A1A8B

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O3	P1	doub	0.00Å	1.50Å
O35	C40	sing	0.00Å	1.42Å
C2	O1	sing	0.00Å	1.45Å
C2	C1	sing	0.00Å	1.47Å
O2	P1	sing	0.00Å	1.50Å
P1	O1	sing	0.00Å	1.60Å
P1	O4	sing	0.00Å	1.60Å
C40	C39	sing	0.00Å	1.51Å
C40	C17	sing	0.00Å	1.52Å
O34	C39	sing	0.00Å	1.42Å
C39	C38	sing	0.00Å	1.53Å
O31	C36	sing	0.00Å	1.43Å
O14	C15	sing	0.00Å	1.43Å
O32	C37	sing	0.00Å	1.42Å
O4	C3	sing	0.00Å	1.46Å
C17	O16	sing	0.00Å	1.41Å
C17	O15	sing	0.00Å	1.40Å
C16	C15	sing	0.00Å	1.52Å
C16	C3	sing	0.00Å	1.52Å
C16	O15	sing	0.00Å	1.43Å
C37	C36	sing	0.00Å	1.51Å
C37	C20	sing	0.00Å	1.52Å
C36	C35	sing	0.00Å	1.53Å
O21	C25	sing	0.00Å	1.42Å
C15	C14	sing	0.00Å	1.52Å
O8	C8	doub	0.00Å	1.20Å
C3	C4	sing	0.00Å	1.52Å
O16	C18	sing	0.00Å	1.43Å
C38	O33	sing	0.00Å	1.42Å
C38	C18	sing	0.00Å	1.53Å
C7	O7	sing	0.00Å	1.44Å
C7	C6	sing	0.00Å	1.51Å
O17	C20	sing	0.00Å	1.40Å
O17	C19	sing	0.00Å	1.43Å
C20	O18	sing	0.00Å	1.41Å
C8	O7	sing	0.00Å	1.34Å
C8	C9	sing	0.00Å	1.49Å
C25	C24	sing	0.00Å	1.51Å
C35	O30	sing	0.00Å	1.43Å
C35	C21	sing	0.00Å	1.54Å
C18	C19	sing	0.00Å	1.51Å
O6	C6	sing	0.00Å	1.44Å
O6	C5	sing	0.00Å	1.42Å
C14	O13	sing	0.00Å	1.43Å
C14	C13	sing	0.00Å	1.52Å
C22	C21	sing	0.00Å	1.51Å
C22	O19	sing	0.00Å	1.44Å
C6	C10	sing	0.00Å	1.51Å
C4	O5	sing	0.00Å	1.43Å
C4	C13	sing	0.00Å	1.52Å
O5	C5	sing	0.00Å	1.40Å
O18	C21	sing	0.00Å	1.44Å
C24	O20	sing	0.00Å	1.43Å
C24	C26	sing	0.00Å	1.51Å
C13	O12	sing	0.00Å	1.43Å
C5	C12	sing	0.00Å	1.52Å
O22	C26	sing	0.00Å	1.42Å
O20	C23	sing	0.00Å	1.42Å
O19	C23	sing	0.00Å	1.40Å
C12	C11	sing	0.00Å	1.51Å
C12	O11	sing	0.00Å	1.42Å
C26	C27	sing	0.00Å	1.52Å
C10	C11	sing	0.00Å	1.51Å
C10	O9	sing	0.00Å	1.42Å
C11	O10	sing	0.00Å	1.42Å
C23	C28	sing	0.00Å	1.53Å
C27	C28	sing	0.00Å	1.53Å
C27	O23	sing	0.00Å	1.43Å
C28	O24	sing	0.00Å	1.43Å
O24	C29	sing	0.00Å	1.41Å
O29	C34	sing	0.00Å	1.42Å
C29	O25	sing	0.00Å	1.42Å
C29	C34	sing	0.00Å	1.52Å
O25	C30	sing	0.00Å	1.44Å
C34	C33	sing	0.00Å	1.51Å
O28	C33	sing	0.00Å	1.43Å
C31	C30	sing	0.00Å	1.51Å
C31	O26	sing	0.00Å	1.43Å
C30	C32	sing	0.00Å	1.52Å
C33	C32	sing	0.00Å	1.52Å
C32	O27	sing	0.00Å	1.42Å
C4	H1	sing	0.00Å	1.10Å
C5	H2	sing	0.00Å	1.10Å
C6	H3	sing	0.00Å	1.10Å
C7	H4	sing	0.00Å	1.10Å
C7	H5	sing	0.00Å	1.10Å
C10	H6	sing	0.00Å	1.10Å
C13	H7	sing	0.00Å	1.10Å
C15	H8	sing	0.00Å	1.10Å
C17	H9	sing	0.00Å	1.10Å
C20	H10	sing	0.00Å	1.10Å
C21	H11	sing	0.00Å	1.10Å
C22	H12	sing	0.00Å	1.10Å
C22	H13	sing	0.00Å	1.10Å
C24	H14	sing	0.00Å	1.10Å
C26	H15	sing	0.00Å	1.10Å
C28	H16	sing	0.00Å	1.10Å
C1	H17	sing	0.00Å	1.07Å
C2	H20	sing	0.00Å	1.10Å
C2	H21	sing	0.00Å	1.10Å
O2	H22	sing	0.00Å	0.95Å
C3	H23	sing	0.00Å	1.10Å
C9	H24	sing	0.00Å	1.10Å
C9	H25	sing	0.00Å	1.10Å
O9	H27	sing	0.00Å	0.95Å
O10	H28	sing	0.00Å	0.95Å
C11	H29	sing	0.00Å	1.10Å
O11	H30	sing	0.00Å	0.95Å
C12	H31	sing	0.00Å	1.10Å
O12	H32	sing	0.00Å	0.95Å
O13	H33	sing	0.00Å	0.95Å
C14	H34	sing	0.00Å	1.10Å
O14	H35	sing	0.00Å	0.95Å
C16	H36	sing	0.00Å	1.10Å
C18	H37	sing	0.00Å	1.10Å
C19	H38	sing	0.00Å	1.10Å
C19	H39	sing	0.00Å	1.10Å
O21	H40	sing	0.00Å	0.95Å
O22	H41	sing	0.00Å	0.95Å
C23	H42	sing	0.00Å	1.10Å
O23	H43	sing	0.00Å	0.95Å
C25	H44	sing	0.00Å	1.10Å
C25	H45	sing	0.00Å	1.10Å
O26	H46	sing	0.00Å	0.95Å
C27	H47	sing	0.00Å	1.10Å
O27	H48	sing	0.00Å	0.95Å
O28	H49	sing	0.00Å	0.95Å
C29	H50	sing	0.00Å	1.10Å
O29	H51	sing	0.00Å	0.95Å
C30	H52	sing	0.00Å	1.10Å
O30	H53	sing	0.00Å	0.95Å
C31	H54	sing	0.00Å	1.10Å
C31	H55	sing	0.00Å	1.10Å
O31	H56	sing	0.00Å	0.95Å
C32	H57	sing	0.00Å	1.10Å
O32	H58	sing	0.00Å	0.95Å
C33	H59	sing	0.00Å	1.10Å
O33	H60	sing	0.00Å	0.95Å
C34	H61	sing	0.00Å	1.10Å
O34	H62	sing	0.00Å	0.95Å
C35	H63	sing	0.00Å	1.10Å
O35	H64	sing	0.00Å	0.95Å
C36	H65	sing	0.00Å	1.10Å
C37	H66	sing	0.00Å	1.10Å
C38	H67	sing	0.00Å	1.10Å
C39	H68	sing	0.00Å	1.10Å
C40	H69	sing	0.00Å	1.10Å
C9	C41	sing	0.00Å	286.04Å
C41	C42	sing	0.00Å	0.00Å
C42	C43	sing	0.00Å	0.00Å
C43	C44	sing	0.00Å	0.00Å
C44	C45	sing	0.00Å	0.00Å
C45	C46	sing	0.00Å	0.00Å
C46	C47	sing	0.00Å	0.00Å
C47	C48	sing	0.00Å	0.00Å
C48	C49	sing	0.00Å	0.00Å
C49	C50	sing	0.00Å	0.00Å
C50	C51	sing	0.00Å	0.00Å
C51	C52	sing	0.00Å	0.00Å
C52	C53	sing	0.00Å	0.00Å
C53	C54	sing	0.00Å	0.00Å
C1	O38	sing	0.00Å	287.60Å
C1	C56	sing	0.00Å	287.60Å
C56	O36	sing	0.00Å	0.00Å
O36	C58	sing	0.00Å	0.00Å
C58	C57	sing	0.00Å	0.00Å
C57	C59	sing	0.00Å	0.00Å
C58	O37	doub	0.00Å	0.00Å
C59	C55	sing	0.00Å	0.00Å
C55	C60	sing	0.00Å	0.00Å
C60	C61	sing	0.00Å	0.00Å
C61	C62	sing	0.00Å	0.00Å
C62	C63	sing	0.00Å	0.00Å
C63	C64	sing	0.00Å	0.00Å
C64	C65	sing	0.00Å	0.00Å
C65	C66	sing	0.00Å	0.00Å
C66	C67	sing	0.00Å	0.00Å
C67	C68	sing	0.00Å	0.00Å
C68	C69	sing	0.00Å	0.00Å
C69	C70	sing	0.00Å	0.00Å
C70	C71	sing	0.00Å	0.00Å
O38	C72	sing	0.00Å	0.00Å
C72	C73	sing	0.00Å	0.00Å
C72	O39	doub	0.00Å	0.00Å
C73	C74	sing	0.00Å	0.00Å
C74	C75	sing	0.00Å	0.00Å
C75	C76	sing	0.00Å	0.00Å
C76	C77	sing	0.00Å	0.00Å
C77	C78	sing	0.00Å	0.00Å
C78	C79	sing	0.00Å	0.00Å
C79	C80	sing	0.00Å	0.00Å
C80	C81	sing	0.00Å	0.00Å
C81	C82	sing	0.00Å	0.00Å
C82	C83	sing	0.00Å	0.00Å
C83	C84	sing	0.00Å	0.00Å
C84	C85	sing	0.00Å	0.00Å
C85	C86	sing	0.00Å	0.00Å
C86	C87	sing	0.00Å	0.00Å
C87	C88	sing	0.00Å	0.00Å
C88	C89	sing	0.00Å	0.00Å
C81	C90	sing	0.00Å	0.00Å
C41	H18	sing	0.00Å	0.00Å
C41	H19	sing	0.00Å	0.00Å
C42	H26	sing	0.00Å	0.00Å
C42	H70	sing	0.00Å	0.00Å
C43	H71	sing	0.00Å	0.00Å
C43	H72	sing	0.00Å	0.00Å
C44	H73	sing	0.00Å	0.00Å
C44	H74	sing	0.00Å	0.00Å
C45	H75	sing	0.00Å	0.00Å
C45	H76	sing	0.00Å	0.00Å
C46	H77	sing	0.00Å	0.00Å
C46	H78	sing	0.00Å	0.00Å
C47	H79	sing	0.00Å	0.00Å
C47	H80	sing	0.00Å	0.00Å
C48	H81	sing	0.00Å	0.00Å
C48	H82	sing	0.00Å	0.00Å
C49	H83	sing	0.00Å	0.00Å
C49	H84	sing	0.00Å	0.00Å
C50	H85	sing	0.00Å	0.00Å
C50	H86	sing	0.00Å	0.00Å
C51	H87	sing	0.00Å	0.00Å
C51	H88	sing	0.00Å	0.00Å
C52	H89	sing	0.00Å	0.00Å
C52	H90	sing	0.00Å	0.00Å
C53	H91	sing	0.00Å	0.00Å
C53	H92	sing	0.00Å	0.00Å
C54	H93	sing	0.00Å	0.00Å
C54	H94	sing	0.00Å	0.00Å
C54	H95	sing	0.00Å	0.00Å
C56	H96	sing	0.00Å	0.00Å
C56	H97	sing	0.00Å	0.00Å
C57	H98	sing	0.00Å	0.00Å
C57	H99	sing	0.00Å	0.00Å
C59	H100	sing	0.00Å	0.00Å
C59	H101	sing	0.00Å	0.00Å
C55	H102	sing	0.00Å	0.00Å
C55	H103	sing	0.00Å	0.00Å
C60	H104	sing	0.00Å	0.00Å
C60	H105	sing	0.00Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O3	P1	O2	118.0°	90.0°
O3	P1	O1	108.4°	90.0°
O3	P1	O4	109.2°	90.0°
O35	C40	C39	110.1°	90.0°
O35	C40	C17	109.4°	90.0°
C40	O35	H64	109.5°	90.0°
O35	C40	H69	110.1°	90.0°
O1	C2	C1	109.8°	90.0°
C2	O1	P1	119.1°	90.0°
O1	C2	H20	109.4°	90.0°
O1	C2	H21	109.4°	90.0°
C2	C1	H17	109.5°	90.0°
C1	C2	H20	109.4°	90.0°
C1	C2	H21	109.4°	90.0°
C2	C1	O38	104.6°	90.0°
C2	C1	C56	104.6°	90.0°
O2	P1	O1	109.5°	90.0°
O2	P1	O4	109.3°	90.0°
P1	O2	H22	109.5°	90.0°
O1	P1	O4	101.3°	90.0°
P1	O4	C3	122.5°	90.0°
C39	C40	C17	109.5°	90.0°
C40	C39	O34	108.1°	90.0°
C40	C39	C38	112.2°	90.0°
C40	C39	H68	108.3°	90.0°
C39	C40	H69	108.8°	90.0°
C40	C17	O16	109.3°	90.0°
C40	C17	O15	108.0°	90.0°
C40	C17	H9	109.3°	90.0°
C17	C40	H69	108.8°	90.0°
O34	C39	C38	110.8°	90.0°
C39	O34	H62	109.5°	90.0°
O34	C39	H68	109.4°	90.0°
C39	C38	O33	109.9°	90.0°
C39	C38	C18	111.9°	90.0°
C39	C38	H67	108.7°	90.0°
C38	C39	H68	108.1°	90.0°
O31	C36	C37	109.8°	90.0°
O31	C36	C35	110.5°	90.0°
C36	O31	H56	109.5°	90.0°
O31	C36	H65	109.3°	90.0°
O14	C15	C16	109.8°	90.0°
O14	C15	C14	109.9°	90.0°
O14	C15	H8	109.2°	90.0°
C15	O14	H35	109.5°	90.0°
O32	C37	C36	111.3°	90.0°
O32	C37	C20	109.9°	90.0°
C37	O32	H58	109.5°	90.0°
O32	C37	H66	109.6°	90.0°
O4	C3	C16	108.1°	90.0°
O4	C3	C4	107.9°	90.0°
O4	C3	H23	110.2°	90.0°
O16	C17	O15	108.6°	90.0°
C17	O16	C18	111.6°	90.0°
O16	C17	H9	110.7°	90.0°
C17	O15	C16	115.6°	90.0°
O15	C17	H9	110.9°	90.0°
C15	C16	C3	111.8°	90.0°
C15	C16	O15	108.3°	90.0°
C16	C15	C14	111.9°	90.0°
C16	C15	H8	108.0°	90.0°
C15	C16	H36	108.9°	90.0°
C3	C16	O15	109.1°	90.0°
C16	C3	C4	111.9°	90.0°
C16	C3	H23	109.3°	90.0°
C3	C16	H36	108.8°	90.0°
O15	C16	H36	110.0°	90.0°
C36	C37	C20	109.2°	90.0°
C37	C36	C35	111.0°	90.0°
C37	C36	H65	108.2°	90.0°
C36	C37	H66	108.4°	90.0°
C37	C20	O17	108.3°	90.0°
C37	C20	O18	109.7°	90.0°
C37	C20	H10	108.2°	90.0°
C20	C37	H66	108.3°	90.0°
C36	C35	O30	110.5°	90.0°
C36	C35	C21	112.1°	90.0°
C36	C35	H63	107.7°	90.0°
C35	C36	H65	108.0°	90.0°
O21	C25	C24	111.3°	90.0°
C25	O21	H40	109.5°	90.0°
O21	C25	H44	109.0°	90.0°
O21	C25	H45	109.0°	90.0°
C15	C14	O13	109.4°	90.0°
C15	C14	C13	111.9°	90.0°
C14	C15	H8	108.0°	90.0°
C15	C14	H34	108.2°	90.0°
O8	C8	O7	122.7°	90.0°
O8	C8	C9	125.7°	90.0°
C3	C4	O5	108.4°	90.0°
C3	C4	C13	112.0°	90.0°
C3	C4	H1	109.2°	90.0°
C4	C3	H23	109.4°	90.0°
O16	C18	C38	109.0°	90.0°
O16	C18	C19	107.6°	90.0°
O16	C18	H37	109.6°	90.0°
O33	C38	C18	107.6°	90.0°
C38	O33	H60	109.5°	90.0°
O33	C38	H67	110.2°	90.0°
C38	C18	C19	113.7°	90.0°
C38	C18	H37	108.4°	90.0°
C18	C38	H67	108.6°	90.0°
O7	C7	C6	108.6°	90.0°
C7	O7	C8	116.9°	90.0°
O7	C7	H4	109.7°	90.0°
O7	C7	H5	109.7°	90.0°
C7	C6	O6	107.3°	90.0°
C7	C6	C10	111.4°	90.0°
C7	C6	H3	109.6°	90.0°
C6	C7	H4	109.7°	90.0°
C6	C7	H5	109.7°	90.0°
C20	O17	C19	113.6°	90.0°
O17	C20	O18	111.0°	90.0°
O17	C20	H10	109.9°	90.0°
O17	C19	C18	108.5°	90.0°
O17	C19	H38	109.7°	90.0°
O17	C19	H39	109.7°	90.0°
C20	O18	C21	113.5°	90.0°
O18	C20	H10	109.7°	90.0°
O7	C8	C9	111.6°	90.0°
C8	C9	H24	110.4°	90.0°
C8	C9	H25	110.4°	90.0°
C8	C9	C41	105.8°	90.0°
C25	C24	O20	106.9°	90.0°
C25	C24	C26	112.9°	90.0°
C25	C24	H14	109.3°	90.0°
C24	C25	H44	109.0°	90.0°
C24	C25	H45	109.0°	90.0°
O30	C35	C21	110.0°	90.0°
C35	O30	H53	109.5°	90.0°
O30	C35	H63	108.9°	90.0°
C35	C21	C22	113.0°	90.0°
C35	C21	O18	111.6°	90.0°
C35	C21	H11	107.9°	90.0°
C21	C35	H63	107.5°	90.0°
C19	C18	H37	108.6°	90.0°
C18	C19	H38	109.7°	90.0°
C18	C19	H39	109.7°	90.0°
C6	O6	C5	113.4°	90.0°
O6	C6	C10	108.5°	90.0°
O6	C6	H3	110.5°	90.0°
O6	C5	O5	110.0°	90.0°
O6	C5	C12	110.5°	90.0°
O6	C5	H2	109.6°	90.0°
O13	C14	C13	109.5°	90.0°
C14	O13	H33	109.5°	90.0°
O13	C14	H34	109.5°	90.0°
C14	C13	C4	110.8°	90.0°
C14	C13	O12	109.5°	90.0°
C14	C13	H7	108.5°	90.0°
C13	C14	H34	108.2°	90.0°
C21	C22	O19	109.3°	90.0°
C22	C21	O18	106.8°	90.0°
C22	C21	H11	108.3°	90.0°
C21	C22	H12	109.5°	90.0°
C21	C22	H13	109.5°	90.0°
C22	O19	C23	114.0°	90.0°
O19	C22	H12	109.5°	90.0°
O19	C22	H13	109.6°	90.0°
C6	C10	C11	108.8°	90.0°
C6	C10	O9	109.6°	90.0°
C10	C6	H3	109.5°	90.0°
C6	C10	H6	109.0°	90.0°
O5	C4	C13	107.5°	90.0°
C4	O5	C5	114.9°	90.0°
O5	C4	H1	110.4°	90.0°
C4	C13	O12	109.7°	90.0°
C13	C4	H1	109.3°	90.0°
C4	C13	H7	108.5°	90.0°
O5	C5	C12	108.6°	90.0°
O5	C5	H2	109.9°	90.0°
O18	C21	H11	109.1°	90.0°
O20	C24	C26	108.0°	90.0°
C24	O20	C23	113.4°	90.0°
O20	C24	H14	110.3°	90.0°
C24	C26	O22	108.5°	90.0°
C24	C26	C27	109.6°	90.0°
C26	C24	H14	109.3°	90.0°
C24	C26	H15	109.1°	90.0°
O12	C13	H7	109.8°	90.0°
C13	O12	H32	109.5°	90.0°
C5	C12	C11	108.5°	90.0°
C5	C12	O11	109.9°	90.0°
C12	C5	H2	108.3°	90.0°
C5	C12	H31	108.4°	90.0°
O22	C26	C27	110.1°	90.0°
O22	C26	H15	110.4°	90.0°
C26	O22	H41	109.5°	90.0°
O20	C23	O19	110.6°	90.0°
O20	C23	C28	111.1°	90.0°
O20	C23	H42	109.4°	90.0°
O19	C23	C28	108.2°	90.0°
O19	C23	H42	109.6°	90.0°
C11	C12	O11	111.8°	90.0°
C12	C11	C10	108.9°	90.0°
C12	C11	O10	110.6°	90.0°
C12	C11	H29	108.7°	90.0°
C11	C12	H31	108.5°	90.0°
C12	O11	H30	109.5°	90.0°
O11	C12	H31	109.7°	90.0°
C26	C27	C28	111.9°	90.0°
C26	C27	O23	109.8°	90.0°
C27	C26	H15	109.0°	90.0°
C26	C27	H47	108.4°	90.0°
C11	C10	O9	110.1°	90.0°
C10	C11	O10	110.0°	90.0°
C11	C10	H6	109.0°	90.0°
C10	C11	H29	108.7°	90.0°
O9	C10	H6	110.3°	90.0°
C10	O9	H27	109.5°	90.0°
C11	O10	H28	109.5°	90.0°
O10	C11	H29	109.9°	90.0°
C23	C28	C27	111.2°	90.0°
C23	C28	O24	109.9°	90.0°
C23	C28	H16	108.1°	90.0°
C28	C23	H42	107.9°	90.0°
C28	C27	O23	109.0°	90.0°
C27	C28	O24	110.2°	90.0°
C27	C28	H16	108.1°	90.0°
C28	C27	H47	108.2°	90.0°
C27	O23	H43	109.5°	90.0°
O23	C27	H47	109.5°	90.0°
C28	O24	C29	117.2°	90.0°
O24	C28	H16	109.4°	90.0°
O24	C29	O25	110.6°	90.0°
O24	C29	C34	107.5°	90.0°
O24	C29	H50	110.1°	90.0°
O29	C34	C29	109.0°	90.0°
O29	C34	C33	110.8°	90.0°
C34	O29	H51	109.5°	90.0°
O29	C34	H61	109.8°	90.0°
O25	C29	C34	110.0°	90.0°
C29	O25	C30	114.2°	90.0°
O25	C29	H50	109.9°	90.0°
C29	C34	C33	110.0°	90.0°
C34	C29	H50	108.6°	90.0°
C29	C34	H61	108.6°	90.0°
O25	C30	C31	106.7°	90.0°
O25	C30	C32	109.9°	90.0°
O25	C30	H52	109.9°	90.0°
C34	C33	O28	109.3°	90.0°
C34	C33	C32	110.7°	90.0°
C34	C33	H59	108.6°	90.0°
C33	C34	H61	108.6°	90.0°
O28	C33	C32	109.8°	90.0°
C33	O28	H49	109.5°	90.0°
O28	C33	H59	109.8°	90.0°
C30	C31	O26	112.0°	90.0°
C31	C30	C32	112.5°	90.0°
C31	C30	H52	109.0°	90.0°
C30	C31	H54	108.8°	90.0°
C30	C31	H55	108.8°	90.0°
C31	O26	H46	109.5°	90.0°
O26	C31	H54	108.8°	90.0°
O26	C31	H55	108.8°	90.0°
C30	C32	C33	110.0°	90.0°
C30	C32	O27	109.5°	90.0°
C32	C30	H52	108.8°	90.0°
C30	C32	H57	108.5°	90.0°
C33	C32	O27	110.3°	90.0°
C33	C32	H57	108.6°	90.0°
C32	C33	H59	108.6°	90.0°
C32	O27	H48	109.5°	90.0°
O27	C32	H57	109.9°	90.0°
H4	C7	H5	109.5°	90.0°
H12	C22	H13	109.5°	90.0°
H17	C1	O38	54.6°	90.0°
H17	C1	C56	54.6°	90.0°
H20	C2	H21	109.5°	90.0°
H24	C9	H25	109.5°	90.0°
H24	C9	C41	110.4°	90.0°
H25	C9	C41	110.4°	90.0°
H38	C19	H39	109.4°	90.0°
H44	C25	H45	109.5°	90.0°
H54	C31	H55	109.5°	90.0°
C9	C41	C42	90.0°	90.0°
C9	C41	H18	90.0°	90.0°
C9	C41	H19	90.0°	90.0°
C41	C42	C43	90.0°	90.0°
C42	C41	H18	90.0°	90.0°
C42	C41	H19	90.0°	90.0°
C41	C42	H26	90.0°	90.0°
C41	C42	H70	90.0°	90.0°
C42	C43	C44	90.0°	90.0°
C43	C42	H26	90.0°	90.0°
C43	C42	H70	90.0°	90.0°
C42	C43	H71	90.0°	90.0°
C42	C43	H72	90.0°	90.0°
C43	C44	C45	90.0°	90.0°
C44	C43	H71	90.0°	90.0°
C44	C43	H72	90.0°	90.0°
C43	C44	H73	90.0°	90.0°
C43	C44	H74	90.0°	90.0°
C44	C45	C46	90.0°	90.0°
C45	C44	H73	90.0°	90.0°
C45	C44	H74	90.0°	90.0°
C44	C45	H75	90.0°	90.0°
C44	C45	H76	90.0°	90.0°
C45	C46	C47	90.0°	90.0°
C46	C45	H75	90.0°	90.0°
C46	C45	H76	90.0°	90.0°
C45	C46	H77	90.0°	90.0°
C45	C46	H78	90.0°	90.0°
C46	C47	C48	90.0°	90.0°
C47	C46	H77	90.0°	90.0°
C47	C46	H78	90.0°	90.0°
C46	C47	H79	90.0°	90.0°
C46	C47	H80	90.0°	90.0°
C47	C48	C49	90.0°	90.0°
C48	C47	H79	90.0°	90.0°
C48	C47	H80	90.0°	90.0°
C47	C48	H81	90.0°	90.0°
C47	C48	H82	90.0°	90.0°
C48	C49	C50	90.0°	90.0°
C49	C48	H81	90.0°	90.0°
C49	C48	H82	90.0°	90.0°
C48	C49	H83	90.0°	90.0°
C48	C49	H84	90.0°	90.0°
C49	C50	C51	90.0°	90.0°
C50	C49	H83	90.0°	90.0°
C50	C49	H84	90.0°	90.0°
C49	C50	H85	90.0°	90.0°
C49	C50	H86	90.0°	90.0°
C50	C51	C52	90.0°	90.0°
C51	C50	H85	90.0°	90.0°
C51	C50	H86	90.0°	90.0°
C50	C51	H87	90.0°	90.0°
C50	C51	H88	90.0°	90.0°
C51	C52	C53	90.0°	90.0°
C52	C51	H87	90.0°	90.0°
C52	C51	H88	90.0°	90.0°
C51	C52	H89	90.0°	90.0°
C51	C52	H90	90.0°	90.0°
C52	C53	C54	90.0°	90.0°
C53	C52	H89	90.0°	90.0°
C53	C52	H90	90.0°	90.0°
C52	C53	H91	90.0°	90.0°
C52	C53	H92	90.0°	90.0°
C54	C53	H91	90.0°	90.0°
C54	C53	H92	90.0°	90.0°
C53	C54	H93	90.0°	90.0°
C53	C54	H94	90.0°	90.0°
C53	C54	H95	90.0°	90.0°
O38	C1	C56	0.0°	90.0°
C1	O38	C72	90.0°	90.0°
C1	C56	O36	90.0°	90.0°
C1	C56	H96	90.0°	90.0°
C1	C56	H97	90.0°	90.0°
C56	O36	C58	90.0°	90.0°
O36	C56	H96	90.0°	90.0°
O36	C56	H97	90.0°	90.0°
O36	C58	C57	90.0°	90.0°
O36	C58	O37	90.0°	90.0°
C58	C57	C59	90.0°	90.0°
C57	C58	O37	90.0°	90.0°
C58	C57	H98	90.0°	90.0°
C58	C57	H99	90.0°	90.0°
C57	C59	C55	90.0°	90.0°
C59	C57	H98	90.0°	90.0°
C59	C57	H99	90.0°	90.0°
C57	C59	H100	90.0°	90.0°
C57	C59	H101	90.0°	90.0°
C59	C55	C60	90.0°	90.0°
C55	C59	H100	90.0°	90.0°
C55	C59	H101	90.0°	90.0°
C59	C55	H102	90.0°	90.0°
C59	C55	H103	90.0°	90.0°
C55	C60	C61	90.0°	90.0°
C60	C55	H102	90.0°	90.0°
C60	C55	H103	90.0°	90.0°
C55	C60	H104	90.0°	90.0°
C55	C60	H105	90.0°	90.0°
C60	C61	C62	90.0°	90.0°
C61	C60	H104	90.0°	90.0°
C61	C60	H105	90.0°	90.0°
C61	C62	C63	90.0°	90.0°
C62	C63	C64	90.0°	90.0°
C63	C64	C65	90.0°	90.0°
C64	C65	C66	90.0°	90.0°
C65	C66	C67	90.0°	90.0°
C66	C67	C68	90.0°	90.0°
C67	C68	C69	90.0°	90.0°
C68	C69	C70	90.0°	90.0°
C69	C70	C71	90.0°	90.0°
O38	C72	C73	90.0°	90.0°
O38	C72	O39	90.0°	90.0°
C73	C72	O39	90.0°	90.0°
C72	C73	C74	90.0°	90.0°
C73	C74	C75	90.0°	90.0°
C74	C75	C76	90.0°	90.0°
C75	C76	C77	90.0°	90.0°
C76	C77	C78	90.0°	90.0°
C77	C78	C79	90.0°	90.0°
C78	C79	C80	90.0°	90.0°
C79	C80	C81	90.0°	90.0°
C80	C81	C82	90.0°	90.0°
C80	C81	C90	90.0°	90.0°
C81	C82	C83	90.0°	90.0°
C82	C81	C90	90.0°	90.0°
C82	C83	C84	90.0°	90.0°
C83	C84	C85	90.0°	90.0°
C84	C85	C86	90.0°	90.0°
C85	C86	C87	90.0°	90.0°
C86	C87	C88	90.0°	90.0°
C87	C88	C89	90.0°	90.0°
H18	C41	H19	90.0°	90.0°
H26	C42	H70	90.0°	90.0°
H71	C43	H72	90.0°	90.0°
H73	C44	H74	90.0°	90.0°
H75	C45	H76	90.0°	90.0°
H77	C46	H78	90.0°	90.0°
H79	C47	H80	90.0°	90.0°
H81	C48	H82	90.0°	90.0°
H83	C49	H84	90.0°	90.0°
H85	C50	H86	90.0°	90.0°
H87	C51	H88	90.0°	90.0°
H89	C52	H90	90.0°	90.0°
H91	C53	H92	90.0°	90.0°
H93	C54	H94	90.0°	90.0°
H93	C54	H95	90.0°	90.0°
H94	C54	H95	90.0°	90.0°
H96	C56	H97	90.0°	90.0°
H98	C57	H99	90.0°	90.0°
H100	C59	H101	90.0°	90.0°
H102	C55	H103	90.0°	90.0°
H104	C60	H105	90.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O3	P1	O1	C2	2.0°	90.0°
O3	P1	O2	O1	124.5°	90.0°
O3	P1	O2	O4	125.4°	90.0°
O3	P1	O1	O4	114.7°	90.0°
O3	P1	O4	C3	120.9°	90.0°
O3	P1	O2	H22	0.0°	90.0°
O35	C40	C39	C17	120.3°	90.0°
O35	C40	C39	H69	120.8°	90.0°
O35	C40	C17	H69	120.3°	90.0°
O35	C40	C39	O34	29.3°	90.0°
O35	C40	C39	C38	151.7°	90.0°
O35	C40	C17	O16	91.1°	90.0°
O35	C40	C17	O15	150.9°	90.0°
O35	C40	C17	H9	30.2°	90.0°
O35	C40	C39	H68	89.1°	90.0°
O1	C2	C1	H20	120.1°	90.0°
O1	C2	C1	H21	120.0°	90.0°
C2	O1	P1	O2	127.9°	90.0°
C2	O1	P1	O4	116.7°	90.0°
O1	C2	C1	H17	180.0°	90.0°
O1	C2	H20	H21	119.9°	90.0°
O1	C2	C1	O38	122.9°	90.0°
O1	C2	C1	C56	122.9°	90.0°
C1	C2	O1	P1	152.6°	90.0°
C2	C1	H17	O38	94.4°	90.0°
C2	C1	H17	C56	94.4°	90.0°
C1	C2	H20	H21	119.8°	90.0°
C2	C1	O38	C56	90.0°	90.0°
C2	C1	C56	O36	90.0°	90.0°
C2	C1	O38	C72	90.0°	90.0°
C2	C1	C56	H96	90.0°	90.0°
C2	C1	C56	H97	90.0°	90.0°
O2	P1	O1	O4	115.3°	90.0°
O2	P1	O4	C3	9.4°	90.0°
O1	P1	O4	C3	124.9°	90.0°
P1	O1	C2	H20	32.6°	90.0°
P1	O1	C2	H21	87.4°	90.0°
O1	P1	O2	H22	124.5°	90.0°
P1	O4	C3	C16	89.8°	90.0°
P1	O4	C3	C4	149.0°	90.0°
O4	P1	O2	H22	125.4°	90.0°
P1	O4	C3	H23	29.7°	90.0°
C39	C40	C17	H69	118.9°	90.0°
C40	C39	O34	C38	123.3°	90.0°
C40	C39	O34	H68	117.7°	90.0°
C40	C39	C38	H68	119.3°	90.0°
C39	C40	C17	O16	29.6°	90.0°
C39	C40	C17	O15	88.3°	90.0°
C40	C39	C38	O33	63.7°	90.0°
C40	C39	C38	C18	55.7°	90.0°
C39	C40	C17	H9	151.0°	90.0°
C40	C39	O34	H62	180.0°	90.0°
C39	C40	O35	H64	180.0°	90.0°
C40	C39	C38	H67	175.7°	90.0°
C17	C40	C39	O34	91.0°	90.0°
C17	C40	C39	C38	31.4°	90.0°
C40	C17	O16	O15	117.6°	90.0°
C40	C17	O16	H9	120.4°	90.0°
C40	C17	O15	H9	119.7°	90.0°
C40	C17	O15	C16	69.9°	90.0°
C40	C17	O16	C18	76.1°	90.0°
C17	C40	O35	H64	59.6°	90.0°
C17	C40	C39	H68	150.6°	90.0°
O34	C39	C38	H68	119.9°	90.0°
O34	C39	C38	O33	175.5°	90.0°
O34	C39	C38	C18	65.1°	90.0°
O34	C39	C38	H67	54.9°	90.0°
O34	C39	C40	H69	150.1°	90.0°
C39	C38	C18	O16	14.9°	90.0°
C39	C38	O33	C18	122.1°	90.0°
C39	C38	O33	H67	119.7°	90.0°
C39	C38	C18	H67	120.0°	90.0°
C39	C38	C18	C19	105.1°	90.0°
C39	C38	C18	H37	134.1°	90.0°
C39	C38	O33	H60	180.0°	90.0°
C38	C39	O34	H62	56.7°	90.0°
C38	C39	C40	H69	87.5°	90.0°
O31	C36	C37	O32	14.0°	90.0°
O31	C36	C37	C35	122.4°	90.0°
O31	C36	C37	H65	119.3°	90.0°
O31	C36	C37	C20	135.5°	90.0°
O31	C36	C35	H65	119.5°	90.0°
O31	C36	C35	O30	157.1°	90.0°
O31	C36	C35	C21	79.8°	90.0°
O31	C36	C35	H63	38.2°	90.0°
O31	C36	C37	H66	106.6°	90.0°
O14	C15	C16	C14	122.2°	90.0°
O14	C15	C16	H8	119.0°	90.0°
O14	C15	C16	C3	70.3°	90.0°
O14	C15	C16	O15	169.5°	90.0°
O14	C15	C14	H8	119.1°	90.0°
O14	C15	C14	O13	113.7°	90.0°
O14	C15	C14	C13	124.7°	90.0°
O14	C15	C14	H34	5.5°	90.0°
O14	C15	C16	H36	49.9°	90.0°
O32	C37	C36	C20	121.5°	90.0°
O32	C37	C36	H66	120.7°	90.0°
O32	C37	C20	H66	119.8°	90.0°
O32	C37	C36	C35	108.4°	90.0°
O32	C37	C20	O17	65.0°	90.0°
O32	C37	C20	O18	56.3°	90.0°
O32	C37	C20	H10	175.9°	90.0°
O32	C37	C36	H65	133.3°	90.0°
O4	C3	C16	C15	65.2°	90.0°
O4	C3	C16	C4	118.7°	90.0°
O4	C3	C16	H23	120.0°	90.0°
O4	C3	C16	O15	175.1°	90.0°
O4	C3	C4	H23	119.9°	90.0°
O4	C3	C4	O5	0.3°	90.0°
O4	C3	C4	C13	118.7°	90.0°
O4	C3	C4	H1	120.1°	90.0°
O4	C3	C16	H36	55.0°	90.0°
O16	C17	O15	H9	121.9°	90.0°
O16	C17	O15	C16	171.7°	90.0°
C17	O16	C18	C38	49.5°	90.0°
C17	O16	C18	C19	173.1°	90.0°
C17	O16	C18	H37	69.0°	90.0°
O16	C17	C40	H69	148.5°	90.0°
C17	O15	C16	C15	94.1°	90.0°
C17	O15	C16	C3	144.1°	90.0°
O15	C17	O16	C18	41.5°	90.0°
C17	O15	C16	H36	24.8°	90.0°
O15	C17	C40	H69	30.5°	90.0°
C15	C16	C3	O15	119.7°	90.0°
C15	C16	C3	H36	120.2°	90.0°
C15	C16	O15	H36	118.9°	90.0°
C16	C15	C14	H8	118.7°	90.0°
C15	C16	C3	C4	53.5°	90.0°
C16	C15	C14	O13	124.1°	90.0°
C16	C15	C14	C13	2.5°	90.0°
C15	C16	C3	H23	174.8°	90.0°
C16	C15	C14	H34	116.7°	90.0°
C16	C15	O14	H35	180.0°	90.0°
C3	C16	O15	H36	119.3°	90.0°
C3	C16	C15	C14	51.9°	90.0°
C16	C3	C4	H23	121.3°	90.0°
C16	C3	C4	O5	118.5°	90.0°
C16	C3	C4	C13	0.1°	90.0°
C16	C3	C4	H1	121.1°	90.0°
C3	C16	C15	H8	170.6°	90.0°
O15	C16	C15	C14	68.3°	90.0°
O15	C16	C3	C4	66.2°	90.0°
O15	C16	C15	H8	50.5°	90.0°
C16	O15	C17	H9	49.8°	90.0°
O15	C16	C3	H23	55.1°	90.0°
C36	C37	C20	H66	117.9°	90.0°
C37	C36	C35	H65	118.4°	90.0°
C36	C37	C20	O17	172.7°	90.0°
C36	C37	C20	O18	66.1°	90.0°
C37	C36	C35	O30	80.9°	90.0°
C37	C36	C35	C21	42.2°	90.0°
C36	C37	C20	H10	53.6°	90.0°
C37	C36	O31	H56	180.0°	90.0°
C36	C37	O32	H58	180.0°	90.0°
C37	C36	C35	H63	160.2°	90.0°
C20	C37	C36	C35	13.1°	90.0°
C37	C20	O17	O18	120.4°	90.0°
C37	C20	O17	H10	118.1°	90.0°
C37	C20	O17	C19	134.6°	90.0°
C37	C20	O18	H10	118.8°	90.0°
C37	C20	O18	C21	58.2°	90.0°
C20	C37	O32	H58	58.9°	90.0°
C20	C37	C36	H65	105.2°	90.0°
C36	C35	O30	C21	124.3°	90.0°
C36	C35	O30	H63	118.1°	90.0°
C36	C35	C21	H63	118.1°	90.0°
C36	C35	C21	C22	68.4°	90.0°
C36	C35	C21	O18	52.0°	90.0°
C36	C35	C21	H11	171.9°	90.0°
C36	C35	O30	H53	180.0°	90.0°
C35	C36	O31	H56	57.3°	90.0°
C35	C36	C37	H66	131.0°	90.0°
O21	C25	C24	H44	120.3°	90.0°
O21	C25	C24	H45	120.3°	90.0°
O21	C25	C24	O20	106.9°	90.0°
O21	C25	C24	C26	134.4°	90.0°
O21	C25	C24	H14	12.5°	90.0°
O21	C25	H44	H45	119.2°	90.0°
C15	C14	O13	C13	123.1°	90.0°
C15	C14	O13	H34	118.4°	90.0°
C15	C14	C13	H34	119.1°	90.0°
C15	C14	C13	C4	55.8°	90.0°
C15	C14	C13	O12	176.9°	90.0°
C15	C14	C13	H7	63.3°	90.0°
C15	C14	O13	H33	180.0°	90.0°
C14	C15	O14	H35	56.6°	90.0°
C14	C15	C16	H36	172.1°	90.0°
O8	C8	O7	C7	19.6°	90.0°
O8	C8	O7	C9	179.9°	90.0°
O8	C8	C9	H24	161.2°	90.0°
O8	C8	C9	H25	77.6°	90.0°
O8	C8	C9	C41	41.8°	90.0°
C3	C4	C13	C14	54.3°	90.0°
C3	C4	O5	C13	121.3°	90.0°
C3	C4	O5	H1	119.6°	90.0°
C3	C4	C13	H1	121.2°	90.0°
C3	C4	O5	C5	103.8°	90.0°
C3	C4	C13	O12	175.3°	90.0°
C3	C4	C13	H7	64.8°	90.0°
C4	C3	C16	H36	173.7°	90.0°
O16	C18	C38	O33	105.9°	90.0°
O16	C18	C38	C19	120.0°	90.0°
O16	C18	C38	H37	119.2°	90.0°
O16	C18	C19	O17	43.1°	90.0°
O16	C18	C19	H37	118.5°	90.0°
C18	O16	C17	H9	163.4°	90.0°
O16	C18	C19	H38	163.0°	90.0°
O16	C18	C19	H39	76.7°	90.0°
O16	C18	C38	H67	134.9°	90.0°
O33	C38	C18	H67	119.2°	90.0°
O33	C38	C18	C19	134.1°	90.0°
O33	C38	C18	H37	13.3°	90.0°
O33	C38	C39	H68	55.6°	90.0°
C38	C18	C19	O17	77.6°	90.0°
C38	C18	C19	H37	120.7°	90.0°
C38	C18	C19	H38	42.2°	90.0°
C38	C18	C19	H39	162.5°	90.0°
C18	C38	O33	H60	58.0°	90.0°
C18	C38	C39	H68	175.0°	90.0°
O7	C7	C6	H4	119.9°	90.0°
O7	C7	C6	H5	119.9°	90.0°
C7	O7	C8	C9	160.5°	90.0°
O7	C7	C6	O6	166.6°	90.0°
O7	C7	C6	C10	48.0°	90.0°
O7	C7	C6	H3	73.4°	90.0°
O7	C7	H4	H5	120.4°	90.0°
C6	C7	O7	C8	84.5°	90.0°
C7	C6	O6	C10	120.5°	90.0°
C7	C6	O6	H3	119.4°	90.0°
C7	C6	O6	C5	132.4°	90.0°
C7	C6	C10	H3	121.4°	90.0°
C7	C6	C10	C11	65.6°	90.0°
C7	C6	C10	O9	54.9°	90.0°
C6	C7	H4	H5	120.3°	90.0°
C7	C6	C10	H6	175.7°	90.0°
O17	C20	O18	H10	121.6°	90.0°
C20	O17	C19	C18	113.3°	90.0°
O17	C20	O18	C21	177.9°	90.0°
C20	O17	C19	H38	126.9°	90.0°
C20	O17	C19	H39	6.6°	90.0°
O17	C20	C37	H66	54.8°	90.0°
C19	O17	C20	O18	14.1°	90.0°
O17	C19	C18	H38	119.8°	90.0°
O17	C19	C18	H39	119.9°	90.0°
C19	O17	C20	H10	107.4°	90.0°
O17	C19	C18	H37	161.6°	90.0°
O17	C19	H38	H39	120.4°	90.0°
C20	O18	C21	C35	0.6°	90.0°
C20	O18	C21	C22	123.5°	90.0°
C20	O18	C21	H11	119.7°	90.0°
O18	C20	C37	H66	176.1°	90.0°
C8	O7	C7	H4	155.6°	90.0°
C8	O7	C7	H5	35.3°	90.0°
O7	C8	C9	H24	18.7°	90.0°
O7	C8	C9	H25	102.5°	90.0°
O7	C8	C9	C41	138.1°	90.0°
C8	C9	H24	H25	121.7°	90.0°
C8	C9	H24	C41	116.6°	90.0°
C8	C9	H25	C41	116.6°	90.0°
C8	C9	C41	C42	90.0°	90.0°
C8	C9	C41	H18	90.0°	90.0°
C8	C9	C41	H19	90.0°	90.0°
C25	C24	O20	C26	121.8°	90.0°
C25	C24	O20	H14	118.8°	90.0°
C25	C24	C26	H14	121.9°	90.0°
C25	C24	C26	O22	61.5°	90.0°
C25	C24	O20	C23	172.3°	90.0°
C25	C24	C26	C27	178.1°	90.0°
C25	C24	C26	H15	58.8°	90.0°
C24	C25	O21	H40	180.0°	90.0°
C24	C25	H44	H45	119.2°	90.0°
O30	C35	C21	H63	118.5°	90.0°
O30	C35	C21	C22	168.2°	90.0°
O30	C35	C21	O18	71.3°	90.0°
O30	C35	C21	H11	48.5°	90.0°
O30	C35	C36	H65	37.5°	90.0°
C35	C21	C22	O18	123.1°	90.0°
C35	C21	C22	H11	119.5°	90.0°
C35	C21	C22	O19	121.6°	90.0°
C35	C21	O18	H11	119.1°	90.0°
C35	C21	C22	H12	1.6°	90.0°
C35	C21	C22	H13	118.4°	90.0°
C21	C35	O30	H53	55.7°	90.0°
C21	C35	C36	H65	160.6°	90.0°
C18	C19	H38	H39	120.5°	90.0°
C19	C18	C38	H67	14.9°	90.0°
O6	C6	C10	H3	120.7°	90.0°
C6	O6	C5	O5	174.6°	90.0°
C6	O6	C5	C12	65.5°	90.0°
O6	C6	C10	C11	52.4°	90.0°
O6	C6	C10	O9	172.9°	90.0°
C6	O6	C5	H2	53.7°	90.0°
O6	C6	C7	H4	46.7°	90.0°
O6	C6	C7	H5	73.5°	90.0°
O6	C6	C10	H6	66.3°	90.0°
C5	O6	C6	C10	11.9°	90.0°
O6	C5	O5	C4	97.8°	90.0°
O6	C5	O5	C12	121.0°	90.0°
O6	C5	O5	H2	120.7°	90.0°
O6	C5	C12	H2	120.0°	90.0°
O6	C5	C12	C11	49.2°	90.0°
O6	C5	C12	O11	171.7°	90.0°
C5	O6	C6	H3	108.2°	90.0°
O6	C5	C12	H31	68.4°	90.0°
O13	C14	C13	H34	119.3°	90.0°
O13	C14	C13	C4	177.4°	90.0°
O13	C14	C13	O12	61.5°	90.0°
O13	C14	C13	H7	58.3°	90.0°
O13	C14	C15	H8	5.4°	90.0°
C14	C13	C4	O5	64.7°	90.0°
C14	C13	C4	O12	121.0°	90.0°
C14	C13	C4	H7	119.0°	90.0°
C14	C13	O12	H7	119.0°	90.0°
C14	C13	C4	H1	175.4°	90.0°
C13	C14	C15	H8	116.2°	90.0°
C14	C13	O12	H32	180.0°	90.0°
C13	C14	O13	H33	56.9°	90.0°
C21	C22	O19	H12	120.0°	90.0°
C21	C22	O19	H13	120.0°	90.0°
C22	C21	O18	H11	116.8°	90.0°
C21	C22	O19	C23	40.0°	90.0°
C21	C22	H12	H13	120.1°	90.0°
C22	C21	C35	H63	49.7°	90.0°
O19	C22	C21	O18	115.3°	90.0°
C22	O19	C23	O20	50.6°	90.0°
C22	O19	C23	C28	172.5°	90.0°
O19	C22	C21	H11	2.1°	90.0°
O19	C22	H12	H13	120.1°	90.0°
C22	O19	C23	H42	70.1°	90.0°
C6	C10	C11	C12	65.7°	90.0°
C6	C10	C11	O9	120.2°	90.0°
C6	C10	C11	H6	118.7°	90.0°
C6	C10	O9	H6	120.0°	90.0°
C6	C10	C11	O10	172.9°	90.0°
C10	C6	C7	H4	71.9°	90.0°
C10	C6	C7	H5	167.8°	90.0°
C6	C10	O9	H27	180.0°	90.0°
C6	C10	C11	H29	52.6°	90.0°
O5	C4	C13	H1	119.9°	90.0°
O5	C4	C13	O12	56.3°	90.0°
C4	O5	C5	C12	23.2°	90.0°
C4	O5	C5	H2	141.5°	90.0°
O5	C4	C13	H7	176.3°	90.0°
O5	C4	C3	H23	120.2°	90.0°
C13	C4	O5	C5	134.9°	90.0°
C4	C13	O12	H7	119.2°	90.0°
C13	C4	C3	H23	121.4°	90.0°
C4	C13	O12	H32	58.2°	90.0°
C4	C13	C14	H34	63.4°	90.0°
O5	C5	C12	H2	119.3°	90.0°
O5	C5	C12	C11	169.9°	90.0°
O5	C5	C12	O11	67.6°	90.0°
C5	O5	C4	H1	15.8°	90.0°
O5	C5	C12	H31	52.3°	90.0°
C21	O18	C20	H10	60.5°	90.0°
O18	C21	C22	H12	124.8°	90.0°
O18	C21	C22	H13	4.7°	90.0°
O18	C21	C35	H63	170.2°	90.0°
O20	C24	C26	H14	120.1°	90.0°
O20	C24	C26	O22	179.6°	90.0°
C24	O20	C23	O19	59.7°	90.0°
O20	C24	C26	C27	60.1°	90.0°
C24	O20	C23	C28	60.5°	90.0°
O20	C24	C26	H15	59.3°	90.0°
C24	O20	C23	H42	179.5°	90.0°
O20	C24	C25	H44	13.3°	90.0°
O20	C24	C25	H45	132.8°	90.0°
C24	C26	O22	C27	120.0°	90.0°
C24	C26	O22	H15	119.5°	90.0°
C26	C24	O20	C23	65.8°	90.0°
C24	C26	C27	H15	119.4°	90.0°
C24	C26	C27	C28	52.7°	90.0°
C24	C26	C27	O23	173.9°	90.0°
C24	C26	O22	H41	180.0°	90.0°
C26	C24	C25	H44	105.3°	90.0°
C26	C24	C25	H45	14.1°	90.0°
C24	C26	C27	H47	66.5°	90.0°
O12	C13	C4	H1	63.5°	90.0°
O12	C13	C14	H34	57.8°	90.0°
C5	C12	C11	O11	121.3°	90.0°
C5	C12	C11	H31	117.6°	90.0°
C5	C12	O11	H31	119.1°	90.0°
C5	C12	C11	C10	13.8°	90.0°
C5	C12	C11	O10	134.8°	90.0°
C5	C12	C11	H29	104.5°	90.0°
C5	C12	O11	H30	180.0°	90.0°
O22	C26	C27	H15	121.2°	90.0°
O22	C26	C27	C28	172.0°	90.0°
O22	C26	C27	O23	66.8°	90.0°
O22	C26	C24	H14	60.3°	90.0°
O22	C26	C27	H47	52.8°	90.0°
O20	C23	O19	C28	121.9°	90.0°
O20	C23	O19	H42	120.7°	90.0°
O20	C23	C28	H42	119.9°	90.0°
O20	C23	C28	C27	49.3°	90.0°
O20	C23	C28	O24	72.9°	90.0°
C23	O20	C24	H14	53.6°	90.0°
O20	C23	C28	H16	167.8°	90.0°
O19	C23	C28	H42	118.5°	90.0°
O19	C23	C28	C27	72.3°	90.0°
O19	C23	C28	O24	165.5°	90.0°
C23	O19	C22	H12	80.0°	90.0°
C23	O19	C22	H13	159.9°	90.0°
O19	C23	C28	H16	46.2°	90.0°
C11	C12	O11	H31	120.4°	90.0°
C12	C11	C10	O10	121.4°	90.0°
C12	C11	C10	H29	118.3°	90.0°
C12	C11	C10	O9	174.0°	90.0°
C12	C11	O10	H29	120.0°	90.0°
C11	C12	C5	H2	70.8°	90.0°
C12	C11	C10	H6	53.0°	90.0°
C12	C11	O10	H28	180.0°	90.0°
C11	C12	O11	H30	59.5°	90.0°
O11	C12	C11	C10	107.5°	90.0°
O11	C12	C11	O10	13.4°	90.0°
O11	C12	C5	H2	51.7°	90.0°
O11	C12	C11	H29	134.2°	90.0°
C26	C27	C28	C23	46.9°	90.0°
C26	C27	C28	O23	121.7°	90.0°
C26	C27	C28	H47	119.3°	90.0°
C26	C27	O23	H47	118.9°	90.0°
C26	C27	C28	O24	75.1°	90.0°
C27	C26	C24	H14	60.0°	90.0°
C26	C27	C28	H16	165.4°	90.0°
C27	C26	O22	H41	60.0°	90.0°
C26	C27	O23	H43	180.0°	90.0°
C11	C10	O9	H6	120.3°	90.0°
C10	C11	O10	H29	119.6°	90.0°
C11	C10	C6	H3	173.0°	90.0°
C11	C10	O9	H27	60.3°	90.0°
C10	C11	O10	H28	59.7°	90.0°
C10	C11	C12	H31	131.4°	90.0°
O9	C10	C11	O10	52.7°	90.0°
O9	C10	C6	H3	66.5°	90.0°
O9	C10	C11	H29	67.7°	90.0°
O10	C11	C10	H6	68.4°	90.0°
O10	C11	C12	H31	107.7°	90.0°
C23	C28	C27	O24	122.0°	90.0°
C23	C28	C27	H16	118.5°	90.0°
C23	C28	C27	O23	168.6°	90.0°
C23	C28	O24	H16	118.5°	90.0°
C23	C28	O24	C29	146.0°	90.0°
C23	C28	C27	H47	72.4°	90.0°
C28	C27	O23	H47	118.2°	90.0°
C27	C28	O24	H16	118.7°	90.0°
C27	C28	O24	C29	91.2°	90.0°
C28	C27	C26	H15	66.7°	90.0°
C27	C28	C23	H42	169.2°	90.0°
C28	C27	O23	H43	57.1°	90.0°
O23	C27	C28	O24	46.5°	90.0°
O23	C27	C26	H15	54.5°	90.0°
O23	C27	C28	H16	72.9°	90.0°
C28	O24	C29	O25	11.6°	90.0°
C28	O24	C29	C34	131.8°	90.0°
O24	C28	C23	H42	47.0°	90.0°
O24	C28	C27	H47	165.6°	90.0°
C28	O24	C29	H50	110.1°	90.0°
O24	C29	C34	O29	26.8°	90.0°
O24	C29	O25	C34	118.7°	90.0°
O24	C29	O25	H50	121.8°	90.0°
O24	C29	C34	H50	119.1°	90.0°
O24	C29	O25	C30	172.0°	90.0°
O24	C29	C34	C33	148.5°	90.0°
C29	O24	C28	H16	27.5°	90.0°
O24	C29	C34	H61	92.8°	90.0°
O29	C34	C29	O25	93.8°	90.0°
O29	C34	C29	C33	121.7°	90.0°
O29	C34	C29	H61	119.6°	90.0°
O29	C34	C33	H61	120.7°	90.0°
O29	C34	C33	O28	33.6°	90.0°
O29	C34	C33	C32	154.7°	90.0°
O29	C34	C29	H50	145.9°	90.0°
O29	C34	C33	H59	86.2°	90.0°
O25	C29	C34	H50	120.3°	90.0°
O25	C29	C34	C33	27.9°	90.0°
C29	O25	C30	C31	160.7°	90.0°
C29	O25	C30	C32	38.5°	90.0°
C29	O25	C30	H52	81.3°	90.0°
O25	C29	C34	H61	146.6°	90.0°
C34	C29	O25	C30	69.4°	90.0°
C29	C34	C33	H61	118.7°	90.0°
C29	C34	C33	O28	87.0°	90.0°
C29	C34	C33	C32	34.0°	90.0°
C29	C34	O29	H51	180.0°	90.0°
C29	C34	C33	H59	153.2°	90.0°
O25	C30	C31	C32	120.6°	90.0°
O25	C30	C31	H52	118.6°	90.0°
O25	C30	C31	O26	109.6°	90.0°
O25	C30	C32	H52	120.4°	90.0°
O25	C30	C32	C33	26.4°	90.0°
O25	C30	C32	O27	95.0°	90.0°
C30	O25	C29	H50	50.1°	90.0°
O25	C30	C31	H54	130.0°	90.0°
O25	C30	C31	H55	10.7°	90.0°
O25	C30	C32	H57	145.0°	90.0°
C34	C33	O28	C32	121.6°	90.0°
C34	C33	O28	H59	119.0°	90.0°
C34	C33	C32	C30	63.5°	90.0°
C34	C33	C32	H59	119.2°	90.0°
C34	C33	C32	O27	57.4°	90.0°
C34	C33	O28	H49	180.0°	90.0°
C33	C34	C29	H50	92.4°	90.0°
C33	C34	O29	H51	58.8°	90.0°
C34	C33	C32	H57	177.9°	90.0°
O28	C33	C32	C30	57.2°	90.0°
O28	C33	C32	H59	120.1°	90.0°
O28	C33	C32	O27	178.1°	90.0°
O28	C33	C32	H57	61.4°	90.0°
O28	C33	C34	H61	154.3°	90.0°
C30	C31	O26	H54	120.4°	90.0°
C30	C31	O26	H55	120.4°	90.0°
C31	C30	C32	H52	120.9°	90.0°
C31	C30	C32	C33	92.3°	90.0°
C31	C30	C32	O27	146.3°	90.0°
C30	C31	O26	H46	180.0°	90.0°
C30	C31	H54	H55	118.9°	90.0°
C31	C30	C32	H57	26.3°	90.0°
O26	C31	C30	C32	129.8°	90.0°
O26	C31	C30	H52	9.0°	90.0°
O26	C31	H54	H55	118.8°	90.0°
C30	C32	C33	O27	120.9°	90.0°
C30	C32	C33	H57	118.6°	90.0°
C30	C32	O27	H57	119.1°	90.0°
C30	C32	O27	H48	180.0°	90.0°
C32	C30	C31	H54	9.4°	90.0°
C32	C30	C31	H55	109.8°	90.0°
C30	C32	C33	H59	177.3°	90.0°
C33	C32	O27	H57	119.7°	90.0°
C33	C32	O27	H48	58.8°	90.0°
C32	C33	O28	H49	58.4°	90.0°
C33	C32	C30	H52	146.7°	90.0°
C32	C33	C34	H61	84.6°	90.0°
O27	C32	C30	H52	25.4°	90.0°
O27	C32	C33	H59	61.8°	90.0°
H1	C4	C13	H7	56.4°	90.0°
H1	C4	C3	H23	0.2°	90.0°
H2	C5	C12	H31	171.6°	90.0°
H3	C6	C7	H4	166.7°	90.0°
H3	C6	C7	H5	46.5°	90.0°
H3	C6	C10	H6	54.3°	90.0°
H6	C10	O9	H27	60.0°	90.0°
H6	C10	C11	H29	171.3°	90.0°
H7	C13	O12	H32	61.0°	90.0°
H7	C13	C14	H34	177.6°	90.0°
H8	C15	C14	H34	124.6°	90.0°
H8	C15	O14	H35	61.7°	90.0°
H8	C15	C16	H36	69.1°	90.0°
H9	C17	C40	H69	90.2°	90.0°
H10	C20	C37	H66	64.3°	90.0°
H11	C21	C22	H12	117.8°	90.0°
H11	C21	C22	H13	122.1°	90.0°
H11	C21	C35	H63	69.9°	90.0°
H14	C24	C26	H15	179.4°	90.0°
H14	C24	C25	H44	132.8°	90.0°
H14	C24	C25	H45	107.7°	90.0°
H15	C26	O22	H41	60.5°	90.0°
H15	C26	C27	H47	174.1°	90.0°
H16	C28	C23	H42	72.3°	90.0°
H16	C28	C27	H47	46.2°	90.0°
H17	C1	C2	H20	59.9°	90.0°
H17	C1	C2	H21	60.0°	90.0°
H17	C1	O38	C56	90.0°	90.0°
H17	C1	C56	O36	90.0°	90.0°
H17	C1	O38	C72	90.0°	90.0°
H17	C1	C56	H96	90.0°	90.0°
H17	C1	C56	H97	90.0°	90.0°
H20	C2	C1	O38	117.1°	90.0°
H20	C2	C1	C56	117.1°	90.0°
H21	C2	C1	O38	2.8°	90.0°
H21	C2	C1	C56	2.8°	90.0°
H23	C3	C16	H36	64.9°	90.0°
H24	C9	H25	C41	121.7°	90.0°
H24	C9	C41	C42	90.0°	90.0°
H24	C9	C41	H18	90.0°	90.0°
H24	C9	C41	H19	90.0°	90.0°
H25	C9	C41	C42	90.0°	90.0°
H25	C9	C41	H18	90.0°	90.0°
H25	C9	C41	H19	90.0°	90.0°
H28	O10	C11	H29	60.0°	90.0°
H29	C11	C12	H31	13.1°	90.0°
H30	O11	C12	H31	60.9°	90.0°
H33	O13	C14	H34	61.6°	90.0°
H37	C18	C19	H38	78.5°	90.0°
H37	C18	C19	H39	41.8°	90.0°
H37	C18	C38	H67	105.9°	90.0°
H40	O21	C25	H44	59.8°	90.0°
H40	O21	C25	H45	59.7°	90.0°
H43	O23	C27	H47	61.1°	90.0°
H46	O26	C31	H54	59.6°	90.0°
H46	O26	C31	H55	59.7°	90.0°
H48	O27	C32	H57	60.9°	90.0°
H49	O28	C33	H59	61.0°	90.0°
H50	C29	C34	H61	26.3°	90.0°
H51	O29	C34	H61	61.2°	90.0°
H52	C30	C31	H54	111.4°	90.0°
H52	C30	C31	H55	129.3°	90.0°
H52	C30	C32	H57	94.6°	90.0°
H53	O30	C35	H63	61.9°	90.0°
H56	O31	C36	H65	61.4°	90.0°
H57	C32	C33	H59	58.7°	90.0°
H58	O32	C37	H66	60.1°	90.0°
H59	C33	C34	H61	34.5°	90.0°
H60	O33	C38	H67	60.3°	90.0°
H62	O34	C39	H68	62.4°	90.0°
H63	C35	C36	H65	81.3°	90.0°
H64	O35	C40	H69	60.0°	90.0°
H65	C36	C37	H66	12.6°	90.0°
H67	C38	C39	H68	65.0°	90.0°
H68	C39	C40	H69	31.7°	90.0°
C9	C41	C42	H18	90.0°	90.0°
C9	C41	C42	H19	90.0°	90.0°
C9	C41	C42	C43	90.0°	90.0°
C9	C41	H18	H19	90.0°	90.0°
C9	C41	C42	H26	90.0°	90.0°
C9	C41	C42	H70	90.0°	90.0°
C41	C42	C43	H26	90.0°	90.0°
C41	C42	C43	H70	90.0°	90.0°
C41	C42	C43	C44	90.0°	90.0°
C42	C41	H18	H19	90.0°	90.0°
C41	C42	H26	H70	90.0°	90.0°
C41	C42	C43	H71	90.0°	90.0°
C41	C42	C43	H72	90.0°	90.0°
C42	C43	C44	H71	90.0°	90.0°
C42	C43	C44	H72	90.0°	90.0°
C42	C43	C44	C45	90.0°	90.0°
C43	C42	C41	H18	90.0°	90.0°
C43	C42	C41	H19	90.0°	90.0°
C43	C42	H26	H70	90.0°	90.0°
C42	C43	H71	H72	90.0°	90.0°
C42	C43	C44	H73	90.0°	90.0°
C42	C43	C44	H74	90.0°	90.0°
C43	C44	C45	H73	90.0°	90.0°
C43	C44	C45	H74	90.0°	90.0°
C43	C44	C45	C46	90.0°	90.0°
C44	C43	C42	H26	90.0°	90.0°
C44	C43	C42	H70	90.0°	90.0°
C44	C43	H71	H72	90.0°	90.0°
C43	C44	H73	H74	90.0°	90.0°
C43	C44	C45	H75	90.0°	90.0°
C43	C44	C45	H76	90.0°	90.0°
C44	C45	C46	H75	90.0°	90.0°
C44	C45	C46	H76	90.0°	90.0°
C44	C45	C46	C47	90.0°	90.0°
C45	C44	C43	H71	90.0°	90.0°
C45	C44	C43	H72	90.0°	90.0°
C45	C44	H73	H74	90.0°	90.0°
C44	C45	H75	H76	90.0°	90.0°
C44	C45	C46	H77	90.0°	90.0°
C44	C45	C46	H78	90.0°	90.0°
C45	C46	C47	H77	90.0°	90.0°
C45	C46	C47	H78	90.0°	90.0°
C45	C46	C47	C48	90.0°	90.0°
C46	C45	C44	H73	90.0°	90.0°
C46	C45	C44	H74	90.0°	90.0°
C46	C45	H75	H76	90.0°	90.0°
C45	C46	H77	H78	90.0°	90.0°
C45	C46	C47	H79	90.0°	90.0°
C45	C46	C47	H80	90.0°	90.0°
C46	C47	C48	H79	90.0°	90.0°
C46	C47	C48	H80	90.0°	90.0°
C46	C47	C48	C49	90.0°	90.0°
C47	C46	C45	H75	90.0°	90.0°
C47	C46	C45	H76	90.0°	90.0°
C47	C46	H77	H78	90.0°	90.0°
C46	C47	H79	H80	90.0°	90.0°
C46	C47	C48	H81	90.0°	90.0°
C46	C47	C48	H82	90.0°	90.0°
C47	C48	C49	H81	90.0°	90.0°
C47	C48	C49	H82	90.0°	90.0°
C47	C48	C49	C50	90.0°	90.0°
C48	C47	C46	H77	90.0°	90.0°
C48	C47	C46	H78	90.0°	90.0°
C48	C47	H79	H80	90.0°	90.0°
C47	C48	H81	H82	90.0°	90.0°
C47	C48	C49	H83	90.0°	90.0°
C47	C48	C49	H84	90.0°	90.0°
C48	C49	C50	H83	90.0°	90.0°
C48	C49	C50	H84	90.0°	90.0°
C48	C49	C50	C51	90.0°	90.0°
C49	C48	C47	H79	90.0°	90.0°
C49	C48	C47	H80	90.0°	90.0°
C49	C48	H81	H82	90.0°	90.0°
C48	C49	H83	H84	90.0°	90.0°
C48	C49	C50	H85	90.0°	90.0°
C48	C49	C50	H86	90.0°	90.0°
C49	C50	C51	H85	90.0°	90.0°
C49	C50	C51	H86	90.0°	90.0°
C49	C50	C51	C52	90.0°	90.0°
C50	C49	C48	H81	90.0°	90.0°
C50	C49	C48	H82	90.0°	90.0°
C50	C49	H83	H84	90.0°	90.0°
C49	C50	H85	H86	90.0°	90.0°
C49	C50	C51	H87	90.0°	90.0°
C49	C50	C51	H88	90.0°	90.0°
C50	C51	C52	H87	90.0°	90.0°
C50	C51	C52	H88	90.0°	90.0°
C50	C51	C52	C53	90.0°	90.0°
C51	C50	C49	H83	90.0°	90.0°
C51	C50	C49	H84	90.0°	90.0°
C51	C50	H85	H86	90.0°	90.0°
C50	C51	H87	H88	90.0°	90.0°
C50	C51	C52	H89	90.0°	90.0°
C50	C51	C52	H90	90.0°	90.0°
C51	C52	C53	H89	90.0°	90.0°
C51	C52	C53	H90	90.0°	90.0°
C51	C52	C53	C54	90.0°	90.0°
C52	C51	C50	H85	90.0°	90.0°
C52	C51	C50	H86	90.0°	90.0°
C52	C51	H87	H88	90.0°	90.0°
C51	C52	H89	H90	90.0°	90.0°
C51	C52	C53	H91	90.0°	90.0°
C51	C52	C53	H92	90.0°	90.0°
C52	C53	C54	H91	90.0°	90.0°
C52	C53	C54	H92	90.0°	90.0°
C53	C52	C51	H87	90.0°	90.0°
C53	C52	C51	H88	90.0°	90.0°
C53	C52	H89	H90	90.0°	90.0°
C52	C53	H91	H92	90.0°	90.0°
C52	C53	C54	H93	90.0°	90.0°
C52	C53	C54	H94	90.0°	90.0°
C52	C53	C54	H95	90.0°	90.0°
C54	C53	C52	H89	90.0°	90.0°
C54	C53	C52	H90	90.0°	90.0°
C54	C53	H91	H92	90.0°	90.0°
C53	C54	H93	H94	90.0°	90.0°
C53	C54	H93	H95	90.0°	90.0°
C53	C54	H94	H95	90.0°	90.0°
O38	C1	C56	O36	90.0°	90.0°
C1	O38	C72	C73	90.0°	90.0°
C1	O38	C72	O39	90.0°	90.0°
O38	C1	C56	H96	90.0°	90.0°
O38	C1	C56	H97	90.0°	90.0°
C1	C56	O36	H96	90.0°	90.0°
C1	C56	O36	H97	90.0°	90.0°
C1	C56	O36	C58	90.0°	90.0°
C56	C1	O38	C72	90.0°	90.0°
C1	C56	H96	H97	90.0°	90.0°
C56	O36	C58	C57	90.0°	90.0°
C56	O36	C58	O37	90.0°	90.0°
O36	C56	H96	H97	90.0°	90.0°
O36	C58	C57	O37	90.0°	90.0°
O36	C58	C57	C59	90.0°	90.0°
C58	O36	C56	H96	90.0°	90.0°
C58	O36	C56	H97	90.0°	90.0°
O36	C58	C57	H98	90.0°	90.0°
O36	C58	C57	H99	90.0°	90.0°
C58	C57	C59	H98	90.0°	90.0°
C58	C57	C59	H99	90.0°	90.0°
C58	C57	C59	C55	90.0°	90.0°
C58	C57	H98	H99	90.0°	90.0°
C58	C57	C59	H100	90.0°	90.0°
C58	C57	C59	H101	90.0°	90.0°
C59	C57	C58	O37	90.0°	90.0°
C57	C59	C55	H100	90.0°	90.0°
C57	C59	C55	H101	90.0°	90.0°
C57	C59	C55	C60	90.0°	90.0°
C59	C57	H98	H99	90.0°	90.0°
C57	C59	H100	H101	90.0°	90.0°
C57	C59	C55	H102	90.0°	90.0°
C57	C59	C55	H103	90.0°	90.0°
O37	C58	C57	H98	90.0°	90.0°
O37	C58	C57	H99	90.0°	90.0°
C59	C55	C60	H102	90.0°	90.0°
C59	C55	C60	H103	90.0°	90.0°
C59	C55	C60	C61	90.0°	90.0°
C55	C59	C57	H98	90.0°	90.0°
C55	C59	C57	H99	90.0°	90.0°
C55	C59	H100	H101	90.0°	90.0°
C59	C55	H102	H103	90.0°	90.0°
C59	C55	C60	H104	90.0°	90.0°
C59	C55	C60	H105	90.0°	90.0°
C55	C60	C61	H104	90.0°	90.0°
C55	C60	C61	H105	90.0°	90.0°
C55	C60	C61	C62	90.0°	90.0°
C60	C55	C59	H100	90.0°	90.0°
C60	C55	C59	H101	90.0°	90.0°
C60	C55	H102	H103	90.0°	90.0°
C55	C60	H104	H105	90.0°	90.0°
C60	C61	C62	C63	90.0°	90.0°
C61	C60	C55	H102	90.0°	90.0°
C61	C60	C55	H103	90.0°	90.0°
C61	C60	H104	H105	90.0°	90.0°
C61	C62	C63	C64	90.0°	90.0°
C62	C61	C60	H104	90.0°	90.0°
C62	C61	C60	H105	90.0°	90.0°
C62	C63	C64	C65	90.0°	90.0°
C63	C64	C65	C66	90.0°	90.0°
C64	C65	C66	C67	90.0°	90.0°
C65	C66	C67	C68	90.0°	90.0°
C66	C67	C68	C69	90.0°	90.0°
C67	C68	C69	C70	90.0°	90.0°
C68	C69	C70	C71	90.0°	90.0°
O38	C72	C73	O39	90.0°	90.0°
O38	C72	C73	C74	90.0°	90.0°
C72	C73	C74	C75	90.0°	90.0°
O39	C72	C73	C74	90.0°	90.0°
C73	C74	C75	C76	90.0°	90.0°
C74	C75	C76	C77	90.0°	90.0°
C75	C76	C77	C78	90.0°	90.0°
C76	C77	C78	C79	90.0°	90.0°
C77	C78	C79	C80	90.0°	90.0°
C78	C79	C80	C81	90.0°	90.0°
C79	C80	C81	C82	90.0°	90.0°
C79	C80	C81	C90	90.0°	90.0°
C80	C81	C82	C90	90.0°	90.0°
C80	C81	C82	C83	90.0°	90.0°
C81	C82	C83	C84	90.0°	90.0°
C82	C83	C84	C85	90.0°	90.0°
C83	C82	C81	C90	90.0°	90.0°
C83	C84	C85	C86	90.0°	90.0°
C84	C85	C86	C87	90.0°	90.0°
C85	C86	C87	C88	90.0°	90.0°
C86	C87	C88	C89	90.0°	90.0°
H18	C41	C42	H26	90.0°	90.0°
H18	C41	C42	H70	90.0°	90.0°
H19	C41	C42	H26	90.0°	90.0°
H19	C41	C42	H70	90.0°	90.0°
H26	C42	C43	H71	90.0°	90.0°
H26	C42	C43	H72	90.0°	90.0°
H70	C42	C43	H71	90.0°	90.0°
H70	C42	C43	H72	90.0°	90.0°
H71	C43	C44	H73	90.0°	90.0°
H71	C43	C44	H74	90.0°	90.0°
H72	C43	C44	H73	90.0°	90.0°
H72	C43	C44	H74	90.0°	90.0°
H73	C44	C45	H75	90.0°	90.0°
H73	C44	C45	H76	90.0°	90.0°
H74	C44	C45	H75	90.0°	90.0°
H74	C44	C45	H76	90.0°	90.0°
H75	C45	C46	H77	90.0°	90.0°
H75	C45	C46	H78	90.0°	90.0°
H76	C45	C46	H77	90.0°	90.0°
H76	C45	C46	H78	90.0°	90.0°
H77	C46	C47	H79	90.0°	90.0°
H77	C46	C47	H80	90.0°	90.0°
H78	C46	C47	H79	90.0°	90.0°
H78	C46	C47	H80	90.0°	90.0°
H79	C47	C48	H81	90.0°	90.0°
H79	C47	C48	H82	90.0°	90.0°
H80	C47	C48	H81	90.0°	90.0°
H80	C47	C48	H82	90.0°	90.0°
H81	C48	C49	H83	90.0°	90.0°
H81	C48	C49	H84	90.0°	90.0°
H82	C48	C49	H83	90.0°	90.0°
H82	C48	C49	H84	90.0°	90.0°
H83	C49	C50	H85	90.0°	90.0°
H83	C49	C50	H86	90.0°	90.0°
H84	C49	C50	H85	90.0°	90.0°
H84	C49	C50	H86	90.0°	90.0°
H85	C50	C51	H87	90.0°	90.0°
H85	C50	C51	H88	90.0°	90.0°
H86	C50	C51	H87	90.0°	90.0°
H86	C50	C51	H88	90.0°	90.0°
H87	C51	C52	H89	90.0°	90.0°
H87	C51	C52	H90	90.0°	90.0°
H88	C51	C52	H89	90.0°	90.0°
H88	C51	C52	H90	90.0°	90.0°
H89	C52	C53	H91	90.0°	90.0°
H89	C52	C53	H92	90.0°	90.0°
H90	C52	C53	H91	90.0°	90.0°
H90	C52	C53	H92	90.0°	90.0°
H91	C53	C54	H93	90.0°	90.0°
H91	C53	C54	H94	90.0°	90.0°
H91	C53	C54	H95	90.0°	90.0°
H92	C53	C54	H93	90.0°	90.0°
H92	C53	C54	H94	90.0°	90.0°
H92	C53	C54	H95	90.0°	90.0°
H93	C54	H94	H95	90.0°	90.0°
H98	C57	C59	H100	90.0°	90.0°
H98	C57	C59	H101	90.0°	90.0°
H99	C57	C59	H100	90.0°	90.0°
H99	C57	C59	H101	90.0°	90.0°
H100	C59	C55	H102	90.0°	90.0°
H100	C59	C55	H103	90.0°	90.0°
H101	C59	C55	H102	90.0°	90.0°
H101	C59	C55	H103	90.0°	90.0°
H102	C55	C60	H104	90.0°	90.0°
H102	C55	C60	H105	90.0°	90.0°
H103	C55	C60	H104	90.0°	90.0°
H103	C55	C60	H105	90.0°	90.0°

Release date:	2025-06-25
Definition date:	2024-09-19
Last modified:	2025-06-20
Release status:	REL
Processing site:	RCSB
Derived from:	9DM5