PRD_000749

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	C1	sing	1.47Å	1.45Å
N1	H1	sing	0.97Å	1.00Å
C1	C2	sing	1.51Å	1.53Å
C1	C3	sing	1.53Å	1.53Å
C1	H2	sing	1.09Å	1.10Å
C2	O1	doub	1.21Å	1.23Å
C3	C4	sing	1.51Å	1.53Å
C3	H3	sing	1.09Å	1.10Å
C3	H4	sing	1.09Å	1.10Å
C4	O2	doub	1.21Å	1.22Å
C4	N2	sing	1.35Å	1.33Å
N2	H5	sing	0.97Å	1.00Å
N2	H6	sing	0.97Å	1.00Å
N3	C5	sing	1.46Å	1.45Å
N3	H7	sing	0.97Å	1.00Å
C5	C6	sing	1.51Å	1.53Å
C5	H8	sing	1.09Å	1.10Å
C5	H9	sing	1.09Å	1.10Å
C6	O3	doub	1.21Å	1.23Å
N4	C7	sing	1.46Å	1.45Å
N4	H10	sing	0.97Å	1.00Å
C7	C8	sing	1.51Å	1.53Å
C7	C9	sing	1.53Å	1.53Å
C7	H11	sing	1.09Å	1.10Å
C8	O4	doub	1.21Å	1.23Å
C9	C10	sing	1.53Å	1.53Å
C9	H12	sing	1.09Å	1.10Å
C9	H13	sing	1.09Å	1.10Å
C10	C11	sing	1.53Å	1.53Å
C10	C12	sing	1.53Å	1.53Å
C10	H14	sing	1.09Å	1.10Å
C11	H15	sing	1.09Å	1.10Å
C11	H16	sing	1.09Å	1.10Å
C11	H17	sing	1.09Å	1.10Å
C12	H18	sing	1.09Å	1.10Å
C12	H19	sing	1.09Å	1.10Å
C12	H20	sing	1.09Å	1.10Å
N5	C13	sing	1.47Å	1.45Å
N5	C17	sing	1.46Å	1.46Å
C13	C14	sing	1.51Å	1.53Å
C13	C15	sing	1.53Å	1.52Å
C13	H21	sing	1.09Å	1.10Å
C14	O5	doub	1.21Å	1.23Å
C15	C16	sing	1.54Å	1.52Å
C15	H22	sing	1.09Å	1.10Å
C15	H23	sing	1.09Å	1.10Å
C16	C17	sing	1.53Å	1.52Å
C16	H24	sing	1.09Å	1.10Å
C16	H25	sing	1.09Å	1.10Å
C17	H26	sing	1.09Å	1.10Å
C17	H27	sing	1.09Å	1.10Å
N6	C18	sing	1.47Å	1.45Å
N6	H28	sing	0.97Å	1.00Å
C18	C19	sing	1.51Å	1.53Å
C18	C20	sing	1.53Å	1.53Å
C18	H29	sing	1.09Å	1.10Å
C19	O6	doub	1.21Å	1.23Å
C20	C21	sing	1.53Å	1.53Å
C20	C22	sing	1.53Å	1.53Å
C20	H30	sing	1.09Å	1.10Å
C21	H31	sing	1.09Å	1.10Å
C21	H32	sing	1.09Å	1.10Å
C21	H33	sing	1.09Å	1.10Å
C22	H34	sing	1.09Å	1.10Å
C22	H35	sing	1.09Å	1.10Å
C22	H36	sing	1.09Å	1.10Å
N7	C23	sing	1.46Å	1.45Å
N7	H37	sing	0.98Å	1.00Å
C23	C24	sing	1.51Å	1.53Å
C23	C25	sing	1.53Å	1.53Å
C23	H38	sing	1.09Å	1.10Å
C24	O7	doub	1.21Å	1.23Å
C25	S1	sing	1.82Å	1.83Å
C25	H39	sing	1.09Å	1.10Å
C25	H40	sing	1.09Å	1.10Å
N8	C26	sing	1.46Å	1.45Å
N8	H41	sing	0.97Å	1.00Å
C26	C27	sing	1.51Å	1.53Å
C26	H42	sing	1.09Å	1.10Å
C26	H43	sing	1.09Å	1.10Å
C27	O8	doub	1.21Å	1.23Å
N9	C28	sing	1.46Å	1.45Å
N9	H44	sing	0.97Å	1.00Å
C28	C29	sing	1.51Å	1.53Å
C28	C30	sing	1.53Å	1.53Å
C28	H45	sing	1.09Å	1.10Å
C29	O9	doub	1.21Å	1.23Å
C30	C31	sing	1.53Å	1.53Å
C30	H46	sing	1.09Å	1.10Å
C30	H47	sing	1.09Å	1.10Å
C31	C32	sing	1.51Å	1.53Å
C31	H48	sing	1.09Å	1.10Å
C31	H49	sing	1.09Å	1.10Å
C32	O10	doub	1.21Å	1.24Å
C32	O11	sing	1.34Å	1.29Å
O11	H50	sing	0.97Å	0.95Å
N10	C33	sing	1.46Å	1.45Å
N10	H51	sing	0.97Å	1.00Å
C33	C34	sing	1.51Å	1.53Å
C33	C35	sing	1.53Å	1.53Å
C33	H52	sing	1.09Å	1.10Å
C34	O12	doub	1.21Å	1.23Å
C35	O13	sing	1.43Å	1.43Å
C35	C36	sing	1.53Å	1.53Å
C35	H53	sing	1.09Å	1.10Å
O13	H54	sing	0.97Å	0.95Å
C36	H55	sing	1.09Å	1.10Å
C36	H56	sing	1.09Å	1.10Å
C36	H57	sing	1.09Å	1.10Å
N11	C37	sing	1.46Å	1.45Å
N11	H58	sing	0.97Å	1.00Å
C37	C38	sing	1.51Å	1.53Å
C37	C39	sing	1.53Å	1.53Å
C37	H59	sing	1.09Å	1.10Å
C38	O14	doub	1.21Å	1.23Å
C39	S2	sing	1.81Å	1.83Å
C39	H60	sing	1.09Å	1.10Å
C39	H61	sing	1.09Å	1.10Å
N12	C40	sing	1.46Å	1.45Å
N12	H62	sing	0.98Å	1.00Å
C40	C41	sing	1.50Å	1.53Å
C40	C42	sing	1.53Å	1.53Å
C40	H63	sing	1.10Å	1.10Å
C41	O15	doub	1.21Å	1.23Å
C42	C43	sing	1.53Å	1.53Å
C42	C44	sing	1.53Å	1.53Å
C42	H64	sing	1.09Å	1.10Å
C43	H65	sing	1.09Å	1.10Å
C43	H66	sing	1.09Å	1.10Å
C43	H67	sing	1.09Å	1.10Å
C44	H68	sing	1.09Å	1.10Å
C44	H69	sing	1.09Å	1.10Å
C44	H70	sing	1.09Å	1.10Å
N13	C45	sing	1.46Å	1.45Å
N13	H71	sing	0.97Å	1.00Å
C45	C46	sing	1.51Å	1.53Å
C45	H72	sing	1.09Å	1.10Å
C45	H73	sing	1.09Å	1.10Å
C46	O16	doub	1.22Å	1.23Å
N14	C47	sing	1.47Å	1.45Å
N14	H74	sing	0.97Å	1.00Å
C47	C48	sing	1.51Å	1.53Å
C47	H75	sing	1.09Å	1.10Å
C47	H76	sing	1.09Å	1.10Å
C48	O17	doub	1.21Å	1.23Å
N15	C49	sing	1.47Å	1.45Å
N15	H77	sing	0.97Å	1.00Å
C49	C50	sing	1.50Å	1.53Å
C49	C51	sing	1.53Å	1.53Å
C49	H78	sing	1.10Å	1.10Å
C50	O18	doub	1.22Å	1.23Å
C51	O19	sing	1.43Å	1.43Å
C51	C52	sing	1.53Å	1.53Å
C51	H79	sing	1.09Å	1.10Å
O19	H80	sing	0.97Å	0.95Å
C52	H81	sing	1.09Å	1.10Å
C52	H82	sing	1.09Å	1.10Å
C52	H83	sing	1.09Å	1.10Å
N16	C53	sing	1.47Å	1.45Å
N16	H84	sing	0.98Å	1.00Å
C53	C54	sing	1.50Å	1.53Å
C53	C55	sing	1.52Å	1.53Å
C53	H85	sing	1.10Å	1.10Å
C54	O20	doub	1.21Å	1.23Å
C55	S3	sing	1.81Å	1.83Å
C55	H86	sing	1.09Å	1.10Å
C55	H87	sing	1.09Å	1.10Å
N17	C56	sing	1.46Å	1.45Å
N17	H88	sing	0.97Å	1.00Å
C56	C57	sing	1.51Å	1.53Å
C56	C58	sing	1.53Å	1.53Å
C56	H89	sing	1.09Å	1.10Å
C57	O21	doub	1.21Å	1.23Å
C58	C59	sing	1.51Å	1.53Å
C58	H90	sing	1.09Å	1.10Å
C58	H91	sing	1.09Å	1.10Å
C59	O22	doub	1.21Å	1.22Å
C59	N18	sing	1.35Å	1.33Å
N18	H92	sing	0.97Å	1.00Å
N18	H93	sing	0.97Å	1.00Å
N19	C60	sing	1.46Å	1.45Å
N19	H94	sing	0.98Å	1.00Å
C60	C61	sing	1.48Å	1.53Å
C60	C62	sing	1.53Å	1.53Å
C60	H95	sing	1.10Å	1.10Å
C61	O23	doub	1.23Å	1.23Å
C62	O24	sing	1.43Å	1.42Å
C62	C63	sing	1.53Å	1.53Å
C62	H96	sing	1.09Å	1.10Å
O24	H97	sing	0.97Å	0.95Å
C63	H98	sing	1.09Å	1.10Å
C63	H99	sing	1.09Å	1.10Å
C63	H100	sing	1.09Å	1.10Å
N20	C64	sing	1.47Å	1.45Å
N20	C68	sing	1.48Å	1.46Å
C64	C65	sing	1.50Å	1.53Å
C64	C66	sing	1.54Å	1.52Å
C64	H101	sing	1.09Å	1.10Å
C65	O25	doub	1.22Å	1.23Å
C66	C67	sing	1.54Å	1.52Å
C66	H102	sing	1.09Å	1.10Å
C66	H103	sing	1.09Å	1.10Å
C67	C68	sing	1.54Å	1.52Å
C67	H104	sing	1.09Å	1.10Å
C67	H105	sing	1.09Å	1.10Å
C68	H106	sing	1.09Å	1.10Å
C68	H107	sing	1.09Å	1.10Å
N21	C69	sing	1.46Å	1.45Å
N21	H108	sing	0.97Å	1.00Å
C69	C70	sing	1.51Å	1.53Å
C69	H109	sing	1.09Å	1.10Å
C69	H110	sing	1.09Å	1.10Å
C70	O26	doub	1.21Å	1.23Å
N22	C71	sing	1.46Å	1.45Å
N22	H111	sing	0.99Å	1.00Å
C71	C72	sing	1.50Å	1.53Å
C71	C73	sing	1.53Å	1.53Å
C71	H112	sing	1.10Å	1.10Å
C72	O27	doub	1.21Å	1.23Å
C73	S4	sing	1.82Å	1.83Å
C73	H113	sing	1.09Å	1.10Å
C73	H114	sing	1.10Å	1.10Å
N23	C74	sing	1.46Å	1.45Å
N23	H115	sing	0.97Å	1.00Å
C74	C75	sing	1.51Å	1.53Å
C74	C76	sing	1.53Å	1.53Å
C74	H116	sing	1.09Å	1.10Å
C75	O28	doub	1.21Å	1.23Å
C76	O29	sing	1.43Å	1.43Å
C76	C77	sing	1.53Å	1.53Å
C76	H117	sing	1.09Å	1.10Å
O29	H118	sing	0.97Å	0.95Å
C77	H119	sing	1.09Å	1.10Å
C77	H120	sing	1.09Å	1.10Å
C77	H121	sing	1.09Å	1.10Å
N24	C78	sing	1.46Å	1.45Å
N24	H122	sing	0.98Å	1.00Å
C78	C79	sing	1.51Å	1.53Å
C78	C80	sing	1.53Å	1.53Å
C78	H123	sing	1.10Å	1.10Å
C79	O30	doub	1.21Å	1.23Å
C80	S5	sing	1.82Å	1.83Å
C80	H124	sing	1.09Å	1.10Å
C80	H125	sing	1.09Å	1.10Å
N25	C81	sing	1.46Å	1.45Å
N25	H126	sing	0.97Å	1.00Å
C81	C82	sing	1.50Å	1.53Å
C81	C83	sing	1.53Å	1.53Å
C81	H127	sing	1.09Å	1.10Å
C82	O31	doub	1.21Å	1.23Å
C83	O32	sing	1.43Å	1.42Å
C83	H128	sing	1.09Å	1.10Å
C83	H129	sing	1.09Å	1.10Å
O32	H130	sing	0.97Å	0.95Å
N26	C84	sing	1.46Å	1.45Å
N26	H131	sing	0.97Å	1.00Å
C84	C85	sing	1.51Å	1.53Å
C84	C86	sing	1.53Å	1.53Å
C84	H132	sing	1.09Å	1.10Å
C85	O33	doub	1.22Å	1.23Å
C86	C87	sing	1.51Å	1.53Å
C86	H133	sing	1.09Å	1.10Å
C86	H134	sing	1.09Å	1.10Å
C87	C88	doub	1.34Å	1.34Å	Aromatic
C87	C89	sing	1.47Å	1.44Å	Aromatic
C88	N27	sing	1.37Å	1.38Å	Aromatic
C88	H135	sing	1.08Å	1.08Å
C89	C90	doub	1.41Å	1.38Å	Aromatic
C89	C91	sing	1.40Å	1.41Å	Aromatic
N27	C90	sing	1.38Å	1.39Å	Aromatic
N27	H136	sing	0.97Å	1.00Å
C90	C92	sing	1.39Å	1.40Å	Aromatic
C91	C93	doub	1.37Å	1.40Å	Aromatic
C91	H137	sing	1.08Å	1.08Å
C92	C94	doub	1.38Å	1.40Å	Aromatic
C92	H138	sing	1.08Å	1.08Å
C93	C94	sing	1.39Å	1.39Å	Aromatic
C93	H139	sing	1.08Å	1.08Å
C94	H140	sing	1.08Å	1.08Å
N28	C95	sing	1.46Å	1.45Å
N28	C99	sing	1.47Å	1.46Å
C95	C96	sing	1.49Å	1.53Å
C95	C97	sing	1.54Å	1.52Å
C95	H141	sing	1.10Å	1.10Å
C96	O34	doub	1.21Å	1.23Å
C97	C98	sing	1.54Å	1.52Å
C97	H142	sing	1.09Å	1.10Å
C97	H143	sing	1.09Å	1.10Å
C98	C99	sing	1.53Å	1.52Å
C98	H144	sing	1.09Å	1.10Å
C98	H145	sing	1.09Å	1.10Å
C99	H146	sing	1.09Å	1.10Å
C99	H147	sing	1.09Å	1.10Å
N29	C100	sing	1.46Å	1.45Å
N29	H148	sing	0.97Å	1.00Å
C100	C101	sing	1.49Å	1.53Å
C100	C102	sing	1.53Å	1.53Å
C100	H149	sing	1.10Å	1.10Å
C101	O35	doub	1.22Å	1.23Å
C102	C103	sing	1.53Å	1.53Å
C102	C104	sing	1.53Å	1.53Å
C102	H150	sing	1.09Å	1.10Å
C103	H151	sing	1.09Å	1.10Å
C103	H152	sing	1.09Å	1.10Å
C103	H153	sing	1.09Å	1.10Å
C104	H154	sing	1.09Å	1.10Å
C104	H155	sing	1.09Å	1.10Å
C104	H156	sing	1.09Å	1.10Å
N30	C105	sing	1.47Å	1.45Å
N30	H157	sing	0.97Å	1.00Å
C105	C106	sing	1.51Å	1.53Å
C105	C107	sing	1.54Å	1.53Å
C105	H158	sing	1.08Å	1.10Å
C106	O36	doub	1.21Å	1.23Å
C107	S6	sing	1.82Å	1.83Å
C107	H159	sing	1.09Å	1.10Å
C107	H160	sing	1.09Å	1.10Å
N31	C108	sing	1.46Å	1.45Å
N31	H161	sing	0.97Å	1.00Å
C108	C109	sing	1.51Å	1.53Å
C108	C110	sing	1.53Å	1.53Å
C108	H162	sing	1.09Å	1.10Å
C109	O37	doub	1.21Å	1.23Å
C110	O38	sing	1.43Å	1.42Å
C110	C111	sing	1.53Å	1.53Å
C110	H163	sing	1.09Å	1.10Å
O38	H164	sing	0.97Å	0.95Å
C111	H165	sing	1.09Å	1.10Å
C111	H166	sing	1.09Å	1.10Å
C111	H167	sing	1.09Å	1.10Å
N32	C112	sing	1.46Å	1.45Å
N32	H168	sing	0.97Å	1.00Å
C112	C113	sing	1.51Å	1.53Å
C112	C114	sing	1.53Å	1.53Å
C112	H169	sing	1.09Å	1.10Å
C113	O39	doub	1.21Å	1.23Å
C114	C115	sing	1.53Å	1.53Å
C114	H170	sing	1.09Å	1.10Å
C114	H171	sing	1.09Å	1.10Å
C115	C116	sing	1.53Å	1.53Å
C115	H172	sing	1.09Å	1.10Å
C115	H173	sing	1.09Å	1.10Å
C116	N33	sing	1.47Å	1.48Å
C116	H174	sing	1.09Å	1.10Å
C116	H175	sing	1.09Å	1.10Å
N33	C117	sing	1.37Å	1.34Å
N33	H176	sing	0.97Å	1.00Å
C117	N34	sing	1.33Å	1.34Å
C117	N35	doub	1.33Å	1.34Å
N34	H177	sing	0.97Å	1.00Å
N34	H178	sing	0.97Å	1.00Å
N35	H179	sing	0.97Å	1.00Å
N35	H180	sing	0.97Å	1.00Å
C2	N3	sing	1.35Å	1.32Å
C6	N4	sing	1.35Å	1.33Å
C8	N5	sing	1.35Å	1.36Å
C14	N6	sing	1.35Å	1.32Å
C19	N7	sing	1.35Å	1.32Å
C24	N8	sing	1.35Å	1.32Å
C27	N9	sing	1.35Å	1.33Å
C29	N10	sing	1.35Å	1.32Å
C34	N11	sing	1.35Å	1.32Å
C38	N12	sing	1.34Å	1.32Å
C41	N13	sing	1.35Å	1.33Å
C46	N14	sing	1.35Å	1.33Å
C48	N15	sing	1.35Å	1.33Å
C50	N16	sing	1.34Å	1.32Å
C54	N17	sing	1.35Å	1.33Å
C57	N19	sing	1.35Å	1.32Å
C61	N20	sing	1.32Å	1.36Å
C65	N21	sing	1.33Å	1.32Å
C70	N22	sing	1.33Å	1.32Å
C72	N23	sing	1.34Å	1.33Å
C75	N24	sing	1.35Å	1.32Å
C79	N25	sing	1.35Å	1.33Å
C82	N26	sing	1.35Å	1.32Å
C85	N28	sing	1.35Å	1.36Å
C96	N29	sing	1.35Å	1.32Å
C101	N30	sing	1.34Å	1.33Å
C106	N31	sing	1.35Å	1.32Å
C109	N32	sing	1.35Å	1.32Å
N1	C113	sing	1.35Å	1.37Å
S1	S6	sing	2.05Å	1.98Å
S2	S5	sing	2.05Å	2.11Å
S3	S4	sing	2.05Å	2.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	N1	H1	113.5°	119.7°
N1	C1	C2	109.4°	109.7°
N1	C1	C3	111.1°	109.1°
N1	C1	H2	110.2°	109.6°
C1	N1	C113	133.1°	120.7°
H1	N1	C113	113.5°	119.6°
C2	C1	C3	108.0°	109.4°
C2	C1	H2	109.1°	109.5°
C1	C2	O1	120.6°	119.8°
C1	C2	N3	114.9°	120.2°
C3	C1	H2	109.1°	109.5°
C1	C3	C4	111.0°	109.5°
C1	C3	H3	109.1°	109.4°
C1	C3	H4	109.1°	109.4°
O1	C2	N3	124.5°	120.0°
C4	C3	H3	109.1°	109.5°
C4	C3	H4	109.1°	109.5°
C3	C4	O2	122.0°	120.0°
C3	C4	N2	114.0°	120.0°
H3	C3	H4	109.5°	109.5°
O2	C4	N2	124.0°	120.0°
C4	N2	H5	120.0°	120.0°
C4	N2	H6	120.0°	120.0°
H5	N2	H6	120.0°	120.0°
C5	N3	H7	119.5°	119.5°
N3	C5	C6	111.0°	109.7°
N3	C5	H8	109.1°	109.8°
N3	C5	H9	109.1°	109.3°
C5	N3	C2	121.0°	120.3°
H7	N3	C2	119.5°	120.2°
C6	C5	H8	109.1°	109.5°
C6	C5	H9	109.1°	109.2°
C5	C6	O3	120.5°	119.5°
C5	C6	N4	115.0°	120.1°
H8	C5	H9	109.5°	109.3°
O3	C6	N4	124.4°	120.4°
C7	N4	H10	119.5°	119.7°
N4	C7	C8	109.3°	109.9°
N4	C7	C9	110.5°	109.0°
N4	C7	H11	108.4°	109.7°
C7	N4	C6	121.0°	121.0°
H10	N4	C6	119.5°	119.4°
C8	C7	C9	113.7°	109.1°
C8	C7	H11	107.4°	109.6°
C7	C8	O4	120.5°	119.3°
C7	C8	N5	115.0°	121.4°
C9	C7	H11	107.4°	109.6°
C7	C9	C10	116.0°	109.5°
C7	C9	H12	107.8°	109.5°
C7	C9	H13	107.8°	109.4°
O4	C8	N5	124.5°	119.3°
C10	C9	H12	107.8°	109.5°
C10	C9	H13	107.8°	109.4°
C9	C10	C11	111.0°	109.4°
C9	C10	C12	111.0°	109.5°
C9	C10	H14	107.5°	109.4°
H12	C9	H13	109.5°	109.5°
C11	C10	C12	112.0°	109.5°
C11	C10	H14	107.6°	109.5°
C10	C11	H15	109.5°	109.5°
C10	C11	H16	109.5°	109.4°
C10	C11	H17	109.5°	109.5°
C12	C10	H14	107.6°	109.5°
C10	C12	H18	109.5°	109.4°
C10	C12	H19	109.5°	109.4°
C10	C12	H20	109.5°	109.4°
H15	C11	H16	109.4°	109.5°
H15	C11	H17	109.4°	109.5°
H16	C11	H17	109.5°	109.5°
H18	C12	H19	109.5°	109.5°
H18	C12	H20	109.5°	109.5°
H19	C12	H20	109.4°	109.5°
C13	N5	C17	113.1°	109.2°
N5	C13	C14	111.0°	109.4°
N5	C13	C15	104.9°	108.3°
N5	C13	H21	109.9°	109.7°
C13	N5	C8	121.0°	124.7°
N5	C17	C16	104.7°	108.0°
N5	C17	H26	110.7°	109.9°
N5	C17	H27	110.7°	109.8°
C17	N5	C8	125.9°	126.1°
C14	C13	C15	113.0°	109.9°
C14	C13	H21	108.9°	109.9°
C13	C14	O5	120.6°	119.4°
C13	C14	N6	115.0°	120.6°
C15	C13	H21	109.0°	109.7°
C13	C15	C16	105.9°	106.3°
C13	C15	H22	110.3°	110.0°
C13	C15	H23	110.3°	110.3°
O5	C14	N6	124.4°	120.0°
C16	C15	H22	110.4°	109.9°
C16	C15	H23	110.4°	110.3°
C15	C16	C17	107.8°	105.7°
C15	C16	H24	109.9°	110.2°
C15	C16	H25	109.9°	110.3°
H22	C15	H23	109.5°	110.0°
C17	C16	H24	109.9°	110.2°
C17	C16	H25	109.9°	110.3°
C16	C17	H26	110.6°	109.7°
C16	C17	H27	110.6°	109.7°
H24	C16	H25	109.5°	110.1°
H26	C17	H27	109.5°	109.7°
C18	N6	H28	119.5°	120.0°
N6	C18	C19	109.3°	109.9°
N6	C18	C20	110.0°	108.8°
N6	C18	H29	108.8°	109.6°
C18	N6	C14	121.0°	120.0°
H28	N6	C14	119.5°	120.1°
C19	C18	C20	113.0°	109.6°
C19	C18	H29	107.8°	109.4°
C18	C19	O6	120.5°	119.6°
C18	C19	N7	115.0°	119.7°
C20	C18	H29	107.8°	109.5°
C18	C20	C21	111.0°	109.5°
C18	C20	C22	111.0°	109.5°
C18	C20	H30	107.9°	109.5°
O6	C19	N7	124.5°	120.7°
C21	C20	C22	110.9°	109.5°
C21	C20	H30	107.9°	109.4°
C20	C21	H31	109.5°	109.5°
C20	C21	H32	109.5°	109.4°
C20	C21	H33	109.5°	109.5°
C22	C20	H30	107.9°	109.5°
C20	C22	H34	109.5°	109.5°
C20	C22	H35	109.4°	109.5°
C20	C22	H36	109.5°	109.5°
H31	C21	H32	109.5°	109.4°
H31	C21	H33	109.5°	109.5°
H32	C21	H33	109.4°	109.5°
H34	C22	H35	109.5°	109.5°
H34	C22	H36	109.5°	109.5°
H35	C22	H36	109.5°	109.4°
C23	N7	H37	119.5°	118.5°
N7	C23	C24	108.3°	111.3°
N7	C23	C25	111.8°	109.3°
N7	C23	H38	108.9°	109.4°
C23	N7	C19	121.1°	122.1°
H37	N7	C19	119.5°	119.4°
C24	C23	C25	111.8°	108.8°
C24	C23	H38	107.9°	108.9°
C23	C24	O7	120.5°	120.7°
C23	C24	N8	115.0°	118.7°
C25	C23	H38	108.0°	109.1°
C23	C25	S1	114.8°	109.5°
C23	C25	H39	108.1°	109.3°
C23	C25	H40	108.1°	109.5°
O7	C24	N8	124.5°	120.6°
S1	C25	H39	108.1°	109.4°
S1	C25	H40	108.1°	109.5°
C25	S1	S6	83.3°	103.3°
H39	C25	H40	109.5°	109.7°
C26	N8	H41	119.6°	119.5°
N8	C26	C27	111.0°	109.1°
N8	C26	H42	109.1°	109.9°
N8	C26	H43	109.1°	109.5°
C26	N8	C24	120.9°	121.4°
H41	N8	C24	119.5°	119.1°
C27	C26	H42	109.1°	109.5°
C27	C26	H43	109.1°	109.4°
C26	C27	O8	120.5°	119.5°
C26	C27	N9	115.0°	120.4°
H42	C26	H43	109.5°	109.4°
O8	C27	N9	124.5°	120.1°
C28	N9	H44	119.5°	119.9°
N9	C28	C29	110.4°	109.7°
N9	C28	C30	111.0°	109.3°
N9	C28	H45	108.8°	109.7°
C28	N9	C27	121.0°	120.3°
H44	N9	C27	119.5°	119.7°
C29	C28	C30	110.9°	109.2°
C29	C28	H45	107.8°	109.4°
C28	C29	O9	120.4°	119.6°
C28	C29	N10	115.0°	119.9°
C30	C28	H45	107.8°	109.4°
C28	C30	C31	111.0°	109.5°
C28	C30	H46	109.1°	109.5°
C28	C30	H47	109.1°	109.5°
O9	C29	N10	124.6°	120.5°
C31	C30	H46	109.1°	109.5°
C31	C30	H47	109.1°	109.5°
C30	C31	C32	111.0°	109.4°
C30	C31	H48	109.1°	109.5°
C30	C31	H49	109.1°	109.4°
H46	C30	H47	109.5°	109.5°
C32	C31	H48	109.1°	109.5°
C32	C31	H49	109.1°	109.5°
C31	C32	O10	120.0°	120.0°
C31	C32	O11	115.0°	120.0°
H48	C31	H49	109.5°	109.5°
O10	C32	O11	125.1°	120.0°
C32	O11	H50	109.5°	117.0°
C33	N10	H51	119.5°	120.1°
N10	C33	C34	110.5°	111.3°
N10	C33	C35	108.0°	109.2°
N10	C33	H52	109.0°	109.5°
C33	N10	C29	121.0°	120.1°
H51	N10	C29	119.5°	119.9°
C34	C33	C35	113.4°	108.8°
C34	C33	H52	108.0°	109.0°
C33	C34	O12	120.5°	119.8°
C33	C34	N11	115.0°	119.8°
C35	C33	H52	108.0°	109.0°
C33	C35	O13	104.1°	109.5°
C33	C35	C36	112.5°	109.4°
C33	C35	H53	111.4°	109.5°
O12	C34	N11	124.5°	120.3°
O13	C35	C36	104.0°	109.4°
O13	C35	H53	113.1°	109.5°
C35	O13	H54	109.5°	114.0°
C36	C35	H53	111.3°	109.5°
C35	C36	H55	109.5°	109.5°
C35	C36	H56	109.5°	109.5°
C35	C36	H57	109.5°	109.5°
H55	C36	H56	109.5°	109.5°
H55	C36	H57	109.5°	109.4°
H56	C36	H57	109.5°	109.5°
C37	N11	H58	119.5°	120.0°
N11	C37	C38	108.3°	108.6°
N11	C37	C39	111.7°	110.9°
N11	C37	H59	108.9°	109.4°
C37	N11	C34	121.0°	121.3°
H58	N11	C34	119.5°	118.7°
C38	C37	C39	111.9°	109.0°
C38	C37	H59	108.0°	109.0°
C37	C38	O14	120.6°	118.6°
C37	C38	N12	114.9°	119.9°
C39	C37	H59	108.0°	109.9°
C37	C39	S2	114.8°	109.6°
C37	C39	H60	108.1°	109.8°
C37	C39	H61	108.1°	109.1°
O14	C38	N12	124.5°	121.6°
S2	C39	H60	108.1°	109.7°
S2	C39	H61	108.1°	109.2°
C39	S2	S5	92.4°	102.9°
H60	C39	H61	109.5°	109.4°
C40	N12	H62	119.5°	118.0°
N12	C40	C41	109.3°	112.8°
N12	C40	C42	110.0°	110.7°
N12	C40	H63	108.8°	108.0°
C40	N12	C38	120.9°	123.6°
H62	N12	C38	119.6°	118.3°
C41	C40	C42	113.0°	109.8°
C41	C40	H63	107.8°	107.5°
C40	C41	O15	120.5°	120.5°
C40	C41	N13	115.0°	119.5°
C42	C40	H63	107.8°	107.8°
C40	C42	C43	111.0°	109.5°
C40	C42	C44	111.1°	109.5°
C40	C42	H64	107.9°	109.5°
O15	C41	N13	124.6°	120.0°
C43	C42	C44	111.0°	109.5°
C43	C42	H64	107.9°	109.5°
C42	C43	H65	109.5°	109.5°
C42	C43	H66	109.5°	109.5°
C42	C43	H67	109.5°	109.5°
C44	C42	H64	107.9°	109.4°
C42	C44	H68	109.5°	109.4°
C42	C44	H69	109.5°	109.5°
C42	C44	H70	109.5°	109.4°
H65	C43	H66	109.5°	109.5°
H65	C43	H67	109.5°	109.5°
H66	C43	H67	109.5°	109.4°
H68	C44	H69	109.5°	109.5°
H68	C44	H70	109.5°	109.5°
H69	C44	H70	109.4°	109.5°
C45	N13	H71	119.5°	119.8°
N13	C45	C46	111.0°	110.0°
N13	C45	H72	109.1°	109.2°
N13	C45	H73	109.1°	109.6°
C45	N13	C41	121.0°	120.5°
H71	N13	C41	119.5°	119.7°
C46	C45	H72	109.1°	109.3°
C46	C45	H73	109.1°	109.4°
C45	C46	O16	120.5°	120.4°
C45	C46	N14	115.0°	119.2°
H72	C45	H73	109.4°	109.4°
O16	C46	N14	124.5°	120.4°
C47	N14	H74	119.5°	120.4°
N14	C47	C48	111.0°	109.7°
N14	C47	H75	109.1°	109.4°
N14	C47	H76	109.1°	109.8°
C47	N14	C46	121.0°	119.1°
H74	N14	C46	119.5°	120.5°
C48	C47	H75	109.1°	109.2°
C48	C47	H76	109.1°	109.2°
C47	C48	O17	120.5°	119.7°
C47	C48	N15	115.0°	120.1°
H75	C47	H76	109.5°	109.6°
O17	C48	N15	124.5°	120.2°
C49	N15	H77	119.5°	120.1°
N15	C49	C50	110.4°	110.3°
N15	C49	C51	107.9°	109.4°
N15	C49	H78	109.0°	108.3°
C49	N15	C48	121.0°	119.3°
H77	N15	C48	119.5°	120.5°
C50	C49	C51	113.4°	111.6°
C50	C49	H78	108.0°	108.5°
C49	C50	O18	120.5°	117.6°
C49	C50	N16	115.0°	123.7°
C51	C49	H78	108.0°	108.7°
C49	C51	O19	104.1°	109.4°
C49	C51	C52	112.5°	109.5°
C49	C51	H79	111.4°	109.5°
O18	C50	N16	124.5°	118.8°
O19	C51	C52	104.0°	109.5°
O19	C51	H79	113.1°	109.5°
C51	O19	H80	109.5°	114.0°
C52	C51	H79	111.4°	109.5°
C51	C52	H81	109.5°	109.4°
C51	C52	H82	109.5°	109.5°
C51	C52	H83	109.4°	109.5°
H81	C52	H82	109.5°	109.5°
H81	C52	H83	109.5°	109.5°
H82	C52	H83	109.5°	109.5°
C53	N16	H84	119.5°	116.8°
N16	C53	C54	108.4°	109.2°
N16	C53	C55	111.7°	110.7°
N16	C53	H85	108.9°	108.2°
C53	N16	C50	121.0°	121.6°
H84	N16	C50	119.5°	121.6°
C54	C53	C55	111.9°	110.3°
C54	C53	H85	107.9°	108.9°
C53	C54	O20	120.5°	119.8°
C53	C54	N17	115.0°	121.4°
C55	C53	H85	107.9°	109.5°
C53	C55	S3	114.7°	110.2°
C53	C55	H86	108.2°	110.2°
C53	C55	H87	108.2°	109.0°
O20	C54	N17	124.5°	118.8°
S3	C55	H86	108.1°	109.4°
S3	C55	H87	108.1°	109.2°
C55	S3	S4	84.7°	102.9°
H86	C55	H87	109.4°	108.9°
C56	N17	H88	119.5°	120.5°
N17	C56	C57	109.3°	110.3°
N17	C56	C58	111.1°	109.5°
N17	C56	H89	110.2°	109.8°
C56	N17	C54	121.0°	120.2°
H88	N17	C54	119.5°	119.4°
C57	C56	C58	108.0°	108.9°
C57	C56	H89	109.1°	108.6°
C56	C57	O21	120.5°	118.2°
C56	C57	N19	115.0°	119.1°
C58	C56	H89	109.1°	109.6°
C56	C58	C59	111.0°	109.5°
C56	C58	H90	109.1°	109.5°
C56	C58	H91	109.1°	109.5°
O21	C57	N19	124.5°	122.7°
C59	C58	H90	109.1°	109.5°
C59	C58	H91	109.1°	109.5°
C58	C59	O22	122.0°	120.0°
C58	C59	N18	113.9°	120.0°
H90	C58	H91	109.5°	109.5°
O22	C59	N18	124.0°	120.0°
C59	N18	H92	120.0°	120.1°
C59	N18	H93	120.0°	120.0°
H92	N18	H93	120.0°	120.0°
C60	N19	H94	119.5°	118.6°
N19	C60	C61	110.4°	111.0°
N19	C60	C62	108.0°	110.2°
N19	C60	H95	109.0°	107.4°
C60	N19	C57	121.0°	123.0°
H94	N19	C57	119.5°	118.4°
C61	C60	C62	113.4°	111.6°
C61	C60	H95	108.0°	108.6°
C60	C61	O23	120.5°	114.8°
C60	C61	N20	115.0°	131.0°
C62	C60	H95	108.0°	107.8°
C60	C62	O24	104.2°	109.5°
C60	C62	C63	112.5°	109.5°
C60	C62	H96	111.4°	109.5°
O23	C61	N20	124.5°	114.2°
O24	C62	C63	104.0°	109.4°
O24	C62	H96	113.0°	109.4°
C62	O24	H97	109.5°	114.0°
C63	C62	H96	111.3°	109.5°
C62	C63	H98	109.5°	109.5°
C62	C63	H99	109.4°	109.5°
C62	C63	H100	109.5°	109.4°
H98	C63	H99	109.5°	109.5°
H98	C63	H100	109.4°	109.5°
H99	C63	H100	109.5°	109.5°
C64	N20	C68	113.0°	108.0°
N20	C64	C65	111.0°	109.5°
N20	C64	C66	105.0°	108.3°
N20	C64	H101	109.9°	109.6°
C64	N20	C61	121.0°	127.7°
N20	C68	C67	104.7°	105.9°
N20	C68	H106	110.7°	109.7°
N20	C68	H107	110.6°	111.4°
C68	N20	C61	126.0°	124.2°
C65	C64	C66	112.9°	109.1°
C65	C64	H101	108.9°	109.8°
C64	C65	O25	120.5°	118.1°
C64	C65	N21	115.0°	123.6°
C66	C64	H101	109.0°	110.5°
C64	C66	C67	105.9°	105.6°
C64	C66	H102	110.4°	109.9°
C64	C66	H103	110.3°	110.2°
O25	C65	N21	124.5°	118.3°
C67	C66	H102	110.4°	110.2°
C67	C66	H103	110.4°	110.5°
C66	C67	C68	107.9°	105.1°
C66	C67	H104	109.9°	110.4°
C66	C67	H105	109.8°	110.3°
H102	C66	H103	109.4°	110.3°
C68	C67	H104	109.8°	110.3°
C68	C67	H105	109.9°	110.3°
C67	C68	H106	110.7°	109.7°
C67	C68	H107	110.7°	110.3°
H104	C67	H105	109.5°	110.5°
H106	C68	H107	109.5°	109.7°
C69	N21	H108	119.5°	117.5°
N21	C69	C70	110.9°	107.8°
N21	C69	H109	109.1°	110.3°
N21	C69	H110	109.1°	109.7°
C69	N21	C65	121.0°	125.0°
H108	N21	C65	119.5°	117.5°
C70	C69	H109	109.1°	109.6°
C70	C69	H110	109.1°	109.2°
C69	C70	O26	120.5°	116.6°
C69	C70	N22	115.0°	121.8°
H109	C69	H110	109.5°	110.3°
O26	C70	N22	124.5°	121.5°
C71	N22	H111	119.5°	118.2°
N22	C71	C72	108.3°	110.6°
N22	C71	C73	111.7°	111.9°
N22	C71	H112	108.9°	108.2°
C71	N22	C70	121.0°	124.2°
H111	N22	C70	119.5°	117.6°
C72	C71	C73	112.0°	110.9°
C72	C71	H112	107.9°	107.6°
C71	C72	O27	120.5°	118.6°
C71	C72	N23	115.0°	122.0°
C73	C71	H112	107.9°	107.5°
C71	C73	S4	114.8°	108.4°
C71	C73	H113	108.2°	111.0°
C71	C73	H114	108.1°	109.3°
O27	C72	N23	124.5°	119.4°
S4	C73	H113	108.1°	110.5°
S4	C73	H114	108.1°	109.1°
C73	S4	S3	122.2°	102.9°
H113	C73	H114	109.5°	108.6°
C74	N23	H115	119.5°	119.0°
N23	C74	C75	110.4°	111.4°
N23	C74	C76	108.0°	108.7°
N23	C74	H116	109.0°	109.4°
C74	N23	C72	121.0°	121.2°
H115	N23	C72	119.5°	119.7°
C75	C74	C76	113.4°	109.0°
C75	C74	H116	108.0°	109.3°
C74	C75	O28	120.5°	120.0°
C74	C75	N24	115.0°	119.0°
C76	C74	H116	108.0°	109.0°
C74	C76	O29	104.1°	109.4°
C74	C76	C77	112.5°	109.5°
C74	C76	H117	111.4°	109.5°
O28	C75	N24	124.5°	120.9°
O29	C76	C77	104.1°	109.5°
O29	C76	H117	113.0°	109.5°
C76	O29	H118	109.5°	114.0°
C77	C76	H117	111.4°	109.5°
C76	C77	H119	109.5°	109.5°
C76	C77	H120	109.5°	109.5°
C76	C77	H121	109.5°	109.4°
H119	C77	H120	109.5°	109.5°
H119	C77	H121	109.4°	109.5°
H120	C77	H121	109.4°	109.5°
C78	N24	H122	119.5°	118.6°
N24	C78	C79	108.3°	111.6°
N24	C78	C80	111.7°	110.8°
N24	C78	H123	109.0°	109.0°
C78	N24	C75	121.0°	122.6°
H122	N24	C75	119.5°	118.8°
C79	C78	C80	111.9°	109.2°
C79	C78	H123	108.0°	108.2°
C78	C79	O30	120.5°	119.7°
C78	C79	N25	115.0°	119.9°
C80	C78	H123	108.0°	107.8°
C78	C80	S5	114.8°	109.5°
C78	C80	H124	108.2°	110.2°
C78	C80	H125	108.1°	109.0°
O30	C79	N25	124.6°	120.4°
S5	C80	H124	108.1°	109.8°
S5	C80	H125	108.1°	109.1°
C80	S5	S2	108.1°	103.1°
H124	C80	H125	109.4°	109.3°
C81	N25	H126	119.6°	119.1°
N25	C81	C82	110.0°	110.1°
N25	C81	C83	111.1°	109.3°
N25	C81	H127	109.1°	109.6°
C81	N25	C79	121.0°	121.8°
H126	N25	C79	119.5°	119.1°
C82	C81	C83	110.3°	109.0°
C82	C81	H127	108.1°	109.2°
C81	C82	O31	120.5°	119.0°
C81	C82	N26	115.0°	121.4°
C83	C81	H127	108.1°	109.6°
C81	C83	O32	112.0°	109.5°
C81	C83	H128	108.9°	109.5°
C81	C83	H129	108.8°	109.5°
O31	C82	N26	124.5°	119.7°
O32	C83	H128	108.8°	109.4°
O32	C83	H129	108.8°	109.5°
C83	O32	H130	109.5°	114.0°
H128	C83	H129	109.5°	109.4°
C84	N26	H131	119.5°	120.1°
N26	C84	C85	108.0°	110.2°
N26	C84	C86	111.0°	109.1°
N26	C84	H132	108.9°	109.4°
C84	N26	C82	121.0°	119.9°
H131	N26	C82	119.5°	120.0°
C85	C84	C86	113.0°	109.1°
C85	C84	H132	107.9°	109.6°
C84	C85	O33	120.4°	120.1°
C84	C85	N28	115.0°	119.3°
C86	C84	H132	107.9°	109.6°
C84	C86	C87	114.1°	109.5°
C84	C86	H133	108.3°	109.4°
C84	C86	H134	108.3°	109.5°
O33	C85	N28	124.6°	120.7°
C87	C86	H133	108.3°	109.5°
C87	C86	H134	108.3°	109.5°
C86	C87	C88	128.0°	126.5°
C86	C87	C89	126.5°	126.5°
H133	C86	H134	109.5°	109.4°
C88	C87	C89	105.5°	107.0°
C87	C88	N27	111.5°	110.0°
C87	C88	H135	124.2°	125.0°
C87	C89	C90	108.3°	106.0°
C87	C89	C91	130.4°	134.0°
N27	C88	H135	124.2°	125.0°
C88	N27	C90	107.4°	109.9°
C88	N27	H136	126.3°	125.1°
C90	C89	C91	121.3°	120.0°
C89	C90	N27	107.4°	107.2°
C89	C90	C92	123.2°	119.3°
C89	C91	C93	114.8°	119.8°
C89	C91	H137	122.6°	120.2°
C90	N27	H136	126.3°	125.1°
N27	C90	C92	129.4°	133.5°
C90	C92	C94	116.5°	119.7°
C90	C92	H138	121.7°	120.1°
C93	C91	H137	122.6°	120.1°
C91	C93	C94	124.5°	120.5°
C91	C93	H139	117.7°	119.7°
C94	C92	H138	121.8°	120.1°
C92	C94	C93	119.7°	120.7°
C92	C94	H140	120.1°	119.6°
C94	C93	H139	117.7°	119.8°
C93	C94	H140	120.1°	119.6°
C95	N28	C99	113.0°	109.0°
N28	C95	C96	111.0°	112.4°
N28	C95	C97	105.0°	107.7°
N28	C95	H141	109.9°	108.5°
C95	N28	C85	121.1°	127.0°
N28	C99	C98	104.7°	108.1°
N28	C99	H146	110.6°	109.5°
N28	C99	H147	110.7°	110.0°
C99	N28	C85	126.0°	123.9°
C96	C95	C97	113.0°	110.9°
C96	C95	H141	108.8°	109.2°
C95	C96	O34	120.5°	118.6°
C95	C96	N29	115.0°	124.0°
C97	C95	H141	109.0°	108.0°
C95	C97	C98	105.9°	104.0°
C95	C97	H142	110.3°	110.4°
C95	C97	H143	110.4°	110.5°
O34	C96	N29	124.5°	117.4°
C98	C97	H142	110.4°	110.3°
C98	C97	H143	110.4°	110.6°
C97	C98	C99	107.8°	105.1°
C97	C98	H144	109.9°	110.3°
C97	C98	H145	109.9°	110.2°
H142	C97	H143	109.5°	110.8°
C99	C98	H144	109.9°	110.2°
C99	C98	H145	109.9°	110.3°
C98	C99	H146	110.7°	109.5°
C98	C99	H147	110.7°	109.9°
H144	C98	H145	109.5°	110.6°
H146	C99	H147	109.4°	109.8°
C100	N29	H148	119.5°	120.7°
N29	C100	C101	109.3°	114.1°
N29	C100	C102	109.9°	108.9°
N29	C100	H149	108.8°	107.7°
C100	N29	C96	120.9°	118.6°
H148	N29	C96	119.5°	120.7°
C101	C100	C102	113.0°	110.5°
C101	C100	H149	107.9°	107.7°
C100	C101	O35	120.6°	118.1°
C100	C101	N30	115.0°	124.1°
C102	C100	H149	107.9°	107.7°
C100	C102	C103	110.9°	109.5°
C100	C102	C104	111.0°	109.5°
C100	C102	H150	108.0°	109.5°
O35	C101	N30	124.5°	117.8°
C103	C102	C104	111.0°	109.5°
C103	C102	H150	107.9°	109.4°
C102	C103	H151	109.5°	109.4°
C102	C103	H152	109.5°	109.4°
C102	C103	H153	109.5°	109.5°
C104	C102	H150	107.9°	109.5°
C102	C104	H154	109.5°	109.5°
C102	C104	H155	109.4°	109.5°
C102	C104	H156	109.5°	109.4°
H151	C103	H152	109.5°	109.5°
H151	C103	H153	109.4°	109.5°
H152	C103	H153	109.5°	109.6°
H154	C104	H155	109.5°	109.5°
H154	C104	H156	109.5°	109.4°
H155	C104	H156	109.5°	109.5°
C105	N30	H157	119.5°	117.2°
N30	C105	C106	108.4°	109.8°
N30	C105	C107	111.7°	108.4°
N30	C105	H158	108.9°	110.3°
C105	N30	C101	121.0°	121.9°
H157	N30	C101	119.5°	120.9°
C106	C105	C107	111.9°	108.5°
C106	C105	H158	107.9°	109.7°
C105	C106	O36	120.5°	119.4°
C105	C106	N31	115.0°	120.4°
C107	C105	H158	108.0°	110.1°
C105	C107	S6	114.8°	110.1°
C105	C107	H159	108.1°	109.3°
C105	C107	H160	108.1°	109.6°
O36	C106	N31	124.5°	120.2°
S6	C107	H159	108.1°	109.3°
S6	C107	H160	108.1°	109.4°
C107	S6	S1	178.7°	102.7°
H159	C107	H160	109.5°	109.2°
C108	N31	H161	119.5°	119.3°
N31	C108	C109	110.4°	109.8°
N31	C108	C110	108.0°	109.3°
N31	C108	H162	109.0°	109.6°
C108	N31	C106	121.0°	121.6°
H161	N31	C106	119.5°	119.1°
C109	C108	C110	113.4°	109.1°
C109	C108	H162	108.0°	109.5°
C108	C109	O37	120.5°	119.7°
C108	C109	N32	115.0°	120.5°
C110	C108	H162	108.0°	109.5°
C108	C110	O38	104.2°	109.4°
C108	C110	C111	112.5°	109.5°
C108	C110	H163	111.4°	109.5°
O37	C109	N32	124.5°	119.8°
O38	C110	C111	104.0°	109.5°
O38	C110	H163	113.0°	109.5°
C110	O38	H164	109.5°	114.0°
C111	C110	H163	111.4°	109.5°
C110	C111	H165	109.5°	109.4°
C110	C111	H166	109.5°	109.5°
C110	C111	H167	109.5°	109.5°
H165	C111	H166	109.5°	109.5°
H165	C111	H167	109.5°	109.5°
H166	C111	H167	109.5°	109.5°
C112	N32	H168	119.5°	119.5°
N32	C112	C113	110.4°	109.4°
N32	C112	C114	111.1°	109.4°
N32	C112	H169	109.3°	109.6°
C112	N32	C109	121.1°	120.6°
H168	N32	C109	119.5°	119.9°
C113	C112	C114	109.3°	109.6°
C113	C112	H169	108.4°	109.4°
C112	C113	O39	120.5°	119.6°
C112	C113	N1	110.7°	120.0°
C114	C112	H169	108.4°	109.4°
C112	C114	C115	111.0°	109.5°
C112	C114	H170	109.1°	109.5°
C112	C114	H171	109.1°	109.5°
O39	C113	N1	124.2°	120.5°
C115	C114	H170	109.1°	109.4°
C115	C114	H171	109.1°	109.4°
C114	C115	C116	111.0°	109.5°
C114	C115	H172	109.1°	109.5°
C114	C115	H173	109.1°	109.5°
H170	C114	H171	109.5°	109.5°
C116	C115	H172	109.1°	109.5°
C116	C115	H173	109.1°	109.5°
C115	C116	N33	110.0°	109.5°
C115	C116	H174	109.3°	109.5°
C115	C116	H175	109.3°	109.5°
H172	C115	H173	109.5°	109.5°
N33	C116	H174	109.3°	109.4°
N33	C116	H175	109.3°	109.5°
C116	N33	C117	124.1°	120.0°
C116	N33	H176	118.0°	120.0°
H174	C116	H175	109.5°	109.5°
C117	N33	H176	118.0°	120.0°
N33	C117	N34	120.1°	120.0°
N33	C117	N35	120.0°	120.0°
N34	C117	N35	119.9°	120.0°
C117	N34	H177	120.0°	120.0°
C117	N34	H178	120.0°	120.0°
C117	N35	H179	120.0°	119.9°
C117	N35	H180	120.0°	120.1°
H177	N34	H178	120.0°	120.0°
H179	N35	H180	120.0°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C1	N1	H1	C113	180.0°	179.6°
N1	C1	C2	C3	121.0°	119.6°
N1	C1	C2	H2	120.6°	120.3°
N1	C1	C3	H2	121.6°	120.0°
N1	C1	C2	O1	159.1°	5.0°
N1	C1	C3	C4	75.1°	55.0°
N1	C1	C3	H3	45.2°	175.0°
N1	C1	C3	H4	164.7°	65.0°
C1	N1	C113	C112	178.8°	176.5°
C1	N1	C113	O39	22.8°	3.9°
N1	C1	C2	N3	20.9°	175.1°
H1	N1	C1	C2	88.8°	25.7°
H1	N1	C1	C3	152.1°	94.1°
H1	N1	C1	H2	31.1°	145.9°
H1	N1	C113	C112	1.2°	3.9°
H1	N1	C113	O39	157.2°	175.7°
C2	C1	C3	H2	118.5°	120.0°
C1	C2	O1	N3	180.0°	179.8°
C2	C1	C3	C4	165.0°	65.0°
C2	C1	C3	H3	74.7°	55.0°
C2	C1	C3	H4	44.8°	175.0°
C1	C2	N3	C5	180.0°	177.3°
C1	C2	N3	H7	0.0°	3.4°
C2	C1	N1	C113	91.2°	153.9°
C3	C1	C2	O1	38.1°	124.7°
C1	C3	C4	H3	120.2°	120.0°
C1	C3	C4	H4	120.2°	120.0°
C1	C3	H3	H4	119.3°	119.9°
C1	C3	C4	O2	43.6°	4.3°
C1	C3	C4	N2	136.5°	175.7°
C3	C1	C2	N3	141.8°	55.5°
C3	C1	N1	C113	27.9°	86.3°
H2	C1	C2	O1	80.3°	115.3°
H2	C1	C3	C4	46.6°	174.9°
H2	C1	C3	H3	166.8°	65.0°
H2	C1	C3	H4	73.6°	54.9°
H2	C1	C2	N3	99.7°	64.6°
H2	C1	N1	C113	148.9°	33.7°
O1	C2	N3	C5	0.0°	2.9°
O1	C2	N3	H7	180.0°	176.4°
C4	C3	H3	H4	119.3°	120.1°
C3	C4	O2	N2	179.9°	180.0°
C3	C4	N2	H5	179.9°	0.0°
C3	C4	N2	H6	0.1°	180.0°
H3	C3	C4	O2	163.8°	115.7°
H3	C3	C4	N2	16.3°	64.3°
H4	C3	C4	O2	76.6°	124.3°
H4	C3	C4	N2	103.3°	55.7°
O2	C4	N2	H5	0.0°	180.0°
O2	C4	N2	H6	180.0°	0.0°
C4	N2	H5	H6	180.0°	179.9°
C5	N3	H7	C2	180.0°	179.3°
N3	C5	C6	H8	120.2°	120.6°
N3	C5	C6	H9	120.2°	119.8°
N3	C5	H8	H9	119.3°	119.9°
N3	C5	C6	O3	140.2°	90.9°
N3	C5	C6	N4	39.8°	89.4°
H7	N3	C5	C6	46.7°	68.1°
H7	N3	C5	H8	73.5°	171.6°
H7	N3	C5	H9	167.0°	51.6°
C6	C5	H8	H9	119.3°	119.6°
C5	C6	O3	N4	179.9°	179.7°
C5	C6	N4	C7	180.0°	177.1°
C5	C6	N4	H10	0.0°	3.2°
C6	C5	N3	C2	133.3°	112.6°
H8	C5	C6	O3	20.0°	148.6°
H8	C5	N3	C2	106.5°	7.7°
H8	C5	C6	N4	160.1°	31.1°
H9	C5	C6	O3	99.5°	28.9°
H9	C5	N3	C2	13.0°	127.6°
H9	C5	C6	N4	80.4°	150.8°
O3	C6	N4	C7	0.0°	3.2°
O3	C6	N4	H10	180.0°	176.5°
C7	N4	H10	C6	180.0°	179.7°
N4	C7	C8	C9	123.9°	119.5°
N4	C7	C8	H11	117.4°	120.6°
N4	C7	C9	H11	118.0°	120.0°
N4	C7	C8	O4	66.6°	18.0°
N4	C7	C9	C10	58.6°	65.0°
N4	C7	C9	H12	62.4°	55.0°
N4	C7	C9	H13	179.5°	175.1°
N4	C7	C8	N5	113.5°	161.9°
H10	N4	C7	C8	118.0°	17.6°
H10	N4	C7	C9	7.8°	101.9°
H10	N4	C7	H11	125.2°	138.2°
C8	C7	C9	H11	118.7°	120.0°
C7	C8	O4	N5	180.0°	180.0°
C8	C7	C9	C10	178.2°	175.0°
C8	C7	C9	H12	60.9°	65.0°
C8	C7	C9	H13	57.2°	55.1°
C7	C8	N5	C13	180.0°	173.6°
C7	C8	N5	C17	0.1°	6.5°
C8	C7	N4	C6	62.0°	162.1°
C9	C7	C8	O4	57.4°	101.4°
C7	C9	C10	H12	120.9°	120.0°
C7	C9	C10	H13	120.9°	119.9°
C7	C9	H12	H13	117.0°	120.0°
C7	C9	C10	C11	129.8°	175.0°
C7	C9	C10	C12	105.0°	65.0°
C7	C9	C10	H14	12.4°	55.0°
C9	C7	N4	C6	172.2°	78.4°
C9	C7	C8	N5	122.6°	78.6°
H11	C7	C8	O4	176.1°	138.6°
H11	C7	C9	C10	59.5°	55.0°
H11	C7	C9	H12	179.6°	175.1°
H11	C7	C9	H13	61.5°	64.9°
H11	C7	N4	C6	54.8°	41.6°
H11	C7	C8	N5	3.9°	41.4°
O4	C8	N5	C13	0.0°	6.4°
O4	C8	N5	C17	180.0°	173.5°
C10	C9	H12	H13	117.1°	120.0°
C9	C10	C11	C12	124.6°	120.0°
C9	C10	C11	H14	117.4°	119.9°
C9	C10	C12	H14	117.4°	120.0°
C9	C10	C11	H15	180.0°	60.1°
C9	C10	C11	H16	60.0°	180.0°
C9	C10	C11	H17	60.0°	60.0°
C9	C10	C12	H18	180.0°	60.0°
C9	C10	C12	H19	60.0°	180.0°
C9	C10	C12	H20	60.0°	60.0°
H12	C9	C10	C11	8.9°	55.0°
H12	C9	C10	C12	134.1°	175.0°
H12	C9	C10	H14	108.5°	65.0°
H13	C9	C10	C11	109.2°	65.1°
H13	C9	C10	C12	15.9°	55.0°
H13	C9	C10	H14	133.3°	175.0°
C11	C10	C12	H14	118.0°	120.0°
C10	C11	H15	H16	120.0°	119.9°
C10	C11	H15	H17	120.0°	120.1°
C10	C11	H16	H17	120.0°	120.0°
C11	C10	C12	H18	55.4°	180.0°
C11	C10	C12	H19	64.7°	60.0°
C11	C10	C12	H20	175.4°	60.0°
C12	C10	C11	H15	55.4°	60.0°
C12	C10	C11	H16	175.4°	60.0°
C12	C10	C11	H17	64.6°	180.0°
C10	C12	H18	H19	120.0°	120.0°
C10	C12	H18	H20	120.0°	119.9°
C10	C12	H19	H20	120.0°	120.0°
H14	C10	C11	H15	62.6°	180.0°
H14	C10	C11	H16	57.4°	60.0°
H14	C10	C11	H17	177.4°	59.9°
H14	C10	C12	H18	62.6°	60.0°
H14	C10	C12	H19	177.4°	60.0°
H14	C10	C12	H20	57.4°	180.0°
H15	C11	H16	H17	119.9°	120.0°
H18	C12	H19	H20	120.0°	120.1°
C13	N5	C17	C8	179.9°	179.9°
N5	C13	C14	C15	117.6°	118.7°
N5	C13	C14	H21	121.1°	120.5°
N5	C13	C15	H21	117.7°	119.7°
N5	C13	C14	O5	115.2°	55.2°
N5	C13	C15	C16	18.7°	3.1°
N5	C13	C15	H22	138.2°	122.1°
N5	C13	C15	H23	100.7°	116.5°
C13	N5	C17	C16	8.6°	16.4°
C13	N5	C17	H26	127.9°	136.1°
C13	N5	C17	H27	110.6°	103.2°
N5	C13	C14	N6	65.0°	125.3°
C17	N5	C13	C14	105.0°	107.5°
C17	N5	C13	C15	17.4°	12.1°
C17	N5	C13	H21	134.5°	131.8°
N5	C17	C16	C15	3.9°	14.0°
N5	C17	C16	H26	119.3°	119.8°
N5	C17	C16	H27	119.2°	119.7°
N5	C17	C16	H24	115.8°	133.1°
N5	C17	C16	H25	123.6°	105.2°
N5	C17	H26	H27	122.2°	120.8°
C14	C13	C15	H21	121.2°	121.0°
C13	C14	O5	N6	179.8°	179.5°
C14	C13	C15	C16	102.4°	116.3°
C14	C13	C15	H22	17.1°	2.7°
C14	C13	C15	H23	138.2°	124.1°
C13	C14	N6	C18	180.0°	170.2°
C13	C14	N6	H28	0.1°	10.0°
C14	C13	N5	C8	75.1°	72.5°
C15	C13	C14	O5	2.4°	63.5°
C13	C15	C16	H22	119.4°	119.0°
C13	C15	C16	H23	119.4°	119.5°
C13	C15	H22	H23	121.6°	121.6°
C13	C15	C16	C17	14.1°	6.6°
C13	C15	C16	H24	105.6°	125.6°
C13	C15	C16	H25	133.8°	112.7°
C15	C13	N5	C8	162.5°	167.8°
C15	C13	C14	N6	177.4°	116.0°
H21	C13	C14	O5	123.7°	175.6°
H21	C13	C15	C16	136.4°	122.7°
H21	C13	C15	H22	104.1°	118.3°
H21	C13	C15	H23	17.0°	3.2°
H21	C13	N5	C8	45.5°	48.1°
H21	C13	C14	N6	56.2°	4.9°
O5	C14	N6	C18	0.1°	10.3°
O5	C14	N6	H28	179.9°	169.5°
C16	C15	H22	H23	121.7°	121.6°
C15	C16	C17	H24	119.7°	119.0°
C15	C16	C17	H25	119.7°	119.2°
C15	C16	H24	H25	120.7°	121.9°
C15	C16	C17	H26	115.4°	133.8°
C15	C16	C17	H27	123.1°	105.6°
H22	C15	C16	C17	133.5°	112.5°
H22	C15	C16	H24	13.8°	6.6°
H22	C15	C16	H25	106.7°	128.3°
H23	C15	C16	C17	105.3°	126.1°
H23	C15	C16	H24	134.9°	114.9°
H23	C15	C16	H25	14.4°	6.9°
C17	C16	H24	H25	120.8°	121.9°
C16	C17	H26	H27	122.2°	120.5°
C16	C17	N5	C8	171.3°	163.5°
H24	C16	C17	H26	124.9°	107.2°
H24	C16	C17	H27	3.4°	13.4°
H25	C16	C17	H26	4.4°	14.6°
H25	C16	C17	H27	117.1°	135.2°
H26	C17	N5	C8	52.1°	43.9°
H27	C17	N5	C8	69.5°	76.9°
C18	N6	H28	C14	180.0°	179.8°
N6	C18	C19	C20	122.9°	119.5°
N6	C18	C19	H29	118.1°	120.4°
N6	C18	C20	H29	118.5°	119.8°
N6	C18	C19	O6	158.1°	15.4°
N6	C18	C20	C21	64.1°	70.1°
N6	C18	C20	C22	59.8°	50.0°
N6	C18	C20	H30	177.8°	170.0°
N6	C18	C19	N7	21.9°	165.4°
H28	N6	C18	C19	41.2°	20.5°
H28	N6	C18	C20	83.5°	99.5°
H28	N6	C18	H29	158.6°	140.8°
C19	C18	C20	H29	119.0°	120.0°
C18	C19	O6	N7	180.0°	179.2°
C19	C18	C20	C21	173.4°	169.7°
C19	C18	C20	C22	62.7°	70.3°
C19	C18	C20	H30	55.3°	49.7°
C18	C19	N7	C23	180.0°	173.8°
C18	C19	N7	H37	0.0°	7.9°
C19	C18	N6	C14	138.8°	159.2°
C20	C18	C19	O6	35.2°	134.9°
C18	C20	C21	C22	123.9°	120.0°
C18	C20	C21	H30	118.1°	120.0°
C18	C20	C22	H30	118.1°	120.0°
C18	C20	C21	H31	180.0°	65.4°
C18	C20	C21	H32	60.0°	174.7°
C18	C20	C21	H33	60.0°	54.7°
C18	C20	C22	H34	180.0°	60.0°
C18	C20	C22	H35	60.0°	60.0°
C18	C20	C22	H36	60.0°	180.0°
C20	C18	N6	C14	96.5°	80.7°
C20	C18	C19	N7	144.8°	45.8°
H29	C18	C19	O6	83.8°	105.0°
H29	C18	C20	C21	54.4°	49.7°
H29	C18	C20	C22	178.3°	169.7°
H29	C18	C20	H30	63.7°	70.3°
H29	C18	N6	C14	21.4°	39.0°
H29	C18	C19	N7	96.2°	74.2°
O6	C19	N7	C23	0.0°	6.9°
O6	C19	N7	H37	180.0°	171.4°
C21	C20	C22	H30	118.0°	120.0°
C20	C21	H31	H32	120.0°	119.9°
C20	C21	H31	H33	120.0°	120.0°
C20	C21	H32	H33	120.0°	120.0°
C21	C20	C22	H34	56.1°	60.0°
C21	C20	C22	H35	63.9°	180.0°
C21	C20	C22	H36	176.1°	60.0°
C22	C20	C21	H31	56.1°	54.6°
C22	C20	C21	H32	176.1°	65.3°
C22	C20	C21	H33	64.0°	174.7°
C20	C22	H34	H35	120.0°	120.0°
C20	C22	H34	H36	120.0°	120.0°
C20	C22	H35	H36	120.0°	120.0°
H30	C20	C21	H31	61.9°	174.7°
H30	C20	C21	H32	58.1°	54.7°
H30	C20	C21	H33	178.1°	65.3°
H30	C20	C22	H34	61.9°	180.0°
H30	C20	C22	H35	178.1°	60.0°
H30	C20	C22	H36	58.1°	60.0°
H31	C21	H32	H33	120.0°	120.0°
H34	C22	H35	H36	120.0°	120.0°
C23	N7	H37	C19	180.0°	178.4°
N7	C23	C24	C25	123.6°	120.5°
N7	C23	C24	H38	117.8°	120.7°
N7	C23	C25	H38	119.8°	119.6°
N7	C23	C24	O7	138.0°	35.2°
N7	C23	C25	S1	172.3°	27.8°
N7	C23	C25	H39	66.9°	147.5°
N7	C23	C25	H40	51.5°	92.3°
N7	C23	C24	N8	42.0°	145.3°
H37	N7	C23	C24	122.0°	146.9°
H37	N7	C23	C25	1.6°	26.7°
H37	N7	C23	H38	120.8°	92.7°
C24	C23	C25	H38	118.6°	118.7°
C23	C24	O7	N8	180.0°	179.5°
C24	C23	C25	S1	50.7°	94.0°
C24	C23	C25	H39	171.5°	25.8°
C24	C23	C25	H40	70.1°	145.9°
C23	C24	N8	C26	180.0°	179.2°
C23	C24	N8	H41	0.1°	0.9°
C24	C23	N7	C19	58.0°	34.8°
C25	C23	C24	O7	98.4°	85.4°
C23	C25	S1	H39	120.8°	119.7°
C23	C25	S1	H40	120.8°	120.1°
C23	C25	H39	H40	117.6°	120.1°
C25	C23	N7	C19	178.4°	155.0°
C25	C23	C24	N8	81.6°	94.2°
C23	C25	S1	S6	172.2°	166.0°
H38	C23	C24	O7	20.2°	155.8°
H38	C23	C25	S1	67.9°	147.4°
H38	C23	C25	H39	52.9°	92.9°
H38	C23	C25	H40	171.3°	27.3°
H38	C23	N7	C19	59.2°	85.6°
H38	C23	C24	N8	159.7°	24.6°
O7	C24	N8	C26	0.0°	1.3°
O7	C24	N8	H41	180.0°	178.6°
S1	C25	H39	H40	117.5°	120.1°
C25	S1	S6	C107	91.3°	126.7°
H39	C25	S1	S6	67.0°	74.4°
H40	C25	S1	S6	51.4°	45.8°
C26	N8	H41	C24	180.0°	179.9°
N8	C26	C27	H42	120.2°	120.3°
N8	C26	C27	H43	120.2°	119.8°
N8	C26	H42	H43	119.3°	120.2°
N8	C26	C27	O8	172.4°	34.0°
N8	C26	C27	N9	7.7°	145.6°
H41	N8	C26	C27	84.3°	61.8°
H41	N8	C26	H42	35.9°	178.1°
H41	N8	C26	H43	155.4°	57.9°
C27	C26	H42	H43	119.4°	119.9°
C26	C27	O8	N9	179.9°	179.6°
C26	C27	N9	C28	180.0°	177.2°
C26	C27	N9	H44	0.0°	2.8°
C27	C26	N8	C24	95.6°	118.1°
H42	C26	C27	O8	52.2°	86.3°
H42	C26	N8	C24	144.1°	2.0°
H42	C26	C27	N9	127.9°	94.1°
H43	C26	C27	O8	67.4°	153.7°
H43	C26	N8	C24	24.6°	122.2°
H43	C26	C27	N9	112.5°	25.9°
O8	C27	N9	C28	0.1°	3.2°
O8	C27	N9	H44	179.9°	176.8°
C28	N9	H44	C27	180.0°	180.0°
N9	C28	C29	C30	123.5°	119.8°
N9	C28	C29	H45	118.7°	120.5°
N9	C28	C30	H45	119.1°	120.2°
N9	C28	C29	O9	24.0°	68.0°
N9	C28	C30	C31	54.8°	65.0°
N9	C28	C30	H46	65.4°	55.0°
N9	C28	C30	H47	175.0°	175.0°
N9	C28	C29	N10	155.9°	112.2°
H44	N9	C28	C29	56.0°	30.7°
H44	N9	C28	C30	67.5°	89.0°
H44	N9	C28	H45	174.1°	151.0°
C29	C28	C30	H45	117.8°	119.7°
C28	C29	O9	N10	179.8°	179.8°
C29	C28	C30	C31	177.9°	174.9°
C29	C28	C30	H46	57.7°	65.1°
C29	C28	C30	H47	61.9°	54.9°
C28	C29	N10	C33	180.0°	179.4°
C28	C29	N10	H51	0.0°	0.3°
C29	C28	N9	C27	124.0°	149.3°
C30	C28	C29	O9	99.5°	51.8°
C28	C30	C31	H46	120.2°	120.0°
C28	C30	C31	H47	120.2°	120.0°
C28	C30	H46	H47	119.3°	120.0°
C28	C30	C31	C32	65.5°	180.0°
C28	C30	C31	H48	54.7°	60.0°
C28	C30	C31	H49	174.2°	60.0°
C30	C28	N9	C27	112.5°	91.0°
C30	C28	C29	N10	80.6°	128.0°
H45	C28	C29	O9	142.7°	171.5°
H45	C28	C30	C31	64.3°	55.2°
H45	C28	C30	H46	175.5°	175.2°
H45	C28	C30	H47	55.9°	64.8°
H45	C28	N9	C27	5.9°	29.0°
H45	C28	C29	N10	37.2°	8.3°
O9	C29	N10	C33	0.2°	0.3°
O9	C29	N10	H51	179.8°	179.9°
C31	C30	H46	H47	119.3°	120.0°
C30	C31	C32	H48	120.2°	120.0°
C30	C31	C32	H49	120.2°	120.0°
C30	C31	H48	H49	119.3°	120.0°
C30	C31	C32	O10	98.0°	0.0°
C30	C31	C32	O11	82.1°	180.0°
H46	C30	C31	C32	174.3°	60.0°
H46	C30	C31	H48	65.5°	180.0°
H46	C30	C31	H49	54.0°	60.0°
H47	C30	C31	C32	54.7°	60.0°
H47	C30	C31	H48	175.0°	60.0°
H47	C30	C31	H49	65.5°	180.0°
C32	C31	H48	H49	119.3°	120.1°
C31	C32	O10	O11	180.0°	180.0°
C31	C32	O11	H50	180.0°	180.0°
H48	C31	C32	O10	22.3°	120.0°
H48	C31	C32	O11	157.7°	60.1°
H49	C31	C32	O10	141.8°	119.9°
H49	C31	C32	O11	38.1°	60.0°
O10	C32	O11	H50	0.0°	0.0°
C33	N10	H51	C29	180.0°	179.8°
N10	C33	C34	C35	121.3°	120.4°
N10	C33	C34	H52	119.1°	120.9°
N10	C33	C35	H52	117.7°	119.5°
N10	C33	C34	O12	3.2°	59.2°
N10	C33	C35	O13	29.0°	65.0°
N10	C33	C35	C36	141.0°	55.0°
N10	C33	C35	H53	93.2°	175.0°
N10	C33	C34	N11	176.6°	121.1°
H51	N10	C33	C34	74.5°	19.8°
H51	N10	C33	C35	50.0°	100.4°
H51	N10	C33	H52	167.0°	140.4°
C34	C33	C35	H52	119.6°	118.8°
C33	C34	O12	N11	179.8°	179.7°
C34	C33	C35	O13	151.7°	56.8°
C34	C33	C35	C36	96.3°	176.7°
C34	C33	C35	H53	29.5°	63.3°
C33	C34	N11	C37	180.0°	174.3°
C33	C34	N11	H58	0.0°	6.1°
C34	C33	N10	C29	105.5°	160.0°
C35	C33	C34	O12	118.1°	61.2°
C33	C35	O13	C36	118.0°	119.9°
C33	C35	O13	H53	121.1°	120.0°
C33	C35	C36	H53	125.9°	120.0°
C33	C35	O13	H54	180.0°	60.0°
C33	C35	C36	H55	180.0°	60.0°
C33	C35	C36	H56	60.0°	180.0°
C33	C35	C36	H57	60.0°	60.0°
C35	C33	N10	C29	130.0°	79.9°
C35	C33	C34	N11	62.1°	118.5°
H52	C33	C34	O12	122.3°	180.0°
H52	C33	C35	O13	88.7°	175.5°
H52	C33	C35	C36	23.3°	64.5°
H52	C33	C35	H53	149.1°	55.5°
H52	C33	N10	C29	13.0°	39.4°
H52	C33	C34	N11	57.5°	0.2°
O12	C34	N11	C37	0.2°	5.4°
O12	C34	N11	H58	179.8°	174.1°
O13	C35	C36	H53	122.1°	120.0°
O13	C35	C36	H55	67.9°	60.0°
O13	C35	C36	H56	172.0°	60.0°
O13	C35	C36	H57	52.1°	180.0°
C36	C35	O13	H54	62.0°	180.0°
C35	C36	H55	H56	120.0°	120.0°
C35	C36	H55	H57	120.0°	120.0°
C35	C36	H56	H57	120.0°	120.0°
H53	C35	O13	H54	58.9°	60.0°
H53	C35	C36	H55	54.1°	180.0°
H53	C35	C36	H56	65.9°	60.0°
H53	C35	C36	H57	174.1°	60.0°
H55	C36	H56	H57	120.0°	119.9°
C37	N11	H58	C34	180.0°	179.6°
N11	C37	C38	C39	123.5°	121.0°
N11	C37	C38	H59	117.8°	119.1°
N11	C37	C39	H59	119.8°	121.0°
N11	C37	C38	O14	111.2°	151.4°
N11	C37	C39	S2	62.1°	105.2°
N11	C37	C39	H60	177.1°	15.4°
N11	C37	C39	H61	58.7°	135.2°
N11	C37	C38	N12	68.8°	29.5°
H58	N11	C37	C38	25.5°	36.0°
H58	N11	C37	C39	98.1°	83.9°
H58	N11	C37	H59	142.7°	154.8°
C38	C37	C39	H59	118.7°	119.4°
C37	C38	O14	N12	180.0°	179.1°
C38	C37	C39	S2	59.5°	135.3°
C38	C37	C39	H60	61.3°	104.2°
C38	C37	C39	H61	179.7°	15.7°
C37	C38	N12	C40	180.0°	168.0°
C37	C38	N12	H62	0.0°	13.1°
C38	C37	N11	C34	154.5°	144.5°
C39	C37	C38	O14	12.3°	87.6°
C37	C39	S2	H60	120.8°	120.6°
C37	C39	S2	H61	120.8°	119.5°
C37	C39	H60	H61	117.6°	119.7°
C39	C37	N11	C34	81.9°	95.7°
C39	C37	C38	N12	167.7°	91.5°
C37	C39	S2	S5	145.2°	116.9°
H59	C37	C38	O14	130.9°	32.3°
H59	C37	C39	S2	178.1°	15.8°
H59	C37	C39	H60	57.4°	136.4°
H59	C37	C39	H61	61.1°	103.8°
H59	C37	N11	C34	37.3°	25.6°
H59	C37	C38	N12	49.1°	148.6°
O14	C38	N12	C40	0.0°	12.9°
O14	C38	N12	H62	180.0°	165.9°
S2	C39	H60	H61	117.6°	119.8°
C39	S2	S5	C80	89.0°	75.7°
H60	C39	S2	S5	24.4°	122.5°
H61	C39	S2	S5	94.0°	2.6°
C40	N12	H62	C38	180.0°	178.9°
N12	C40	C41	C42	122.9°	124.0°
N12	C40	C41	H63	118.1°	118.9°
N12	C40	C42	H63	118.4°	117.9°
N12	C40	C41	O15	158.7°	41.3°
N12	C40	C42	C43	162.9°	180.0°
N12	C40	C42	C44	38.9°	60.0°
N12	C40	C42	H64	79.2°	60.0°
N12	C40	C41	N13	21.3°	139.2°
H62	N12	C40	C41	105.2°	105.8°
H62	N12	C40	C42	19.5°	130.7°
H62	N12	C40	H63	137.3°	12.9°
C41	C40	C42	H63	119.1°	116.9°
C40	C41	O15	N13	180.0°	179.5°
C41	C40	C42	C43	74.6°	54.9°
C41	C40	C42	C44	161.4°	174.8°
C41	C40	C42	H64	43.3°	65.2°
C40	C41	N13	C45	179.9°	177.3°
C40	C41	N13	H71	0.1°	2.5°
C41	C40	N12	C38	74.8°	73.0°
C42	C40	C41	O15	78.5°	82.6°
C40	C42	C43	C44	124.1°	120.0°
C40	C42	C43	H64	118.0°	120.0°
C40	C42	C44	H64	118.0°	120.0°
C40	C42	C43	H65	180.0°	60.0°
C40	C42	C43	H66	60.0°	180.0°
C40	C42	C43	H67	60.0°	60.0°
C40	C42	C44	H68	180.0°	60.0°
C40	C42	C44	H69	60.0°	180.0°
C40	C42	C44	H70	60.0°	60.0°
C42	C40	N12	C38	160.6°	50.5°
C42	C40	C41	N13	101.5°	96.9°
H63	C40	C41	O15	40.6°	160.3°
H63	C40	C42	C43	44.5°	62.0°
H63	C40	C42	C44	79.6°	57.9°
H63	C40	C42	H64	162.4°	177.9°
H63	C40	N12	C38	42.7°	168.3°
H63	C40	C41	N13	139.4°	20.2°
O15	C41	N13	C45	0.1°	3.2°
O15	C41	N13	H71	179.9°	177.0°
C43	C42	C44	H64	118.0°	120.0°
C42	C43	H65	H66	120.0°	120.0°
C42	C43	H65	H67	120.0°	120.0°
C42	C43	H66	H67	120.0°	120.0°
C43	C42	C44	H68	56.0°	180.0°
C43	C42	C44	H69	64.1°	60.0°
C43	C42	C44	H70	176.0°	60.0°
C44	C42	C43	H65	55.9°	60.0°
C44	C42	C43	H66	176.0°	60.0°
C44	C42	C43	H67	64.1°	180.0°
C42	C44	H68	H69	120.0°	120.0°
C42	C44	H68	H70	120.0°	120.0°
C42	C44	H69	H70	120.0°	120.0°
H64	C42	C43	H65	62.1°	NaN°
H64	C42	C43	H66	58.0°	59.9°
H64	C42	C43	H67	177.9°	60.0°
H64	C42	C44	H68	62.0°	60.0°
H64	C42	C44	H69	178.0°	60.0°
H64	C42	C44	H70	58.0°	180.0°
H65	C43	H66	H67	120.0°	120.0°
H68	C44	H69	H70	120.0°	120.0°
C45	N13	H71	C41	180.0°	179.8°
N13	C45	C46	H72	120.2°	119.9°
N13	C45	C46	H73	120.2°	120.4°
N13	C45	H72	H73	119.3°	119.9°
N13	C45	C46	O16	173.7°	14.4°
N13	C45	C46	N14	6.3°	165.6°
H71	N13	C45	C46	75.1°	31.3°
H71	N13	C45	H72	164.7°	88.6°
H71	N13	C45	H73	45.2°	151.6°
C46	C45	H72	H73	119.3°	119.7°
C45	C46	O16	N14	180.0°	180.0°
C45	C46	N14	C47	180.0°	1.3°
C45	C46	N14	H74	0.0°	178.8°
C46	C45	N13	C41	104.9°	148.5°
H72	C45	C46	O16	53.5°	134.3°
H72	C45	N13	C41	15.3°	91.6°
H72	C45	C46	N14	126.6°	45.7°
H73	C45	C46	O16	66.0°	106.0°
H73	C45	N13	C41	134.8°	28.2°
H73	C45	C46	N14	113.9°	74.0°
O16	C46	N14	C47	0.1°	178.7°
O16	C46	N14	H74	179.9°	1.2°
C47	N14	H74	C46	180.0°	179.9°
N14	C47	C48	H75	120.2°	119.9°
N14	C47	C48	H76	120.2°	120.3°
N14	C47	H75	H76	119.3°	120.4°
N14	C47	C48	O17	158.6°	36.4°
N14	C47	C48	N15	21.5°	143.6°
H74	N14	C47	C48	86.2°	23.5°
H74	N14	C47	H75	34.1°	96.3°
H74	N14	C47	H76	153.6°	143.5°
C48	C47	H75	H76	119.3°	119.6°
C47	C48	O17	N15	179.9°	180.0°
C47	C48	N15	C49	179.9°	177.4°
C47	C48	N15	H77	0.1°	2.2°
C48	C47	N14	C46	93.8°	156.4°
H75	C47	C48	O17	81.2°	83.5°
H75	C47	N14	C46	145.9°	83.8°
H75	C47	C48	N15	98.8°	96.5°
H76	C47	C48	O17	38.4°	156.7°
H76	C47	N14	C46	26.4°	36.4°
H76	C47	C48	N15	141.7°	23.3°
O17	C48	N15	C49	0.0°	2.7°
O17	C48	N15	H77	180.0°	177.8°
C49	N15	H77	C48	180.0°	179.5°
N15	C49	C50	C51	121.3°	121.8°
N15	C49	C50	H78	119.1°	118.5°
N15	C49	C51	H78	117.7°	118.1°
N15	C49	C50	O18	100.6°	60.9°
N15	C49	C51	O19	78.9°	49.6°
N15	C49	C51	C52	169.2°	169.6°
N15	C49	C51	H79	43.3°	70.3°
N15	C49	C50	N16	79.4°	118.9°
H77	N15	C49	C50	48.3°	42.7°
H77	N15	C49	C51	76.2°	80.4°
H77	N15	C49	H78	166.8°	161.3°
C50	C49	C51	H78	119.6°	119.6°
C49	C50	O18	N16	180.0°	179.8°
C50	C49	C51	O19	158.5°	172.0°
C50	C49	C51	C52	46.5°	68.0°
C50	C49	C51	H79	79.4°	52.1°
C49	C50	N16	C53	180.0°	170.4°
C49	C50	N16	H84	0.1°	11.2°
C50	C49	N15	C48	131.7°	136.8°
C51	C49	C50	O18	20.7°	177.3°
C49	C51	O19	C52	118.0°	120.0°
C49	C51	O19	H79	121.1°	120.0°
C49	C51	C52	H79	125.9°	120.0°
C49	C51	O19	H80	180.0°	66.2°
C49	C51	C52	H81	180.0°	60.0°
C49	C51	C52	H82	60.0°	180.0°
C49	C51	C52	H83	60.0°	60.0°
C51	C49	N15	C48	103.9°	100.1°
C51	C49	C50	N16	159.3°	2.9°
H78	C49	C50	O18	140.3°	57.6°
H78	C49	C51	O19	38.8°	68.4°
H78	C49	C51	C52	73.1°	51.6°
H78	C49	C51	H79	161.0°	171.6°
H78	C49	N15	C48	13.2°	18.2°
H78	C49	C50	N16	39.7°	122.6°
O18	C50	N16	C53	0.1°	9.8°
O18	C50	N16	H84	179.9°	168.6°
O19	C51	C52	H79	122.1°	120.0°
O19	C51	C52	H81	68.0°	60.0°
O19	C51	C52	H82	172.0°	60.0°
O19	C51	C52	H83	52.0°	179.9°
C52	C51	O19	H80	62.0°	173.8°
C51	C52	H81	H82	120.0°	120.0°
C51	C52	H81	H83	120.0°	119.9°
C51	C52	H82	H83	120.0°	120.0°
H79	C51	O19	H80	58.9°	53.8°
H79	C51	C52	H81	54.1°	180.0°
H79	C51	C52	H82	65.9°	60.0°
H79	C51	C52	H83	174.1°	60.1°
H81	C52	H82	H83	120.0°	120.0°
C53	N16	H84	C50	180.0°	178.5°
N16	C53	C54	C55	123.6°	121.9°
N16	C53	C54	H85	117.8°	118.0°
N16	C53	C55	H85	119.7°	119.2°
N16	C53	C54	O20	149.0°	32.0°
N16	C53	C55	S3	58.9°	71.7°
N16	C53	C55	H86	179.7°	49.1°
N16	C53	C55	H87	61.8°	168.5°
N16	C53	C54	N17	30.9°	147.7°
H84	N16	C53	C54	134.9°	122.0°
H84	N16	C53	C55	11.1°	116.4°
H84	N16	C53	H85	108.0°	3.6°
C54	C53	C55	H85	118.6°	119.8°
C53	C54	O20	N17	179.9°	179.7°
C54	C53	C55	S3	62.8°	167.3°
C54	C53	C55	H86	58.0°	71.8°
C54	C53	C55	H87	176.5°	47.5°
C53	C54	N17	C56	180.0°	179.8°
C53	C54	N17	H88	0.0°	0.7°
C54	C53	N16	C50	45.2°	59.5°
C55	C53	C54	O20	87.4°	89.8°
C53	C55	S3	H86	120.8°	121.3°
C53	C55	S3	H87	120.8°	119.6°
C53	C55	H86	H87	117.6°	119.4°
C55	C53	N16	C50	168.9°	62.2°
C55	C53	C54	N17	92.7°	90.4°
C53	C55	S3	S4	175.4°	122.2°
H85	C53	C54	O20	31.2°	150.0°
H85	C53	C55	S3	178.7°	47.5°
H85	C53	C55	H86	60.6°	168.4°
H85	C53	C55	H87	57.9°	72.3°
H85	C53	N16	C50	72.0°	177.8°
H85	C53	C54	N17	148.7°	29.7°
O20	C54	N17	C56	0.1°	0.1°
O20	C54	N17	H88	179.9°	179.5°
S3	C55	H86	H87	117.6°	119.2°
C55	S3	S4	C73	115.3°	85.5°
H86	C55	S3	S4	54.6°	116.5°
H87	C55	S3	S4	63.8°	2.5°
C56	N17	H88	C54	180.0°	179.4°
N17	C56	C57	C58	120.9°	120.3°
N17	C56	C57	H89	120.6°	120.4°
N17	C56	C58	H89	121.7°	120.6°
N17	C56	C57	O21	164.0°	27.7°
N17	C56	C58	C59	161.5°	58.7°
N17	C56	C58	H90	41.3°	178.7°
N17	C56	C58	H91	78.3°	61.3°
N17	C56	C57	N19	16.0°	152.0°
H88	N17	C56	C57	120.1°	26.6°
H88	N17	C56	C58	120.8°	93.3°
H88	N17	C56	H89	0.2°	146.3°
C57	C56	C58	H89	118.5°	118.7°
C56	C57	O21	N19	180.0°	179.7°
C57	C56	C58	C59	78.6°	62.1°
C57	C56	C58	H90	161.1°	57.9°
C57	C56	C58	H91	41.6°	178.0°
C56	C57	N19	C60	180.0°	179.6°
C56	C57	N19	H94	0.0°	1.3°
C57	C56	N17	C54	59.9°	152.8°
C58	C56	C57	O21	43.1°	92.6°
C56	C58	C59	H90	120.2°	120.0°
C56	C58	C59	H91	120.2°	120.0°
C56	C58	H90	H91	119.3°	120.0°
C56	C58	C59	O22	109.1°	2.7°
C56	C58	C59	N18	70.9°	177.3°
C58	C56	N17	C54	59.2°	87.3°
C58	C56	C57	N19	137.0°	87.8°
H89	C56	C57	O21	75.4°	148.1°
H89	C56	C58	C59	39.8°	179.3°
H89	C56	C58	H90	80.4°	60.7°
H89	C56	C58	H91	160.1°	59.3°
H89	C56	N17	C54	179.8°	33.2°
H89	C56	C57	N19	104.6°	31.6°
O21	C57	N19	C60	0.0°	0.1°
O21	C57	N19	H94	180.0°	178.3°
C59	C58	H90	H91	119.3°	120.0°
C58	C59	O22	N18	180.0°	180.0°
C58	C59	N18	H92	179.9°	0.0°
C58	C59	N18	H93	0.0°	180.0°
H90	C58	C59	O22	130.7°	122.7°
H90	C58	C59	N18	49.4°	57.3°
H91	C58	C59	O22	11.1°	117.3°
H91	C58	C59	N18	168.9°	62.7°
O22	C59	N18	H92	0.0°	180.0°
O22	C59	N18	H93	180.0°	0.0°
C59	N18	H92	H93	180.0°	180.0°
C60	N19	H94	C57	180.0°	178.3°
N19	C60	C61	C62	121.4°	123.3°
N19	C60	C61	H95	119.0°	117.9°
N19	C60	C62	H95	117.7°	117.0°
N19	C60	C61	O23	29.7°	48.4°
N19	C60	C62	O24	30.2°	75.5°
N19	C60	C62	C63	142.3°	44.4°
N19	C60	C62	H96	91.9°	164.5°
N19	C60	C61	N20	150.3°	132.3°
H94	N19	C60	C61	68.7°	105.2°
H94	N19	C60	C62	55.8°	130.6°
H94	N19	C60	H95	172.8°	13.4°
C61	C60	C62	H95	119.6°	119.2°
C60	C61	O23	N20	180.0°	179.4°
C61	C60	C62	O24	152.9°	48.3°
C61	C60	C62	C63	95.0°	168.2°
C61	C60	C62	H96	30.8°	71.7°
C60	C61	N20	C64	180.0°	126.6°
C60	C61	N20	C68	0.1°	56.5°
C61	C60	N19	C57	111.3°	73.0°
C62	C60	C61	O23	91.6°	171.8°
C60	C62	O24	C63	118.0°	120.0°
C60	C62	O24	H96	121.1°	120.0°
C60	C62	C63	H96	125.8°	120.1°
C60	C62	O24	H97	31.2°	96.8°
C60	C62	C63	H98	180.0°	60.0°
C60	C62	C63	H99	60.0°	180.0°
C60	C62	C63	H100	60.0°	60.0°
C62	C60	N19	C57	124.2°	51.2°
C62	C60	C61	N20	88.4°	9.0°
H95	C60	C61	O23	148.8°	69.5°
H95	C60	C62	O24	87.4°	167.5°
H95	C60	C62	C63	24.6°	72.5°
H95	C60	C62	H96	150.4°	47.5°
H95	C60	N19	C57	7.1°	168.4°
H95	C60	C61	N20	31.3°	109.8°
O23	C61	N20	C64	0.0°	54.2°
O23	C61	N20	C68	180.0°	122.7°
O24	C62	C63	H96	122.0°	120.0°
O24	C62	C63	H98	67.9°	60.0°
O24	C62	C63	H99	172.1°	60.0°
O24	C62	C63	H100	52.1°	180.0°
C63	C62	O24	H97	149.2°	23.2°
C62	C63	H98	H99	120.0°	120.0°
C62	C63	H98	H100	120.0°	120.0°
C62	C63	H99	H100	120.0°	119.9°
H96	C62	O24	H97	89.9°	143.2°
H96	C62	C63	H98	54.2°	180.0°
H96	C62	C63	H99	65.9°	59.9°
H96	C62	C63	H100	174.1°	60.0°
H98	C63	H99	H100	120.0°	120.1°
C64	N20	C68	C61	179.9°	177.4°
N20	C64	C65	C66	117.6°	118.4°
N20	C64	C65	H101	121.1°	120.4°
N20	C64	C66	H101	117.7°	120.0°
N20	C64	C65	O25	38.3°	52.1°
N20	C64	C66	C67	18.7°	0.3°
N20	C64	C66	H102	138.1°	119.2°
N20	C64	C66	H103	100.8°	119.0°
C64	N20	C68	C67	8.6°	26.2°
C64	N20	C68	H106	127.9°	92.1°
C64	N20	C68	H107	110.6°	146.2°
N20	C64	C65	N21	141.5°	128.9°
C68	N20	C64	C65	105.0°	135.1°
C68	N20	C64	C66	17.4°	16.2°
C68	N20	C64	H101	134.5°	104.4°
N20	C68	C67	C66	3.9°	25.8°
N20	C68	C67	H106	119.3°	118.4°
N20	C68	C67	H107	119.2°	120.7°
N20	C68	C67	H104	115.9°	93.1°
N20	C68	C67	H105	123.6°	144.6°
N20	C68	H106	H107	122.2°	122.7°
C65	C64	C66	H101	121.2°	120.8°
C64	C65	O25	N21	179.9°	179.1°
C65	C64	C66	C67	102.4°	118.8°
C65	C64	C66	H102	17.0°	0.0°
C65	C64	C66	H103	138.1°	121.8°
C64	C65	N21	C69	180.0°	6.6°
C64	C65	N21	H108	0.0°	173.1°
C65	C64	N20	C61	75.1°	47.6°
C66	C64	C65	O25	79.3°	66.3°
C64	C66	C67	H102	119.5°	118.7°
C64	C66	C67	H103	119.4°	119.2°
C64	C66	H102	H103	121.6°	121.7°
C64	C66	C67	C68	14.0°	15.9°
C64	C66	C67	H104	105.7°	103.0°
C64	C66	C67	H105	133.8°	134.7°
C66	C64	N20	C61	162.6°	166.5°
C66	C64	C65	N21	100.9°	112.7°
H101	C64	C65	O25	159.5°	172.5°
H101	C64	C66	C67	136.4°	120.4°
H101	C64	C66	H102	104.2°	120.8°
H101	C64	C66	H103	16.9°	1.0°
H101	C64	N20	C61	45.4°	72.9°
H101	C64	C65	N21	20.4°	8.5°
O25	C65	N21	C69	0.1°	172.4°
O25	C65	N21	H108	179.9°	7.8°
C67	C66	H102	H103	121.6°	122.3°
C66	C67	C68	H104	119.7°	118.9°
C66	C67	C68	H105	119.7°	118.8°
C66	C67	H104	H105	120.7°	122.2°
C66	C67	C68	H106	115.4°	92.6°
C66	C67	C68	H107	123.1°	146.5°
H102	C66	C67	C68	133.5°	134.6°
H102	C66	C67	H104	13.8°	15.7°
H102	C66	C67	H105	106.7°	106.7°
H103	C66	C67	C68	105.4°	103.3°
H103	C66	C67	H104	134.9°	137.8°
H103	C66	C67	H105	14.4°	15.5°
C68	C67	H104	H105	120.8°	122.1°
C67	C68	H106	H107	122.2°	121.3°
C67	C68	N20	C61	171.3°	156.4°
H104	C67	C68	H106	124.9°	148.5°
H104	C67	C68	H107	3.3°	27.5°
H105	C67	C68	H106	4.3°	26.2°
H105	C67	C68	H107	117.2°	94.7°
H106	C68	N20	C61	52.1°	85.3°
H107	C68	N20	C61	69.4°	36.4°
C69	N21	H108	C65	180.0°	179.8°
N21	C69	C70	H109	120.2°	120.0°
N21	C69	C70	H110	120.2°	119.1°
N21	C69	H109	H110	119.3°	121.3°
N21	C69	C70	O26	130.0°	49.6°
N21	C69	C70	N22	50.1°	131.5°
H108	N21	C69	C70	138.1°	2.7°
H108	N21	C69	H109	17.9°	116.9°
H108	N21	C69	H110	101.6°	121.5°
C70	C69	H109	H110	119.3°	120.2°
C69	C70	O26	N22	179.9°	178.9°
C69	C70	N22	C71	180.0°	165.3°
C69	C70	N22	H111	0.0°	14.6°
C70	C69	N21	C65	41.8°	177.5°
H109	C69	C70	O26	109.8°	70.4°
H109	C69	N21	C65	162.1°	62.9°
H109	C69	C70	N22	70.1°	108.5°
H110	C69	C70	O26	9.8°	168.7°
H110	C69	N21	C65	78.4°	58.7°
H110	C69	C70	N22	170.3°	12.4°
O26	C70	N22	C71	0.1°	15.8°
O26	C70	N22	H111	179.9°	164.3°
C71	N22	H111	C70	180.0°	179.9°
N22	C71	C72	C73	123.6°	124.7°
N22	C71	C72	H112	117.8°	118.0°
N22	C71	C73	H112	119.7°	118.7°
N22	C71	C72	O27	4.6°	66.4°
N22	C71	C73	S4	110.4°	78.9°
N22	C71	C73	H113	128.9°	42.6°
N22	C71	C73	H114	10.4°	162.3°
N22	C71	C72	N23	175.5°	113.0°
H111	N22	C71	C72	72.9°	42.3°
H111	N22	C71	C73	50.9°	166.4°
H111	N22	C71	H112	170.0°	75.3°
C72	C71	C73	H112	118.6°	117.3°
C71	C72	O27	N23	179.9°	179.5°
C72	C71	C73	S4	11.3°	157.1°
C72	C71	C73	H113	109.5°	81.4°
C72	C71	C73	H114	132.1°	38.3°
C71	C72	N23	C74	180.0°	171.9°
C71	C72	N23	H115	0.0°	8.1°
C72	C71	N22	C70	107.1°	137.8°
C73	C71	C72	O27	119.0°	168.8°
C71	C73	S4	H113	120.8°	121.8°
C71	C73	S4	H114	120.8°	118.9°
C71	C73	H113	H114	117.6°	120.1°
C73	C71	N22	C70	129.1°	13.6°
C73	C71	C72	N23	60.9°	11.7°
C71	C73	S4	S3	121.1°	177.3°
H112	C71	C72	O27	122.3°	51.6°
H112	C71	C73	S4	129.9°	39.8°
H112	C71	C73	H113	9.2°	161.3°
H112	C71	C73	H114	109.3°	79.0°
H112	C71	N22	C70	10.0°	104.6°
H112	C71	C72	N23	57.8°	129.0°
O27	C72	N23	C74	0.1°	8.7°
O27	C72	N23	H115	179.9°	171.3°
S4	C73	H113	H114	117.6°	119.6°
H113	C73	S4	S3	118.1°	55.5°
H114	C73	S4	S3	0.3°	63.8°
C74	N23	H115	C72	180.0°	180.0°
N23	C74	C75	C76	121.3°	119.9°
N23	C74	C75	H116	119.0°	121.1°
N23	C74	C76	H116	117.7°	119.2°
N23	C74	C75	O28	107.9°	1.3°
N23	C74	C76	O29	89.1°	65.0°
N23	C74	C76	C77	158.9°	55.0°
N23	C74	C76	H117	33.0°	175.0°
N23	C74	C75	N24	72.1°	178.2°
H115	N23	C74	C75	38.7°	40.7°
H115	N23	C74	C76	85.8°	79.4°
H115	N23	C74	H116	157.1°	161.7°
C75	C74	C76	H116	119.6°	119.2°
C74	C75	O28	N24	180.0°	179.4°
C75	C74	C76	O29	148.3°	56.6°
C75	C74	C76	C77	36.3°	176.6°
C75	C74	C76	H117	89.6°	63.4°
C74	C75	N24	C78	180.0°	177.5°
C74	C75	N24	H122	0.0°	2.9°
C75	C74	N23	C72	141.3°	139.3°
C76	C74	C75	O28	13.4°	118.6°
C74	C76	O29	C77	118.0°	120.0°
C74	C76	O29	H117	121.0°	120.0°
C74	C76	C77	H117	125.9°	120.0°
C74	C76	O29	H118	180.0°	60.1°
C74	C76	C77	H119	180.0°	60.0°
C74	C76	C77	H120	60.0°	180.0°
C74	C76	C77	H121	60.0°	60.0°
C76	C74	N23	C72	94.2°	100.6°
C76	C74	C75	N24	166.5°	61.9°
H116	C74	C75	O28	133.1°	122.4°
H116	C74	C76	O29	28.7°	175.8°
H116	C74	C76	C77	83.4°	64.2°
H116	C74	C76	H117	150.7°	55.9°
H116	C74	N23	C72	22.9°	18.3°
H116	C74	C75	N24	46.9°	57.1°
O28	C75	N24	C78	0.0°	3.1°
O28	C75	N24	H122	180.0°	176.5°
O29	C76	C77	H117	122.1°	120.0°
O29	C76	C77	H119	67.9°	60.0°
O29	C76	C77	H120	172.0°	60.0°
O29	C76	C77	H121	52.1°	180.0°
C77	C76	O29	H118	62.0°	180.0°
C76	C77	H119	H120	120.0°	120.0°
C76	C77	H119	H121	120.0°	120.0°
C76	C77	H120	H121	120.0°	119.9°
H117	C76	O29	H118	59.0°	59.9°
H117	C76	C77	H119	54.1°	180.0°
H117	C76	C77	H120	65.9°	60.0°
H117	C76	C77	H121	174.1°	60.0°
H119	C77	H120	H121	119.9°	120.0°
C78	N24	H122	C75	180.0°	179.6°
N24	C78	C79	C80	123.5°	122.9°
N24	C78	C79	H123	117.8°	120.0°
N24	C78	C80	H123	119.8°	119.2°
N24	C78	C79	O30	65.5°	104.4°
N24	C78	C80	S5	175.0°	81.7°
N24	C78	C80	H124	64.2°	39.1°
N24	C78	C80	H125	54.2°	159.0°
N24	C78	C79	N25	114.6°	75.7°
H122	N24	C78	C79	141.2°	115.8°
H122	N24	C78	C80	17.6°	122.2°
H122	N24	C78	H123	101.6°	3.7°
C79	C78	C80	H123	118.7°	117.4°
C78	C79	O30	N25	180.0°	179.9°
C79	C78	C80	S5	53.4°	154.9°
C79	C78	C80	H124	174.2°	84.3°
C79	C78	C80	H125	67.3°	35.7°
C78	C79	N25	C81	180.0°	179.4°
C78	C79	N25	H126	0.0°	1.3°
C79	C78	N24	C75	38.8°	63.8°
C80	C78	C79	O30	58.0°	18.5°
C78	C80	S5	H124	120.8°	121.1°
C78	C80	S5	H125	120.8°	119.2°
C78	C80	H124	H125	117.6°	119.8°
C80	C78	N24	C75	162.4°	58.2°
C80	C78	C79	N25	121.9°	161.4°
C78	C80	S5	S2	54.2°	108.8°
H123	C78	C79	O30	176.7°	135.6°
H123	C78	C80	S5	65.2°	37.6°
H123	C78	C80	H124	55.6°	158.4°
H123	C78	C80	H125	174.0°	81.7°
H123	C78	N24	C75	78.4°	176.7°
H123	C78	C79	N25	3.3°	44.3°
O30	C79	N25	C81	0.1°	0.7°
O30	C79	N25	H126	179.9°	178.6°
S5	C80	H124	H125	117.6°	119.6°
H124	C80	S5	S2	66.6°	130.1°
H125	C80	S5	S2	175.0°	10.4°
C81	N25	H126	C79	180.0°	179.3°
N25	C81	C82	C83	122.9°	119.9°
N25	C81	C82	H127	119.0°	120.4°
N25	C81	C83	H127	119.7°	120.2°
N25	C81	C82	O31	167.8°	65.4°
N25	C81	C83	O32	168.6°	65.0°
N25	C81	C83	H128	71.0°	55.0°
N25	C81	C83	H129	48.3°	175.0°
N25	C81	C82	N26	12.1°	114.6°
H126	N25	C81	C82	59.1°	21.8°
H126	N25	C81	C83	63.3°	97.9°
H126	N25	C81	H127	177.5°	141.9°
C82	C81	C83	H127	118.0°	119.4°
C81	C82	O31	N26	179.9°	179.9°
C82	C81	C83	O32	46.4°	174.6°
C82	C81	C83	H128	166.7°	65.4°
C82	C81	C83	H129	74.0°	54.6°
C81	C82	N26	C84	180.0°	179.1°
C81	C82	N26	H131	0.0°	0.4°
C82	C81	N25	C79	120.9°	157.4°
C83	C81	C82	O31	69.3°	54.5°
C81	C83	O32	H128	120.4°	120.0°
C81	C83	O32	H129	120.4°	120.0°
C81	C83	H128	H129	118.9°	120.0°
C81	C83	O32	H130	18.5°	180.0°
C83	C81	N25	C79	116.7°	82.8°
C83	C81	C82	N26	110.8°	125.4°
H127	C81	C82	O31	48.8°	174.2°
H127	C81	C83	O32	71.7°	55.2°
H127	C81	C83	H128	48.7°	175.2°
H127	C81	C83	H129	168.0°	64.8°
H127	C81	N25	C79	2.4°	37.3°
H127	C81	C82	N26	131.1°	5.7°
O31	C82	N26	C84	0.1°	1.0°
O31	C82	N26	H131	179.9°	179.5°
O32	C83	H128	H129	118.9°	120.0°
H128	C83	O32	H130	138.9°	60.0°
H129	C83	O32	H130	101.9°	59.9°
C84	N26	H131	C82	180.0°	179.5°
N26	C84	C85	C86	123.2°	119.7°
N26	C84	C85	H132	117.5°	120.4°
N26	C84	C86	H132	119.2°	119.7°
N26	C84	C85	O33	42.8°	18.1°
N26	C84	C86	C87	125.9°	172.2°
N26	C84	C86	H133	5.3°	52.2°
N26	C84	C86	H134	113.4°	67.7°
N26	C84	C85	N28	137.3°	161.1°
H131	N26	C84	C85	117.5°	21.9°
H131	N26	C84	C86	118.0°	97.8°
H131	N26	C84	H132	0.6°	142.4°
C85	C84	C86	H132	119.2°	120.0°
C84	C85	O33	N28	179.9°	179.2°
C85	C84	C86	C87	112.5°	67.5°
C85	C84	C86	H133	126.8°	172.6°
C85	C84	C86	H134	8.2°	52.6°
C84	C85	N28	C95	0.0°	162.6°
C84	C85	N28	C99	179.9°	19.7°
C85	C84	N26	C82	62.5°	158.6°
C86	C84	C85	O33	80.4°	101.6°
C84	C86	C87	H133	120.7°	119.9°
C84	C86	C87	H134	120.7°	120.0°
C84	C86	H133	H134	117.9°	120.0°
C84	C86	C87	C88	98.4°	82.7°
C84	C86	C87	C89	81.6°	97.0°
C86	C84	N26	C82	62.0°	81.7°
C86	C84	C85	N28	99.5°	79.3°
H132	C84	C85	O33	160.4°	138.5°
H132	C84	C86	C87	6.7°	52.5°
H132	C84	C86	H133	114.0°	67.5°
H132	C84	C86	H134	127.4°	172.6°
H132	C84	N26	C82	179.4°	38.2°
H132	C84	C85	N28	19.7°	40.7°
O33	C85	N28	C95	179.9°	18.2°
O33	C85	N28	C99	0.0°	159.5°
C87	C86	H133	H134	117.9°	120.1°
C86	C87	C88	C89	180.0°	179.8°
C86	C87	C88	N27	179.9°	180.0°
C86	C87	C88	H135	0.0°	0.1°
C86	C87	C89	C90	180.0°	180.0°
C86	C87	C89	C91	0.0°	0.0°
H133	C86	C87	C88	22.3°	157.4°
H133	C86	C87	C89	157.7°	22.9°
H134	C86	C87	C88	141.0°	37.4°
H134	C86	C87	C89	39.1°	142.9°
C87	C88	N27	H135	180.0°	179.9°
C88	C87	C89	C90	0.0°	0.3°
C88	C87	C89	C91	180.0°	179.7°
C87	C88	N27	C90	0.0°	0.2°
C87	C88	N27	H136	180.0°	180.0°
C89	C87	C88	N27	0.0°	0.3°
C89	C87	C88	H135	180.0°	179.8°
C87	C89	C90	C91	180.0°	180.0°
C87	C89	C90	N27	0.0°	0.1°
C87	C89	C90	C92	180.0°	180.0°
C87	C89	C91	C93	180.0°	180.0°
C87	C89	C91	H137	0.1°	0.0°
C88	N27	C90	C89	0.0°	0.0°
C88	N27	C90	H136	180.0°	179.8°
C88	N27	C90	C92	180.0°	179.8°
H135	C88	N27	C90	180.0°	179.9°
H135	C88	N27	H136	0.0°	0.1°
C89	C90	N27	C92	180.0°	179.9°
C89	C90	N27	H136	180.0°	179.9°
C90	C89	C91	C93	0.0°	0.1°
C90	C89	C91	H137	179.9°	180.0°
C89	C90	C92	C94	0.1°	0.0°
C89	C90	C92	H138	179.9°	180.0°
C91	C89	C90	N27	180.0°	179.8°
C91	C89	C90	C92	0.0°	0.0°
C89	C91	C93	H137	180.0°	180.0°
C89	C91	C93	C94	0.0°	0.1°
C89	C91	C93	H139	180.0°	180.0°
N27	C90	C92	C94	179.9°	179.8°
N27	C90	C92	H138	0.0°	0.2°
H136	N27	C90	C92	0.0°	0.0°
C90	C92	C94	H138	180.0°	179.9°
C90	C92	C94	C93	0.1°	0.1°
C90	C92	C94	H140	179.9°	180.0°
C91	C93	C94	C92	0.1°	0.1°
C91	C93	C94	H139	180.0°	179.9°
C91	C93	C94	H140	179.9°	179.9°
H137	C91	C93	C94	180.0°	179.9°
H137	C91	C93	H139	0.0°	0.0°
C92	C94	C93	H140	180.0°	179.9°
C92	C94	C93	H139	179.9°	180.0°
H138	C92	C94	C93	179.9°	179.9°
H138	C92	C94	H140	0.1°	0.0°
H139	C93	C94	H140	0.1°	0.1°
C95	N28	C99	C85	180.0°	178.1°
N28	C95	C96	C97	117.7°	120.6°
N28	C95	C96	H141	121.1°	120.5°
N28	C95	C97	H141	117.7°	117.0°
N28	C95	C96	O34	160.3°	37.6°
N28	C95	C97	C98	18.7°	23.9°
N28	C95	C97	H142	138.1°	94.5°
N28	C95	C97	H143	100.8°	142.6°
C95	N28	C99	C98	8.6°	0.2°
C95	N28	C99	H146	127.8°	119.5°
C95	N28	C99	H147	110.7°	119.7°
N28	C95	C96	N29	19.7°	142.6°
C99	N28	C95	C96	105.1°	137.4°
C99	N28	C95	C97	17.4°	15.0°
C99	N28	C95	H141	134.5°	101.7°
N28	C99	C98	C97	3.9°	15.2°
N28	C99	C98	H146	119.2°	119.3°
N28	C99	C98	H147	119.3°	120.1°
N28	C99	C98	H144	115.8°	133.9°
N28	C99	C98	H145	123.7°	103.6°
N28	C99	H146	H147	122.2°	120.9°
C96	C95	C97	H141	121.1°	119.6°
C95	C96	O34	N29	179.9°	179.8°
C96	C95	C97	C98	102.4°	147.3°
C96	C95	C97	H142	17.0°	28.9°
C96	C95	C97	H143	138.1°	94.0°
C95	C96	N29	C100	180.0°	174.0°
C95	C96	N29	H148	0.0°	5.9°
C96	C95	N28	C85	75.0°	44.6°
C97	C95	C96	O34	82.0°	158.3°
C95	C97	C98	H142	119.4°	118.4°
C95	C97	C98	H143	119.5°	118.7°
C95	C97	H142	H143	121.6°	122.8°
C95	C97	C98	C99	14.1°	23.3°
C95	C97	C98	H144	105.7°	142.1°
C95	C97	C98	H145	133.9°	95.6°
C97	C95	N28	C85	162.6°	167.0°
C97	C95	C96	N29	98.0°	21.9°
H141	C95	C96	O34	39.2°	82.8°
H141	C95	C97	C98	136.4°	93.1°
H141	C95	C97	H142	104.1°	148.6°
H141	C95	C97	H143	17.0°	25.6°
H141	C95	N28	C85	45.5°	76.3°
H141	C95	C96	N29	140.8°	97.0°
O34	C96	N29	C100	0.1°	5.8°
O34	C96	N29	H148	180.0°	174.3°
C98	C97	H142	H143	121.7°	122.8°
C97	C98	C99	H144	119.7°	118.8°
C97	C98	C99	H145	119.8°	118.8°
C97	C98	H144	H145	120.7°	122.1°
C97	C98	C99	H146	115.3°	134.4°
C97	C98	C99	H147	123.2°	104.9°
H142	C97	C98	C99	133.5°	95.1°
H142	C97	C98	H144	13.8°	23.7°
H142	C97	C98	H145	106.7°	146.1°
H143	C97	C98	C99	105.4°	142.0°
H143	C97	C98	H144	134.9°	99.3°
H143	C97	C98	H145	14.4°	23.1°
C99	C98	H144	H145	120.8°	122.3°
C98	C99	H146	H147	122.2°	120.7°
C98	C99	N28	C85	171.4°	177.9°
H144	C98	C99	H146	124.9°	106.8°
H144	C98	C99	H147	3.5°	13.9°
H145	C98	C99	H146	4.4°	15.6°
H145	C98	C99	H147	117.1°	136.3°
H146	C99	N28	C85	52.1°	58.6°
H147	C99	N28	C85	69.3°	62.2°
C100	N29	H148	C96	180.0°	179.9°
N29	C100	C101	C102	122.7°	123.1°
N29	C100	C101	H149	118.1°	119.5°
N29	C100	C102	H149	118.5°	116.5°
N29	C100	C101	O35	29.7°	67.2°
N29	C100	C102	C103	156.8°	179.9°
N29	C100	C102	C104	32.9°	60.0°
N29	C100	C102	H150	85.2°	60.0°
N29	C100	C101	N30	150.3°	112.6°
H148	N29	C100	C101	66.2°	39.3°
H148	N29	C100	C102	58.3°	84.7°
H148	N29	C100	H149	176.3°	158.8°
C101	C100	C102	H149	119.1°	117.4°
C100	C101	O35	N30	179.9°	179.8°
C101	C100	C102	C103	80.9°	53.9°
C101	C100	C102	C104	155.2°	173.9°
C101	C100	C102	H150	37.1°	66.0°
C100	C101	N30	C105	180.0°	160.6°
C100	C101	N30	H157	0.0°	21.4°
C101	C100	N29	C96	113.8°	140.8°
C102	C100	C101	O35	93.0°	169.7°
C100	C102	C103	C104	123.9°	120.0°
C100	C102	C103	H150	118.1°	119.9°
C100	C102	C104	H150	118.1°	120.0°
C100	C102	C103	H151	180.0°	60.0°
C100	C102	C103	H152	60.0°	180.0°
C100	C102	C103	H153	60.0°	59.9°
C100	C102	C104	H154	180.0°	60.0°
C100	C102	C104	H155	60.0°	180.0°
C100	C102	C104	H156	60.0°	60.0°
C102	C100	N29	C96	121.7°	95.3°
C102	C100	C101	N30	87.0°	10.5°
H149	C100	C101	O35	147.8°	52.3°
H149	C100	C102	C103	38.3°	63.5°
H149	C100	C102	C104	85.6°	56.5°
H149	C100	C102	H150	156.3°	176.6°
H149	C100	N29	C96	3.7°	21.3°
H149	C100	C101	N30	32.1°	127.9°
O35	C101	N30	C105	0.1°	19.6°
O35	C101	N30	H157	179.9°	158.4°
C103	C102	C104	H150	118.0°	120.0°
C102	C103	H151	H152	120.0°	119.9°
C102	C103	H151	H153	120.0°	119.9°
C102	C103	H152	H153	120.0°	120.0°
C103	C102	C104	H154	56.2°	180.0°
C103	C102	C104	H155	63.8°	60.0°
C103	C102	C104	H156	176.2°	60.0°
C104	C102	C103	H151	56.1°	60.0°
C104	C102	C103	H152	176.1°	59.9°
C104	C102	C103	H153	63.9°	180.0°
C102	C104	H154	H155	120.0°	120.0°
C102	C104	H154	H156	120.0°	119.9°
C102	C104	H155	H156	120.0°	120.0°
H150	C102	C103	H151	62.0°	179.9°
H150	C102	C103	H152	58.0°	60.1°
H150	C102	C103	H153	178.0°	60.0°
H150	C102	C104	H154	61.9°	60.0°
H150	C102	C104	H155	178.1°	60.0°
H150	C102	C104	H156	58.1°	180.0°
H151	C103	H152	H153	119.9°	120.1°
H154	C104	H155	H156	120.0°	120.0°
C105	N30	H157	C101	180.0°	178.1°
N30	C105	C106	C107	123.5°	118.3°
N30	C105	C106	H158	117.8°	121.4°
N30	C105	C107	H158	119.7°	120.8°
N30	C105	C106	O36	13.3°	103.9°
N30	C105	C107	S6	89.3°	134.5°
N30	C105	C107	H159	149.9°	14.5°
N30	C105	C107	H160	31.5°	105.2°
N30	C105	C106	N31	166.6°	75.9°
H157	N30	C105	C106	102.3°	19.6°
H157	N30	C105	C107	21.3°	98.7°
H157	N30	C105	H158	140.5°	140.6°
C106	C105	C107	H158	118.6°	120.0°
C105	C106	O36	N31	179.8°	179.9°
C106	C105	C107	S6	32.4°	106.3°
C106	C105	C107	H159	88.4°	133.6°
C106	C105	C107	H160	153.1°	14.0°
C105	C106	N31	C108	179.9°	175.2°
C105	C106	N31	H161	0.1°	5.2°
C106	C105	N30	C101	77.6°	158.4°
C107	C105	C106	O36	110.3°	137.8°
C105	C107	S6	H159	120.8°	120.1°
C105	C107	S6	H160	120.8°	120.4°
C105	C107	H159	H160	117.6°	119.9°
C107	C105	N30	C101	158.7°	83.2°
C107	C105	C106	N31	69.9°	42.4°
C105	C107	S6	S1	80.1°	163.5°
H158	C105	C106	O36	131.1°	17.4°
H158	C105	C107	S6	151.0°	13.7°
H158	C105	C107	H159	30.2°	106.3°
H158	C105	C107	H160	88.2°	134.0°
H158	C105	N30	C101	39.6°	37.4°
H158	C105	C106	N31	48.8°	162.7°
O36	C106	N31	C108	0.1°	4.9°
O36	C106	N31	H161	179.9°	174.6°
S6	C107	H159	H160	117.6°	119.6°
H159	C107	S6	S1	159.1°	76.4°
H160	C107	S6	S1	40.7°	43.1°
C108	N31	H161	C106	180.0°	179.6°
N31	C108	C109	C110	121.4°	119.8°
N31	C108	C109	H162	119.0°	120.4°
N31	C108	C110	H162	117.7°	120.1°
N31	C108	C109	O37	5.4°	5.2°
N31	C108	C110	O38	39.8°	65.0°
N31	C108	C110	C111	72.2°	55.0°
N31	C108	C110	H163	162.0°	175.0°
N31	C108	C109	N32	174.6°	174.8°
H161	N31	C108	C109	46.6°	14.8°
H161	N31	C108	C110	77.9°	104.9°
H161	N31	C108	H162	165.0°	135.1°
C109	C108	C110	H162	119.6°	119.8°
C108	C109	O37	N32	180.0°	180.0°
C109	C108	C110	O38	82.9°	55.1°
C109	C108	C110	C111	165.1°	175.1°
C109	C108	C110	H163	39.3°	64.9°
C108	C109	N32	C112	179.9°	176.3°
C108	C109	N32	H168	0.1°	4.2°
C109	C108	N31	C106	133.4°	164.8°
C110	C108	C109	O37	115.9°	114.6°
C108	C110	O38	C111	118.0°	120.0°
C108	C110	O38	H163	121.0°	120.0°
C108	C110	C111	H163	125.8°	120.0°
C108	C110	O38	H164	15.2°	60.0°
C108	C110	C111	H165	180.0°	59.9°
C108	C110	C111	H166	60.0°	179.9°
C108	C110	C111	H167	60.0°	60.0°
C110	C108	N31	C106	102.1°	75.5°
C110	C108	C109	N32	64.0°	65.5°
H162	C108	C109	O37	124.5°	125.6°
H162	C108	C110	O38	157.6°	174.9°
H162	C108	C110	C111	45.5°	65.1°
H162	C108	C110	H163	80.3°	54.9°
H162	C108	N31	C106	14.9°	44.5°
H162	C108	C109	N32	55.6°	54.4°
O37	C109	N32	C112	0.0°	3.8°
O37	C109	N32	H168	180.0°	175.8°
O38	C110	C111	H163	122.1°	120.1°
O38	C110	C111	H165	67.9°	60.0°
O38	C110	C111	H166	172.1°	60.0°
O38	C110	C111	H167	52.1°	180.0°
C111	C110	O38	H164	102.9°	60.0°
C110	C111	H165	H166	120.0°	120.0°
C110	C111	H165	H167	120.0°	120.0°
C110	C111	H166	H167	120.0°	120.0°
H163	C110	O38	H164	136.2°	180.0°
H163	C110	C111	H165	54.2°	179.9°
H163	C110	C111	H166	65.8°	60.1°
H163	C110	C111	H167	174.2°	60.0°
H165	C111	H166	H167	120.0°	120.0°
C112	N32	H168	C109	180.0°	179.5°
N32	C112	C113	C114	122.4°	120.0°
N32	C112	C113	H169	119.7°	120.1°
N32	C112	C114	H169	120.1°	120.1°
N32	C112	C113	O39	94.3°	90.0°
N32	C112	C114	C115	163.3°	65.0°
N32	C112	C114	H170	43.1°	55.0°
N32	C112	C114	H171	76.5°	175.0°
N32	C112	C113	N1	62.7°	90.5°
H168	N32	C112	C113	62.3°	51.4°
H168	N32	C112	C114	59.0°	68.7°
H168	N32	C112	H169	178.5°	171.3°
C113	C112	C114	H169	117.9°	119.9°
C112	C113	O39	N1	153.8°	179.6°
C113	C112	C114	C115	74.8°	175.0°
C113	C112	C114	H170	165.0°	65.0°
C113	C112	C114	H171	45.5°	55.1°
C113	C112	N32	C109	117.7°	129.1°
C114	C112	C113	O39	28.1°	30.0°
C112	C114	C115	H170	120.2°	120.0°
C112	C114	C115	H171	120.2°	120.0°
C112	C114	H170	H171	119.3°	120.0°
C112	C114	C115	C116	153.4°	180.0°
C112	C114	C115	H172	33.2°	60.0°
C112	C114	C115	H173	86.4°	60.0°
C114	C112	N32	C109	121.0°	110.8°
C114	C112	C113	N1	174.9°	149.6°
H169	C112	C113	O39	146.0°	150.0°
H169	C112	C114	C115	43.1°	55.1°
H169	C112	C114	H170	77.1°	175.1°
H169	C112	C114	H171	163.4°	64.8°
H169	C112	N32	C109	1.5°	9.2°
H169	C112	C113	N1	57.0°	29.6°
C115	C114	H170	H171	119.3°	120.0°
C114	C115	C116	H172	120.2°	120.0°
C114	C115	C116	H173	120.2°	120.0°
C114	C115	H172	H173	119.3°	120.0°
C114	C115	C116	N33	99.0°	180.0°
C114	C115	C116	H174	21.1°	60.0°
C114	C115	C116	H175	140.9°	60.0°
H170	C114	C115	C116	86.4°	60.0°
H170	C114	C115	H172	153.4°	180.0°
H170	C114	C115	H173	33.8°	60.0°
H171	C114	C115	C116	33.2°	60.0°
H171	C114	C115	H172	87.1°	60.0°
H171	C114	C115	H173	153.4°	180.0°
C116	C115	H172	H173	119.3°	120.0°
C115	C116	N33	H174	120.1°	120.0°
C115	C116	N33	H175	120.1°	120.0°
C115	C116	H174	H175	119.8°	120.0°
C115	C116	N33	C117	168.7°	180.0°
C115	C116	N33	H176	11.4°	0.0°
H172	C115	C116	N33	140.8°	60.0°
H172	C115	C116	H174	99.2°	180.0°
H172	C115	C116	H175	20.7°	60.0°
H173	C115	C116	N33	21.2°	60.0°
H173	C115	C116	H174	141.3°	60.0°
H173	C115	C116	H175	98.8°	180.0°
N33	C116	H174	H175	119.7°	120.0°
C116	N33	C117	H176	180.0°	180.0°
C116	N33	C117	N34	0.1°	0.0°
C116	N33	C117	N35	180.0°	180.0°
H174	C116	N33	C117	48.6°	60.0°
H174	C116	N33	H176	131.5°	120.0°
H175	C116	N33	C117	71.3°	60.0°
H175	C116	N33	H176	108.7°	120.0°
N33	C117	N34	N35	179.9°	180.0°
N33	C117	N34	H177	179.9°	0.0°
N33	C117	N34	H178	0.1°	180.0°
N33	C117	N35	H179	179.9°	180.0°
N33	C117	N35	H180	0.1°	0.0°
H176	N33	C117	N34	179.9°	180.0°
H176	N33	C117	N35	0.0°	0.0°
C117	N34	H177	H178	180.0°	179.9°
N34	C117	N35	H179	0.0°	0.0°
N34	C117	N35	H180	180.0°	180.0°
N35	C117	N34	H177	0.0°	180.0°
N35	C117	N34	H178	180.0°	0.0°
C117	N35	H179	H180	180.0°	180.0°

Release date:	2020-08-12
Last modified:	2023-09-20
Processing site:	PDBE