A1L6D

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C39	C38	sing	1.51Å	0.00Å
O5	C38	doub	1.21Å	0.00Å
C38	O4	sing	1.34Å	0.00Å
O4	C34	sing	1.45Å	0.00Å
C34	C35	sing	1.53Å	0.00Å
C34	C33	sing	1.53Å	0.00Å
C35	C36	sing	1.53Å	0.00Å
C33	C32	sing	1.53Å	0.00Å
C41	C32	sing	1.53Å	0.00Å
C32	C31	sing	1.51Å	0.00Å
C32	C40	sing	1.53Å	0.00Å
C36	C37	sing	1.53Å	0.00Å
C36	C31	sing	1.51Å	0.00Å
C36	O3	sing	1.43Å	0.00Å
C31	C30	doub	1.31Å	0.00Å
C30	C29	doub	1.31Å	0.00Å
C28	C27	sing	1.51Å	0.00Å
C29	C27	sing	1.34Å	0.00Å
C27	C26	doub	1.42Å	0.00Å
C26	C25	sing	1.36Å	0.00Å
C25	C24	doub	1.40Å	0.00Å
C	C1	sing	1.51Å	0.00Å
C24	C1	sing	1.38Å	0.00Å
C1	C2	doub	1.39Å	0.00Å
C2	C3	sing	1.39Å	0.00Å
C3	C4	doub	1.39Å	0.00Å
C4	C5	sing	1.39Å	0.00Å
C5	C6	doub	1.39Å	0.00Å
C6	C43	sing	1.39Å	0.00Å
C6	C7	sing	1.51Å	0.00Å
C43	C42	doub	1.38Å	0.00Å
C42	C8	sing	1.40Å	0.00Å
C8	C9	doub	1.38Å	0.00Å
C22	C16	sing	1.53Å	0.00Å
C9	C10	sing	1.40Å	0.00Å
C9	C12	sing	1.51Å	0.00Å
O1	C10	sing	1.35Å	0.00Å
C10	C11	doub	1.39Å	0.00Å
C17	C16	sing	1.54Å	0.00Å
C17	C18	sing	1.55Å	0.00Å
C16	C23	sing	1.53Å	0.00Å
C16	C15	sing	1.54Å	0.00Å
C11	C13	sing	1.39Å	0.00Å
C13	O	doub	1.22Å	0.00Å
C13	C15	sing	1.51Å	0.00Å
C15	C21	sing	1.53Å	0.00Å
C15	C19	sing	1.54Å	0.00Å
C18	O2	sing	1.43Å	0.00Å
C18	C19	sing	1.55Å	0.00Å
C2	H1	sing	1.08Å	0.00Å
C3	H2	sing	1.08Å	0.00Å
C4	H3	sing	1.08Å	0.00Å
C5	H4	sing	1.08Å	0.00Å
C39	H5	sing	1.09Å	0.00Å
C39	H6	sing	1.09Å	0.00Å
C39	H7	sing	1.09Å	0.00Å
C34	H8	sing	1.09Å	0.00Å
C33	H9	sing	1.09Å	0.00Å
C33	H10	sing	1.09Å	0.00Å
C41	H11	sing	1.09Å	0.00Å
C41	H12	sing	1.09Å	0.00Å
C41	H13	sing	1.09Å	0.00Å
C40	H14	sing	1.09Å	0.00Å
C40	H15	sing	1.09Å	0.00Å
C40	H16	sing	1.09Å	0.00Å
C35	H17	sing	1.09Å	0.00Å
C35	H18	sing	1.09Å	0.00Å
C37	H19	sing	1.09Å	0.00Å
C37	H20	sing	1.09Å	0.00Å
C37	H21	sing	1.09Å	0.00Å
O3	H22	sing	0.97Å	0.00Å
C29	H23	sing	1.08Å	0.00Å
C28	H24	sing	1.09Å	0.00Å
C28	H25	sing	1.09Å	0.00Å
C28	H26	sing	1.09Å	0.00Å
C26	H27	sing	1.08Å	0.00Å
C25	H28	sing	1.08Å	0.00Å
C24	H29	sing	1.08Å	0.00Å
C	H30	sing	1.09Å	0.00Å
C	H31	sing	1.09Å	0.00Å
C	H32	sing	1.09Å	0.00Å
C7	H33	sing	1.09Å	0.00Å
C7	H34	sing	1.09Å	0.00Å
C7	H35	sing	1.09Å	0.00Å
C11	H36	sing	1.08Å	0.00Å
C19	H37	sing	1.09Å	0.00Å
C19	H38	sing	1.09Å	0.00Å
C18	H39	sing	1.09Å	0.00Å
O2	H40	sing	0.97Å	0.00Å
C17	H41	sing	1.09Å	0.00Å
C17	H42	sing	1.09Å	0.00Å
C23	H43	sing	1.09Å	0.00Å
C23	H44	sing	1.09Å	0.00Å
C23	H45	sing	1.09Å	0.00Å
C22	H46	sing	1.09Å	0.00Å
C22	H47	sing	1.09Å	0.00Å
C22	H48	sing	1.09Å	0.00Å
O1	H49	sing	0.97Å	0.00Å
C12	H50	sing	1.09Å	0.00Å
C12	H51	sing	1.09Å	0.00Å
C12	H52	sing	1.09Å	0.00Å
C8	H53	sing	1.08Å	0.00Å
C42	H54	sing	1.08Å	0.00Å
C43	H55	sing	1.08Å	0.00Å
C21	H56	sing	1.09Å	0.00Å
C21	H57	sing	1.09Å	0.00Å
C21	H58	sing	1.09Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C39	C38	O5	90.0°	120.0°
C39	C38	O4	90.0°	120.0°
C38	C39	H5	90.0°	109.5°
C38	C39	H6	90.0°	109.5°
C38	C39	H7	90.0°	109.5°
O5	C38	O4	90.0°	120.0°
C38	O4	C34	90.0°	117.0°
O4	C34	C35	90.0°	109.4°
O4	C34	C33	90.0°	109.4°
O4	C34	H8	90.0°	109.4°
C35	C34	C33	90.0°	109.8°
C34	C35	C36	90.0°	109.4°
C35	C34	H8	90.0°	109.4°
C34	C35	H17	90.0°	109.5°
C34	C35	H18	90.0°	109.5°
C34	C33	C32	90.0°	109.4°
C33	C34	H8	90.0°	109.3°
C34	C33	H9	90.0°	109.5°
C34	C33	H10	90.0°	109.5°
C35	C36	C37	90.0°	109.6°
C35	C36	C31	90.0°	108.6°
C35	C36	O3	90.0°	109.7°
C36	C35	H17	90.0°	109.4°
C36	C35	H18	90.0°	109.5°
C33	C32	C41	90.0°	109.6°
C33	C32	C31	90.0°	108.5°
C33	C32	C40	90.0°	109.7°
C32	C33	H9	90.0°	109.4°
C32	C33	H10	90.0°	109.5°
C41	C32	C31	90.0°	109.6°
C41	C32	C40	90.0°	109.8°
C32	C41	H11	90.0°	109.5°
C32	C41	H12	90.0°	109.4°
C32	C41	H13	90.0°	109.5°
C31	C32	C40	90.0°	109.6°
C32	C31	C36	90.0°	118.3°
C32	C31	C30	90.0°	120.9°
C32	C40	H14	90.0°	109.5°
C32	C40	H15	90.0°	109.5°
C32	C40	H16	90.0°	109.4°
C37	C36	C31	90.0°	109.6°
C37	C36	O3	90.0°	109.6°
C36	C37	H19	90.0°	109.4°
C36	C37	H20	90.0°	109.5°
C36	C37	H21	90.0°	109.4°
C31	C36	O3	90.0°	109.8°
C36	C31	C30	90.0°	120.9°
C36	O3	H22	90.0°	114.0°
C31	C30	C29	90.0°	180.0°
C30	C29	C27	90.0°	120.0°
C30	C29	H23	90.0°	120.0°
C28	C27	C29	90.0°	120.0°
C28	C27	C26	90.0°	120.0°
C27	C28	H24	90.0°	109.5°
C27	C28	H25	90.0°	109.5°
C27	C28	H26	90.0°	109.5°
C29	C27	C26	90.0°	120.0°
C27	C29	H23	90.0°	120.0°
C27	C26	C25	90.0°	120.0°
C27	C26	H27	90.0°	120.0°
C26	C25	C24	90.0°	120.0°
C25	C26	H27	90.0°	120.0°
C26	C25	H28	90.0°	120.1°
C25	C24	C1	90.0°	120.0°
C24	C25	H28	90.0°	120.0°
C25	C24	H29	90.0°	120.0°
C	C1	C24	90.0°	120.0°
C	C1	C2	90.0°	120.0°
C1	C	H30	90.0°	109.5°
C1	C	H31	90.0°	109.5°
C1	C	H32	90.0°	109.5°
C24	C1	C2	90.0°	120.0°
C1	C24	H29	90.0°	120.0°
C1	C2	C3	90.0°	120.0°
C1	C2	H1	90.0°	120.0°
C2	C3	C4	90.0°	120.0°
C3	C2	H1	90.0°	119.9°
C2	C3	H2	90.0°	120.0°
C3	C4	C5	90.0°	120.0°
C4	C3	H2	90.0°	120.0°
C3	C4	H3	90.0°	120.0°
C4	C5	C6	90.0°	120.0°
C5	C4	H3	90.0°	120.0°
C4	C5	H4	90.0°	120.0°
C5	C6	C43	90.0°	120.0°
C5	C6	C7	90.0°	120.0°
C6	C5	H4	90.0°	120.0°
C43	C6	C7	90.0°	120.0°
C6	C43	C42	90.0°	120.0°
C6	C43	H55	90.0°	120.1°
C6	C7	H33	90.0°	109.4°
C6	C7	H34	90.0°	109.5°
C6	C7	H35	90.0°	109.4°
C43	C42	C8	90.0°	120.0°
C43	C42	H54	90.0°	120.0°
C42	C43	H55	90.0°	120.0°
C42	C8	C9	90.0°	120.0°
C42	C8	H53	90.0°	120.0°
C8	C42	H54	90.0°	120.0°
C8	C9	C10	90.0°	120.0°
C8	C9	C12	90.0°	120.0°
C9	C8	H53	90.0°	120.0°
C22	C16	C17	90.0°	110.0°
C22	C16	C23	90.0°	110.0°
C22	C16	C15	90.0°	110.1°
C16	C22	H46	90.0°	109.4°
C16	C22	H47	90.0°	109.5°
C16	C22	H48	90.0°	109.5°
C10	C9	C12	90.0°	120.0°
C9	C10	O1	90.0°	120.0°
C9	C10	C11	90.0°	120.0°
C9	C12	H50	90.0°	109.5°
C9	C12	H51	90.0°	109.4°
C9	C12	H52	90.0°	109.5°
O1	C10	C11	90.0°	120.0°
C10	O1	H49	90.0°	114.0°
C10	C11	C13	90.0°	120.0°
C10	C11	H36	90.0°	120.0°
C16	C17	C18	90.0°	104.2°
C17	C16	C23	90.0°	110.0°
C17	C16	C15	90.0°	106.6°
C16	C17	H41	90.0°	110.5°
C16	C17	H42	90.0°	110.5°
C17	C18	O2	90.0°	110.7°
C17	C18	C19	90.0°	102.8°
C17	C18	H39	90.0°	110.9°
C18	C17	H41	90.0°	110.5°
C18	C17	H42	90.0°	110.4°
C23	C16	C15	90.0°	110.1°
C16	C23	H43	90.0°	109.5°
C16	C23	H44	90.0°	109.5°
C16	C23	H45	90.0°	109.5°
C16	C15	C13	90.0°	110.0°
C16	C15	C21	90.0°	110.0°
C16	C15	C19	90.0°	106.6°
C11	C13	O	90.0°	120.0°
C11	C13	C15	90.0°	120.0°
C13	C11	H36	90.0°	120.0°
O	C13	C15	90.0°	120.0°
C13	C15	C21	90.0°	110.0°
C13	C15	C19	90.0°	110.0°
C21	C15	C19	90.0°	110.0°
C15	C21	H56	90.0°	109.5°
C15	C21	H57	90.0°	109.5°
C15	C21	H58	90.0°	109.5°
C15	C19	C18	90.0°	104.2°
C15	C19	H37	90.0°	110.5°
C15	C19	H38	90.0°	110.5°
O2	C18	C19	90.0°	110.8°
O2	C18	H39	90.0°	110.6°
C18	O2	H40	90.0°	114.0°
C18	C19	H37	90.0°	110.5°
C18	C19	H38	90.0°	110.6°
C19	C18	H39	90.0°	110.8°
H5	C39	H6	90.0°	109.5°
H5	C39	H7	90.0°	109.4°
H6	C39	H7	90.0°	109.5°
H9	C33	H10	90.0°	109.5°
H11	C41	H12	90.0°	109.5°
H11	C41	H13	90.0°	109.5°
H12	C41	H13	90.0°	109.5°
H14	C40	H15	90.0°	109.5°
H14	C40	H16	90.0°	109.5°
H15	C40	H16	90.0°	109.4°
H17	C35	H18	90.0°	109.5°
H19	C37	H20	90.0°	109.5°
H19	C37	H21	90.0°	109.5°
H20	C37	H21	90.0°	109.5°
H24	C28	H25	90.0°	109.5°
H24	C28	H26	90.0°	109.5°
H25	C28	H26	90.0°	109.5°
H30	C	H31	90.0°	109.5°
H30	C	H32	90.0°	109.4°
H31	C	H32	90.0°	109.5°
H33	C7	H34	90.0°	109.5°
H33	C7	H35	90.0°	109.5°
H34	C7	H35	90.0°	109.5°
H37	C19	H38	90.0°	110.4°
H41	C17	H42	90.0°	110.6°
H43	C23	H44	90.0°	109.5°
H43	C23	H45	90.0°	109.4°
H44	C23	H45	90.0°	109.5°
H46	C22	H47	90.0°	109.5°
H46	C22	H48	90.0°	109.5°
H47	C22	H48	90.0°	109.5°
H50	C12	H51	90.0°	109.6°
H50	C12	H52	90.0°	109.5°
H51	C12	H52	90.0°	109.4°
H56	C21	H57	90.0°	109.4°
H56	C21	H58	90.0°	109.4°
H57	C21	H58	90.0°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C39	C38	O5	O4	90.0°	180.0°
C39	C38	O4	C34	90.0°	180.0°
C38	C39	H5	H6	90.0°	120.0°
C38	C39	H5	H7	90.0°	120.0°
C38	C39	H6	H7	90.0°	120.0°
O5	C38	O4	C34	90.0°	0.0°
O5	C38	C39	H5	90.0°	89.9°
O5	C38	C39	H6	90.0°	150.0°
O5	C38	C39	H7	90.0°	30.0°
C38	O4	C34	C35	90.0°	90.0°
C38	O4	C34	C33	90.0°	149.6°
O4	C38	C39	H5	90.0°	90.0°
O4	C38	C39	H6	90.0°	30.0°
O4	C38	C39	H7	90.0°	150.0°
C38	O4	C34	H8	90.0°	29.8°
O4	C34	C35	C33	90.0°	120.1°
O4	C34	C35	H8	90.0°	119.9°
O4	C34	C33	H8	90.0°	119.8°
O4	C34	C35	C36	90.0°	176.3°
O4	C34	C33	C32	90.0°	176.3°
O4	C34	C33	H9	90.0°	63.7°
O4	C34	C33	H10	90.0°	56.3°
O4	C34	C35	H17	90.0°	56.3°
O4	C34	C35	H18	90.0°	63.7°
C35	C34	C33	H8	90.0°	120.0°
C34	C35	C36	H17	90.0°	119.9°
C34	C35	C36	H18	90.0°	120.0°
C35	C34	C33	C32	90.0°	63.6°
C34	C35	C36	C37	90.0°	174.3°
C34	C35	C36	C31	90.0°	54.7°
C34	C35	C36	O3	90.0°	65.3°
C35	C34	C33	H9	90.0°	56.4°
C35	C34	C33	H10	90.0°	176.4°
C34	C35	H17	H18	90.0°	120.0°
C33	C34	C35	C36	90.0°	63.6°
C34	C33	C32	H9	90.0°	120.0°
C34	C33	C32	H10	90.0°	120.0°
C34	C33	C32	C41	90.0°	65.1°
C34	C33	C32	C31	90.0°	54.6°
C34	C33	C32	C40	90.0°	174.4°
C34	C33	H9	H10	90.0°	120.0°
C33	C34	C35	H17	90.0°	176.5°
C33	C34	C35	H18	90.0°	56.4°
C35	C36	C31	C32	90.0°	51.4°
C35	C36	C37	C31	90.0°	119.0°
C35	C36	C37	O3	90.0°	120.4°
C35	C36	C31	O3	90.0°	119.9°
C35	C36	C31	C30	90.0°	128.6°
C36	C35	C34	H8	90.0°	56.4°
C36	C35	H17	H18	90.0°	120.1°
C35	C36	C37	H19	90.0°	59.9°
C35	C36	C37	H20	90.0°	180.0°
C35	C36	C37	H21	90.0°	60.0°
C35	C36	O3	H22	90.0°	60.0°
C33	C32	C41	C31	90.0°	119.0°
C33	C32	C41	C40	90.0°	120.5°
C33	C32	C31	C40	90.0°	119.8°
C33	C32	C31	C36	90.0°	51.3°
C33	C32	C31	C30	90.0°	128.6°
C32	C33	C34	H8	90.0°	56.5°
C32	C33	H9	H10	90.0°	120.0°
C33	C32	C41	H11	90.0°	60.0°
C33	C32	C41	H12	90.0°	180.0°
C33	C32	C41	H13	90.0°	60.1°
C33	C32	C40	H14	90.0°	60.0°
C33	C32	C40	H15	90.0°	179.9°
C33	C32	C40	H16	90.0°	60.0°
C41	C32	C31	C40	90.0°	120.6°
C41	C32	C31	C36	90.0°	68.4°
C41	C32	C31	C30	90.0°	111.7°
C41	C32	C33	H9	90.0°	174.9°
C41	C32	C33	H10	90.0°	54.9°
C32	C41	H11	H12	90.0°	120.0°
C32	C41	H11	H13	90.0°	120.0°
C32	C41	H12	H13	90.0°	120.0°
C41	C32	C40	H14	90.0°	60.5°
C41	C32	C40	H15	90.0°	59.6°
C41	C32	C40	H16	90.0°	179.5°
C32	C31	C36	C37	90.0°	171.1°
C32	C31	C36	C30	90.0°	179.9°
C32	C31	C36	O3	90.0°	68.5°
C32	C31	C30	C29	90.0°	78.0°
C31	C32	C33	H9	90.0°	65.4°
C31	C32	C33	H10	90.0°	174.6°
C31	C32	C41	H11	90.0°	59.0°
C31	C32	C41	H12	90.0°	61.0°
C31	C32	C41	H13	90.0°	179.1°
C31	C32	C40	H14	90.0°	179.0°
C31	C32	C40	H15	90.0°	60.9°
C31	C32	C40	H16	90.0°	59.0°
C40	C32	C31	C36	90.0°	171.1°
C40	C32	C31	C30	90.0°	8.9°
C40	C32	C33	H9	90.0°	54.4°
C40	C32	C33	H10	90.0°	65.6°
C40	C32	C41	H11	90.0°	179.5°
C40	C32	C41	H12	90.0°	59.5°
C40	C32	C41	H13	90.0°	60.5°
C32	C40	H14	H15	90.0°	120.1°
C32	C40	H14	H16	90.0°	120.0°
C32	C40	H15	H16	90.0°	119.9°
C37	C36	C31	O3	90.0°	120.4°
C37	C36	C31	C30	90.0°	8.9°
C37	C36	C35	H17	90.0°	65.7°
C37	C36	C35	H18	90.0°	54.3°
C36	C37	H19	H20	90.0°	120.0°
C36	C37	H19	H21	90.0°	119.9°
C36	C37	H20	H21	90.0°	119.9°
C37	C36	O3	H22	90.0°	60.4°
C36	C31	C30	C29	90.0°	102.1°
C31	C36	C35	H17	90.0°	174.6°
C31	C36	C35	H18	90.0°	65.3°
C31	C36	C37	H19	90.0°	59.1°
C31	C36	C37	H20	90.0°	60.9°
C31	C36	C37	H21	90.0°	179.1°
C31	C36	O3	H22	90.0°	179.2°
O3	C36	C31	C30	90.0°	111.6°
O3	C36	C35	H17	90.0°	54.7°
O3	C36	C35	H18	90.0°	174.7°
O3	C36	C37	H19	90.0°	179.6°
O3	C36	C37	H20	90.0°	59.6°
O3	C36	C37	H21	90.0°	60.4°
C31	C30	C29	C27	90.0°	168.0°
C31	C30	C29	H23	90.0°	12.0°
C30	C29	C27	C28	90.0°	0.0°
C30	C29	C27	H23	90.0°	180.0°
C30	C29	C27	C26	90.0°	180.0°
C28	C27	C29	C26	90.0°	180.0°
C28	C27	C26	C25	90.0°	0.0°
C28	C27	C29	H23	90.0°	180.0°
C27	C28	H24	H25	90.0°	120.0°
C27	C28	H24	H26	90.0°	120.0°
C27	C28	H25	H26	90.0°	120.0°
C28	C27	C26	H27	90.0°	180.0°
C29	C27	C26	C25	90.0°	180.0°
C29	C27	C28	H24	90.0°	90.0°
C29	C27	C28	H25	90.0°	150.0°
C29	C27	C28	H26	90.0°	30.0°
C29	C27	C26	H27	90.0°	0.0°
C27	C26	C25	H27	90.0°	180.0°
C27	C26	C25	C24	90.0°	180.0°
C26	C27	C29	H23	90.0°	0.0°
C26	C27	C28	H24	90.0°	90.0°
C26	C27	C28	H25	90.0°	30.0°
C26	C27	C28	H26	90.0°	150.0°
C27	C26	C25	H28	90.0°	0.0°
C26	C25	C24	H28	90.0°	180.0°
C26	C25	C24	C1	90.0°	180.0°
C26	C25	C24	H29	90.0°	0.1°
C25	C24	C1	C	90.0°	0.3°
C25	C24	C1	H29	90.0°	179.9°
C25	C24	C1	C2	90.0°	180.0°
C24	C25	C26	H27	90.0°	0.0°
C	C1	C24	C2	90.0°	179.7°
C	C1	C2	C3	90.0°	0.3°
C	C1	C2	H1	90.0°	179.7°
C	C1	C24	H29	90.0°	179.7°
C1	C	H30	H31	90.0°	120.0°
C1	C	H30	H32	90.0°	120.0°
C1	C	H31	H32	90.0°	120.0°
C24	C1	C2	C3	90.0°	180.0°
C24	C1	C2	H1	90.0°	0.0°
C1	C24	C25	H28	90.0°	0.0°
C24	C1	C	H30	90.0°	90.3°
C24	C1	C	H31	90.0°	29.7°
C24	C1	C	H32	90.0°	149.7°
C1	C2	C3	H1	90.0°	180.0°
C1	C2	C3	C4	90.0°	180.0°
C1	C2	C3	H2	90.0°	0.0°
C2	C1	C24	H29	90.0°	0.1°
C2	C1	C	H30	90.0°	90.0°
C2	C1	C	H31	90.0°	150.0°
C2	C1	C	H32	90.0°	30.0°
C2	C3	C4	H2	90.0°	180.0°
C2	C3	C4	C5	90.0°	180.0°
C2	C3	C4	H3	90.0°	0.0°
C3	C4	C5	H3	90.0°	180.0°
C3	C4	C5	C6	90.0°	180.0°
C4	C3	C2	H1	90.0°	0.0°
C3	C4	C5	H4	90.0°	0.0°
C4	C5	C6	H4	90.0°	179.9°
C4	C5	C6	C43	90.0°	180.0°
C4	C5	C6	C7	90.0°	0.0°
C5	C4	C3	H2	90.0°	0.0°
C5	C6	C43	C7	90.0°	180.0°
C5	C6	C43	C42	90.0°	180.0°
C6	C5	C4	H3	90.0°	0.0°
C5	C6	C7	H33	90.0°	90.0°
C5	C6	C7	H34	90.0°	150.0°
C5	C6	C7	H35	90.0°	29.9°
C5	C6	C43	H55	90.0°	0.0°
C6	C43	C42	H55	90.0°	179.9°
C6	C43	C42	C8	90.0°	180.0°
C43	C6	C5	H4	90.0°	0.0°
C43	C6	C7	H33	90.0°	90.0°
C43	C6	C7	H34	90.0°	30.0°
C43	C6	C7	H35	90.0°	150.0°
C6	C43	C42	H54	90.0°	0.0°
C7	C6	C43	C42	90.0°	0.0°
C7	C6	C5	H4	90.0°	180.0°
C6	C7	H33	H34	90.0°	120.0°
C6	C7	H33	H35	90.0°	119.9°
C6	C7	H34	H35	90.0°	120.0°
C7	C6	C43	H55	90.0°	179.9°
C43	C42	C8	H54	90.0°	180.0°
C43	C42	C8	C9	90.0°	180.0°
C43	C42	C8	H53	90.0°	0.1°
C42	C8	C9	H53	90.0°	179.9°
C42	C8	C9	C10	90.0°	180.0°
C42	C8	C9	C12	90.0°	0.0°
C8	C42	C43	H55	90.0°	0.1°
C8	C9	C10	C12	90.0°	180.0°
C8	C9	C10	O1	90.0°	0.0°
C8	C9	C10	C11	90.0°	180.0°
C8	C9	C12	H50	90.0°	90.0°
C8	C9	C12	H51	90.0°	30.0°
C8	C9	C12	H52	90.0°	150.0°
C9	C8	C42	H54	90.0°	0.0°
C22	C16	C17	C23	90.0°	121.4°
C22	C16	C17	C15	90.0°	119.3°
C22	C16	C17	C18	90.0°	95.7°
C22	C16	C23	C15	90.0°	121.5°
C22	C16	C15	C13	90.0°	0.0°
C22	C16	C15	C21	90.0°	121.4°
C22	C16	C15	C19	90.0°	119.3°
C22	C16	C17	H41	90.0°	23.0°
C22	C16	C17	H42	90.0°	145.7°
C22	C16	C23	H43	90.0°	179.9°
C22	C16	C23	H44	90.0°	60.0°
C22	C16	C23	H45	90.0°	60.0°
C16	C22	H46	H47	90.0°	119.9°
C16	C22	H46	H48	90.0°	120.0°
C16	C22	H47	H48	90.0°	120.1°
C9	C10	O1	C11	90.0°	179.9°
C9	C10	C11	C13	90.0°	174.7°
C9	C10	C11	H36	90.0°	5.2°
C9	C10	O1	H49	90.0°	175.3°
C10	C9	C12	H50	90.0°	90.0°
C10	C9	C12	H51	90.0°	150.0°
C10	C9	C12	H52	90.0°	30.0°
C10	C9	C8	H53	90.0°	0.1°
C12	C9	C10	O1	90.0°	180.0°
C12	C9	C10	C11	90.0°	0.0°
C9	C12	H50	H51	90.0°	120.0°
C9	C12	H50	H52	90.0°	120.0°
C9	C12	H51	H52	90.0°	119.9°
C12	C9	C8	H53	90.0°	179.9°
O1	C10	C11	C13	90.0°	5.3°
O1	C10	C11	H36	90.0°	174.8°
C10	C11	C13	H36	90.0°	179.9°
C10	C11	C13	O	90.0°	5.9°
C10	C11	C13	C15	90.0°	174.1°
C11	C10	O1	H49	90.0°	4.8°
C16	C17	C18	H41	90.0°	118.6°
C16	C17	C18	H42	90.0°	118.6°
C17	C16	C23	C15	90.0°	117.1°
C17	C16	C15	C13	90.0°	119.3°
C17	C16	C15	C21	90.0°	119.3°
C17	C16	C15	C19	90.0°	0.0°
C16	C17	C18	O2	90.0°	156.3°
C16	C17	C18	C19	90.0°	37.9°
C16	C17	C18	H39	90.0°	80.5°
C16	C17	H41	H42	90.0°	122.7°
C17	C16	C23	H43	90.0°	58.5°
C17	C16	C23	H44	90.0°	178.6°
C17	C16	C23	H45	90.0°	61.4°
C17	C16	C22	H46	90.0°	56.9°
C17	C16	C22	H47	90.0°	176.8°
C17	C16	C22	H48	90.0°	63.1°
C18	C17	C16	C23	90.0°	142.9°
C18	C17	C16	C15	90.0°	23.6°
C17	C18	C19	C15	90.0°	38.0°
C17	C18	O2	C19	90.0°	113.3°
C17	C18	O2	H39	90.0°	123.4°
C17	C18	C19	H39	90.0°	118.5°
C17	C18	C19	H37	90.0°	156.7°
C17	C18	C19	H38	90.0°	80.8°
C17	C18	O2	H40	90.0°	174.8°
C18	C17	H41	H42	90.0°	122.6°
C23	C16	C15	C13	90.0°	121.4°
C23	C16	C15	C21	90.0°	0.1°
C23	C16	C15	C19	90.0°	119.3°
C23	C16	C17	H41	90.0°	98.4°
C23	C16	C17	H42	90.0°	24.3°
C16	C23	H43	H44	90.0°	120.0°
C16	C23	H43	H45	90.0°	120.0°
C16	C23	H44	H45	90.0°	120.0°
C23	C16	C22	H46	90.0°	64.5°
C23	C16	C22	H47	90.0°	55.4°
C23	C16	C22	H48	90.0°	175.5°
C16	C15	C13	C11	90.0°	68.2°
C16	C15	C13	O	90.0°	111.7°
C16	C15	C13	C21	90.0°	121.4°
C16	C15	C13	C19	90.0°	117.2°
C16	C15	C21	C19	90.0°	117.2°
C16	C15	C19	C18	90.0°	23.6°
C16	C15	C19	H37	90.0°	142.3°
C16	C15	C19	H38	90.0°	95.2°
C15	C16	C17	H41	90.0°	142.3°
C15	C16	C17	H42	90.0°	95.0°
C15	C16	C23	H43	90.0°	58.6°
C15	C16	C23	H44	90.0°	61.4°
C15	C16	C23	H45	90.0°	178.6°
C15	C16	C22	H46	90.0°	174.0°
C15	C16	C22	H47	90.0°	66.0°
C15	C16	C22	H48	90.0°	54.1°
C16	C15	C21	H56	90.0°	60.6°
C16	C15	C21	H57	90.0°	59.3°
C16	C15	C21	H58	90.0°	179.4°
C11	C13	O	C15	90.0°	180.0°
C11	C13	C15	C21	90.0°	53.2°
C11	C13	C15	C19	90.0°	174.5°
O	C13	C15	C21	90.0°	126.9°
O	C13	C15	C19	90.0°	5.5°
O	C13	C11	H36	90.0°	174.2°
C13	C15	C21	C19	90.0°	121.4°
C13	C15	C19	C18	90.0°	95.7°
C15	C13	C11	H36	90.0°	5.8°
C13	C15	C19	H37	90.0°	23.0°
C13	C15	C19	H38	90.0°	145.5°
C13	C15	C21	H56	90.0°	60.7°
C13	C15	C21	H57	90.0°	179.3°
C13	C15	C21	H58	90.0°	59.2°
C21	C15	C19	C18	90.0°	143.0°
C21	C15	C19	H37	90.0°	98.4°
C21	C15	C19	H38	90.0°	24.1°
C15	C21	H56	H57	90.0°	120.0°
C15	C21	H56	H58	90.0°	120.0°
C15	C21	H57	H58	90.0°	120.1°
C15	C19	C18	O2	90.0°	156.3°
C15	C19	C18	H37	90.0°	118.7°
C15	C19	C18	H38	90.0°	118.8°
C15	C19	H37	H38	90.0°	122.6°
C15	C19	C18	H39	90.0°	80.6°
C19	C15	C21	H56	90.0°	177.9°
C19	C15	C21	H57	90.0°	57.9°
C19	C15	C21	H58	90.0°	62.2°
O2	C18	C19	H39	90.0°	123.2°
O2	C18	C19	H37	90.0°	85.1°
O2	C18	C19	H38	90.0°	37.5°
O2	C18	C17	H41	90.0°	85.1°
O2	C18	C17	H42	90.0°	37.6°
C18	C19	H37	H38	90.0°	122.7°
C19	C18	O2	H40	90.0°	61.5°
C19	C18	C17	H41	90.0°	156.6°
C19	C18	C17	H42	90.0°	80.7°
H1	C2	C3	H2	90.0°	180.0°
H2	C3	C4	H3	90.0°	180.0°
H3	C4	C5	H4	90.0°	180.0°
H5	C39	H6	H7	90.0°	119.9°
H8	C34	C33	H9	90.0°	176.4°
H8	C34	C33	H10	90.0°	63.5°
H8	C34	C35	H17	90.0°	63.5°
H8	C34	C35	H18	90.0°	176.4°
H11	C41	H12	H13	90.0°	120.0°
H14	C40	H15	H16	90.0°	120.0°
H19	C37	H20	H21	90.0°	120.1°
H24	C28	H25	H26	90.0°	120.0°
H27	C26	C25	H28	90.0°	180.0°
H28	C25	C24	H29	90.0°	179.9°
H30	C	H31	H32	90.0°	120.0°
H33	C7	H34	H35	90.0°	120.1°
H37	C19	C18	H39	90.0°	38.1°
H38	C19	C18	H39	90.0°	160.7°
H39	C18	O2	H40	90.0°	61.8°
H39	C18	C17	H41	90.0°	38.1°
H39	C18	C17	H42	90.0°	160.8°
H43	C23	H44	H45	90.0°	120.0°
H46	C22	H47	H48	90.0°	120.0°
H50	C12	H51	H52	90.0°	120.0°
H53	C8	C42	H54	90.0°	179.9°
H54	C42	C43	H55	90.0°	179.9°
H56	C21	H57	H58	90.0°	120.0°

Release date:	2026-01-28
Definition date:	2024-11-26
Last modified:	2026-01-23
Release status:	REL
Processing site:	PDBJ