H101	C61	C62	H103	69.4°	90.0°
H101	C61	C63	H104	60.6°	90.0°
H101	C61	C63	H105	59.4°	90.0°
H101	C61	C63	H106	179.4°	90.0°
C64	C62	H102	H103	118.4°	90.0°
C62	C64	H107	H108	120.0°	90.0°
C62	C64	H107	H109	120.0°	90.0°
C62	C64	H108	H109	120.0°	90.0°
H102	C62	C64	H107	59.5°	90.0°
H102	C62	C64	H108	179.5°	90.0°
H102	C62	C64	H109	60.6°	90.0°
H103	C62	C64	H107	59.5°	90.0°
H103	C62	C64	H108	60.5°	90.0°
H103	C62	C64	H109	179.5°	90.0°
H104	C63	H105	H106	120.0°	90.0°
H107	C64	H108	H109	120.0°	90.0°
C65	N20	H110	C60	180.0°	90.0°
N20	C65	C66	C67	124.6°	90.0°
N20	C65	C66	H111	118.4°	90.0°
N20	C65	C67	H111	117.7°	90.0°
N20	C65	C66	O17	147.1°	90.0°
N20	C65	C67	C68	72.1°	90.0°
N20	C65	C67	H112	48.5°	90.0°
N20	C65	C67	H113	167.3°	90.0°
N20	C65	C66	N24	33.6°	90.0°
H110	N20	C65	C66	111.0°	90.0°
H110	N20	C65	C67	13.9°	90.0°
H110	N20	C65	H111	131.0°	90.0°
C66	C65	C67	H111	117.2°	90.0°
C65	C66	O17	N24	179.2°	90.0°
C66	C65	C67	C68	162.8°	90.0°
C66	C65	C67	H112	76.6°	90.0°
C66	C65	C67	H113	42.2°	90.0°
C65	C66	N24	C71	173.1°	90.0°
C65	C66	N24	H123	6.9°	90.0°
C66	C65	N20	C60	68.9°	90.0°
C67	C65	C66	O17	88.3°	90.0°
C65	C67	C68	H112	120.6°	90.0°
C65	C67	C68	H113	120.6°	90.0°
C65	C67	H112	H113	118.1°	90.0°
C65	C67	C68	C69	162.8°	90.0°
C65	C67	C68	H114	42.5°	90.0°
C65	C67	C68	H115	77.0°	90.0°
C67	C65	N20	C60	166.1°	90.0°
C67	C65	C66	N24	91.0°	90.0°
H111	C65	C66	O17	28.7°	90.0°
H111	C65	C67	C68	45.6°	90.0°
H111	C65	C67	H112	166.3°	90.0°
H111	C65	C67	H113	75.0°	90.0°
H111	C65	N20	C60	49.0°	90.0°
H111	C65	C66	N24	152.0°	90.0°
O17	C66	N24	C71	7.7°	90.0°
O17	C66	N24	H123	172.4°	90.0°
C68	C67	H112	H113	118.2°	90.0°
C67	C68	C69	H114	120.3°	90.0°
C67	C68	C69	H115	120.2°	90.0°
C67	C68	H114	H115	119.3°	90.0°
C67	C68	C69	N21	171.1°	90.0°
C67	C68	C69	H116	68.8°	90.0°
C67	C68	C69	H117	51.0°	90.0°
H112	C67	C68	C69	76.7°	90.0°
H112	C67	C68	H114	163.1°	90.0°
H112	C67	C68	H115	43.6°	90.0°
H113	C67	C68	C69	42.2°	90.0°
H113	C67	C68	H114	78.1°	90.0°
H113	C67	C68	H115	162.4°	90.0°
C69	C68	H114	H115	119.2°	90.0°
C68	C69	N21	H116	120.1°	90.0°
C68	C69	N21	H117	120.1°	90.0°
C68	C69	H116	H117	119.7°	90.0°
C68	C69	N21	C70	86.9°	90.0°
C68	C69	N21	H118	93.1°	90.0°
H114	C68	C69	N21	50.8°	90.0°
H114	C68	C69	H116	170.9°	90.0°
H114	C68	C69	H117	69.3°	90.0°
H115	C68	C69	N21	68.7°	90.0°
H115	C68	C69	H116	51.4°	90.0°
H115	C68	C69	H117	171.2°	90.0°
N21	C69	H116	H117	119.7°	90.0°
C69	N21	C70	H118	180.0°	90.0°
C69	N21	C70	N22	1.7°	90.0°
C69	N21	C70	N23	178.2°	90.0°
H116	C69	N21	C70	33.2°	90.0°
H116	C69	N21	H118	146.8°	90.0°
H117	C69	N21	C70	153.0°	90.0°
H117	C69	N21	H118	27.0°	90.0°
N21	C70	N22	N23	179.8°	90.0°
N21	C70	N22	H119	179.8°	90.0°
N21	C70	N22	H120	0.2°	90.0°
N21	C70	N23	H121	179.8°	90.0°
N21	C70	N23	H122	0.2°	90.0°
H118	N21	C70	N22	178.3°	90.0°
H118	N21	C70	N23	1.9°	90.0°
C70	N22	H119	H120	180.0°	90.0°
N22	C70	N23	H121	0.0°	90.0°
N22	C70	N23	H122	180.0°	90.0°
N23	C70	N22	H119	0.0°	90.0°
N23	C70	N22	H120	180.0°	90.0°
C70	N23	H121	H122	180.0°	90.0°
C71	N24	H123	C66	180.0°	90.0°
N24	C71	C72	C73	121.5°	90.0°
N24	C71	C72	H124	120.7°	90.0°
N24	C71	C73	H124	119.4°	90.0°
N24	C71	C72	O18	134.9°	90.0°
N24	C71	C73	C74	170.7°	90.0°
N24	C71	C73	H125	68.7°	90.0°
N24	C71	C73	H126	50.2°	90.0°
N24	C71	C72	N26	45.7°	90.0°
H123	N24	C71	C72	120.1°	90.0°
H123	N24	C71	C73	0.8°	90.0°
H123	N24	C71	H124	119.7°	90.0°
C72	C71	C73	H124	117.9°	90.0°
C71	C72	O18	N26	179.3°	90.0°
C72	C71	C73	C74	48.1°	90.0°
C72	C71	C73	H125	168.6°	90.0°
C72	C71	C73	H126	72.5°	90.0°
C71	C72	N26	C77	176.6°	90.0°
C71	C72	N26	H136	3.4°	90.0°
C72	C71	N24	C66	59.8°	90.0°
C73	C71	C72	O18	103.6°	90.0°
C71	C73	C74	H125	120.6°	90.0°
C71	C73	C74	H126	120.5°	90.0°
C71	C73	H125	H126	118.2°	90.0°
C71	C73	C74	C75	160.7°	90.0°
C71	C73	C74	H127	40.4°	90.0°
C71	C73	C74	H128	79.1°	90.0°
C73	C71	N24	C66	179.2°	90.0°
C73	C71	C72	N26	75.8°	90.0°
H124	C71	C72	O18	14.2°	90.0°
H124	C71	C73	C74	69.8°	90.0°
H124	C71	C73	H125	50.8°	90.0°
H124	C71	C73	H126	169.6°	90.0°
H124	C71	N24	C66	60.4°	90.0°
H124	C71	C72	N26	166.4°	90.0°
O18	C72	N26	C77	4.0°	90.0°
O18	C72	N26	H136	176.0°	90.0°
C74	C73	H125	H126	118.3°	90.0°
C73	C74	C75	H127	120.3°	90.0°
C73	C74	C75	H128	120.3°	90.0°
C73	C74	H127	H128	119.2°	90.0°
C73	C74	C75	C76	71.6°	90.0°
C73	C74	C75	H129	168.1°	90.0°
C73	C74	C75	H130	48.7°	90.0°
H125	C73	C74	C75	78.7°	90.0°
H125	C73	C74	H127	161.0°	90.0°
H125	C73	C74	H128	41.5°	90.0°
H126	C73	C74	C75	40.2°	90.0°
H126	C73	C74	H127	80.1°	90.0°
H126	C73	C74	H128	160.4°	90.0°
C75	C74	H127	H128	119.2°	90.0°
C74	C75	C76	H129	120.3°	90.0°
C74	C75	C76	H130	120.3°	90.0°
C74	C75	H129	H130	119.1°	90.0°
C74	C75	C76	N25	175.8°	90.0°
C74	C75	C76	H131	55.4°	90.0°
C74	C75	C76	H132	63.8°	90.0°
H127	C74	C75	C76	48.7°	90.0°
H127	C74	C75	H129	71.6°	90.0°
H127	C74	C75	H130	169.0°	90.0°
H128	C74	C75	C76	168.2°	90.0°
H128	C74	C75	H129	47.8°	90.0°
H128	C74	C75	H130	71.5°	90.0°
C76	C75	H129	H130	119.1°	90.0°
C75	C76	N25	H131	120.4°	90.0°
C75	C76	N25	H132	120.4°	90.0°
C75	C76	H131	H132	118.7°	90.0°
C75	C76	N25	H133	180.0°	90.0°
C75	C76	N25	H134	60.0°	90.0°
C75	C76	N25	H135	60.0°	90.0°
H129	C75	C76	N25	63.9°	90.0°
H129	C75	C76	H131	175.7°	90.0°
H129	C75	C76	H132	56.5°	90.0°
H130	C75	C76	N25	55.5°	90.0°
H130	C75	C76	H131	64.9°	90.0°
H130	C75	C76	H132	175.9°	90.0°
N25	C76	H131	H132	118.8°	90.0°
C76	N25	H133	H134	120.0°	90.0°
C76	N25	H133	H135	120.0°	90.0°
C76	N25	H134	H135	120.0°	90.0°
H131	C76	N25	H133	59.6°	90.0°
H131	C76	N25	H134	179.6°	90.0°
H131	C76	N25	H135	60.4°	90.0°
H132	C76	N25	H133	59.6°	90.0°
H132	C76	N25	H134	60.4°	90.0°
H132	C76	N25	H135	179.6°	90.0°
H133	N25	H134	H135	120.0°	90.0°
C77	N26	H136	C72	180.0°	90.0°
N26	C77	C78	C79	123.5°	90.0°
N26	C77	C78	H137	120.1°	90.0°
N26	C77	C79	H137	117.8°	90.0°
N26	C77	C78	O19	148.7°	90.0°
N26	C77	C79	C80	67.3°	90.0°
N26	C77	C79	H138	53.5°	90.0°
N26	C77	C79	H139	171.9°	90.0°
N26	C77	C78	N28	31.9°	90.0°
H136	N26	C77	C78	117.3°	90.0°
H136	N26	C77	C79	5.8°	90.0°
H136	N26	C77	H137	123.1°	90.0°
C78	C77	C79	H137	116.5°	90.0°
C77	C78	O19	N28	179.5°	90.0°
C78	C77	C79	C80	167.0°	90.0°
C78	C77	C79	H138	72.2°	90.0°
C78	C77	C79	H139	46.1°	90.0°
C77	C78	N28	C83	179.5°	90.0°
C77	C78	N28	H149	0.5°	90.0°
C78	C77	N26	C72	62.7°	90.0°
C79	C77	C78	O19	87.9°	90.0°
C77	C79	C80	H138	120.8°	90.0°
C77	C79	C80	H139	120.8°	90.0°
C77	C79	H138	H139	117.5°	90.0°
C77	C79	C80	C81	74.6°	90.0°
C77	C79	C80	H140	45.6°	90.0°
C77	C79	C80	H141	165.2°	90.0°
C79	C77	N26	C72	174.2°	90.0°
C79	C77	C78	N28	91.6°	90.0°
H137	C77	C78	O19	28.6°	90.0°
H137	C77	C79	C80	50.5°	90.0°
H137	C77	C79	H138	171.3°	90.0°
H137	C77	C79	H139	70.3°	90.0°
H137	C77	N26	C72	56.9°	90.0°
H137	C77	C78	N28	152.0°	90.0°
O19	C78	N28	C83	1.1°	90.0°
O19	C78	N28	H149	178.9°	90.0°
C80	C79	H138	H139	117.5°	90.0°
C79	C80	C81	H140	120.2°	90.0°
C79	C80	C81	H141	120.2°	90.0°
C79	C80	H140	H141	119.3°	90.0°
C79	C80	C81	C82	68.2°	90.0°
C79	C80	C81	H142	168.7°	90.0°
C79	C80	C81	H143	54.9°	90.0°
H138	C79	C80	C81	164.6°	90.0°
H138	C79	C80	H140	75.2°	90.0°
H138	C79	C80	H141	44.3°	90.0°
H139	C79	C80	C81	46.2°	90.0°
H139	C79	C80	H140	166.4°	90.0°
H139	C79	C80	H141	74.0°	90.0°
C81	C80	H140	H141	119.3°	90.0°
C80	C81	C82	H142	123.1°	90.0°
C80	C81	C82	H143	123.1°	90.0°
C80	C81	H142	H143	108.8°	90.0°
C80	C81	C82	N27	90.0°	90.0°
C80	C81	C82	H144	90.0°	90.0°
C80	C81	C82	H145	90.0°	90.0°
H140	C80	C81	C82	52.0°	90.0°
H140	C80	C81	H142	71.1°	90.0°
H140	C80	C81	H143	175.1°	90.0°
H141	C80	C81	C82	171.6°	90.0°
H141	C80	C81	H142	48.4°	90.0°
H141	C80	C81	H143	65.3°	90.0°
C82	C81	H142	H143	108.8°	90.0°
C81	C82	N27	H144	90.0°	90.0°
C81	C82	N27	H145	90.0°	90.0°
C81	C82	H144	H145	90.0°	90.0°
C81	C82	N27	H146	90.0°	90.0°
C81	C82	N27	H147	90.0°	90.0°
C81	C82	N27	H148	90.0°	90.0°
H142	C81	C82	N27	90.0°	90.0°
H142	C81	C82	H144	90.0°	90.0°
H142	C81	C82	H145	90.0°	90.0°
H143	C81	C82	N27	90.0°	90.0°
H143	C81	C82	H144	90.0°	90.0°
H143	C81	C82	H145	90.0°	90.0°
N27	C82	H144	H145	90.0°	90.0°
C82	N27	H146	H147	90.0°	90.0°
C82	N27	H146	H148	90.0°	90.0°
C82	N27	H147	H148	90.0°	90.0°
H144	C82	N27	H146	90.0°	90.0°
H144	C82	N27	H147	90.0°	90.0°
H144	C82	N27	H148	90.0°	90.0°
H145	C82	N27	H146	90.0°	90.0°
H145	C82	N27	H147	90.0°	90.0°
H145	C82	N27	H148	90.0°	90.0°
H146	N27	H147	H148	90.0°	90.0°
C83	N28	H149	C78	180.0°	90.0°
N28	C83	C84	C85	119.9°	90.0°
N28	C83	C84	H150	121.4°	90.0°
N28	C83	C85	H150	122.6°	90.0°
N28	C83	C84	O20	133.2°	90.0°
N28	C83	C85	C86	80.3°	90.0°
N28	C83	C85	H151	40.8°	90.0°
N28	C83	C85	H152	158.6°	90.0°
N28	C83	C84	N29	47.8°	90.0°
H149	N28	C83	C84	117.0°	90.0°
H149	N28	C83	C85	0.3°	90.0°
H149	N28	C83	H150	121.9°	90.0°
C84	C83	C85	H150	119.0°	90.0°
C83	C84	O20	N29	178.8°	90.0°
C84	C83	C85	C86	161.3°	90.0°
C84	C83	C85	H151	77.6°	90.0°
C84	C83	C85	H152	40.2°	90.0°
C83	C84	N29	C88	175.3°	90.0°
C83	C84	N29	H158	4.7°	90.0°
C84	C83	N28	C78	63.0°	90.0°
C85	C83	C84	O20	106.9°	90.0°
C83	C85	C86	H151	121.1°	90.0°
C83	C85	C86	H152	121.1°	90.0°
C83	C85	H151	H152	116.7°	90.0°
C83	C85	C86	S1	172.8°	90.0°
C83	C85	C86	H153	67.4°	90.0°
C83	C85	C86	H154	53.0°	90.0°
C85	C83	N28	C78	179.7°	90.0°
C85	C83	C84	N29	72.0°	90.0°
H150	C83	C84	O20	11.9°	90.0°
H150	C83	C85	C86	42.3°	90.0°
H150	C83	C85	H151	163.4°	90.0°
H150	C83	C85	H152	78.8°	90.0°
H150	C83	N28	C78	58.1°	90.0°
H150	C83	C84	N29	169.2°	90.0°
O20	C84	N29	C88	5.8°	90.0°
O20	C84	N29	H158	174.2°	90.0°
C86	C85	H151	H152	116.7°	90.0°
C85	C86	S1	H153	119.8°	90.0°
C85	C86	S1	H154	119.8°	90.0°
C85	C86	H153	H154	120.6°	90.0°
C85	C86	S1	C87	135.9°	90.0°
H151	C85	C86	S1	51.7°	90.0°
H151	C85	C86	H153	171.5°	90.0°
H151	C85	C86	H154	68.0°	90.0°
H152	C85	C86	S1	66.1°	90.0°
H152	C85	C86	H153	53.7°	90.0°
H152	C85	C86	H154	174.1°	90.0°
S1	C86	H153	H154	120.6°	90.0°
C86	S1	C87	H155	180.0°	90.0°
C86	S1	C87	H156	60.0°	90.0°
C86	S1	C87	H157	60.0°	90.0°
H153	C86	S1	C87	104.3°	90.0°
H154	C86	S1	C87	16.2°	90.0°
S1	C87	H155	H156	120.0°	90.0°
S1	C87	H155	H157	120.0°	90.0°
S1	C87	H156	H157	120.0°	90.0°
H155	C87	H156	H157	120.0°	90.0°
C88	N29	H158	C84	180.0°	90.0°
N29	C88	C89	C90	119.4°	90.0°
N29	C88	C89	H159	121.7°	90.0°
N29	C88	C90	H159	121.7°	90.0°
N29	C88	C89	O21	85.8°	90.0°
N29	C88	C89	O22	155.2°	90.0°
N29	C88	C90	C91	173.3°	90.0°
N29	C88	C90	C92	51.2°	90.0°
N29	C88	C90	H160	67.3°	90.0°
H158	N29	C88	C89	108.2°	90.0°
H158	N29	C88	C90	9.4°	90.0°
H158	N29	C88	H159	130.6°	90.0°
C89	C88	C90	H159	119.0°	90.0°
C88	C89	O21	O22	142.0°	90.0°
C89	C88	C90	C91	67.4°	90.0°
C89	C88	C90	C92	170.5°	90.0°
C89	C88	C90	H160	52.0°	90.0°
C88	C89	O22	H167	90.0°	90.0°
C89	C88	N29	C84	71.8°	90.0°
C90	C88	C89	O21	33.6°	90.0°
C90	C88	C89	O22	35.9°	90.0°
C88	C90	C91	C92	121.5°	90.0°
C88	C90	C91	H160	119.2°	90.0°
C88	C90	C92	H160	118.5°	90.0°
C88	C90	C91	H161	180.0°	90.0°
C88	C90	C91	H162	60.0°	90.0°
C88	C90	C91	H163	60.0°	90.0°
C88	C90	C92	H164	180.0°	90.0°
C88	C90	C92	H165	60.0°	90.0°
C88	C90	C92	H166	60.0°	90.0°
C90	C88	N29	C84	170.6°	90.0°
H159	C88	C89	O21	152.5°	90.0°
H159	C88	C89	O22	83.1°	90.0°
H159	C88	C90	C91	51.6°	90.0°
H159	C88	C90	C92	70.5°	90.0°
H159	C88	C90	H160	170.9°	90.0°
H159	C88	N29	C84	49.4°	90.0°
O21	C89	O22	H167	90.0°	90.0°
C91	C90	C92	H160	119.5°	90.0°
C90	C91	H161	H162	120.0°	90.0°
C90	C91	H161	H163	120.0°	90.0°
C90	C91	H162	H163	120.0°	90.0°
C91	C90	C92	H164	58.0°	90.0°
C91	C90	C92	H165	62.0°	90.0°
C91	C90	C92	H166	178.0°	90.0°
C92	C90	C91	H161	58.5°	90.0°
C92	C90	C91	H162	178.5°	90.0°
C92	C90	C91	H163	61.5°	90.0°
C90	C92	H164	H165	120.0°	90.0°
C90	C92	H164	H166	120.0°	90.0°
C90	C92	H165	H166	120.0°	90.0°
H160	C90	C91	H161	60.8°	90.0°
H160	C90	C91	H162	59.2°	90.0°
H160	C90	C91	H163	179.2°	90.0°
H160	C90	C92	H164	61.5°	90.0°
H160	C90	C92	H165	178.5°	90.0°
H160	C90	C92	H166	58.5°	90.0°
H161	C91	H162	H163	120.0°	90.0°
H164	C92	H165	H166	120.0°	90.0°

Release date:	2013-11-06
Last modified:	2013-11-06
Processing site:	RCSB