A1H2V

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C45	C44	sing	1.53Å	0.00Å
C44	C43	sing	1.53Å	0.00Å
C1	C2	sing	1.53Å	0.00Å
C43	C42	sing	1.53Å	0.00Å
C3	C2	sing	1.53Å	0.00Å
C3	C4	sing	1.53Å	0.00Å
C42	C41	sing	1.53Å	0.00Å
C6	C7	sing	1.53Å	0.00Å
C6	C5	sing	1.53Å	0.00Å
C7	C8	sing	1.53Å	0.00Å
C4	C5	sing	1.53Å	0.00Å
C41	C40	sing	1.53Å	0.00Å
C39	C40	sing	1.53Å	0.00Å
C39	C38	sing	1.53Å	0.00Å
C8	C9	sing	1.53Å	0.00Å
C9	C10	sing	1.53Å	0.00Å
C37	C36	sing	1.53Å	0.00Å
C37	C38	sing	1.53Å	0.00Å
C10	C11	sing	1.53Å	0.00Å
C36	C35	sing	1.53Å	0.00Å
C11	C12	sing	1.53Å	0.00Å
C35	C34	sing	1.53Å	0.00Å
C34	C33	sing	1.53Å	0.00Å
C12	C13	sing	1.53Å	0.00Å
O15	C14	doub	1.21Å	0.00Å
C33	C31	sing	1.51Å	0.00Å
C13	C14	sing	1.51Å	0.00Å
O32	C31	doub	1.21Å	0.00Å
C14	O16	sing	1.34Å	0.00Å
O28	C27	sing	1.43Å	0.00Å
C31	O30	sing	1.34Å	0.00Å
O16	C17	sing	1.45Å	0.00Å
C27	C26	sing	1.53Å	0.00Å
O30	C18	sing	1.45Å	0.00Å
C17	C18	sing	1.53Å	0.00Å
C18	C19	sing	1.53Å	0.00Å
C26	C25	sing	1.53Å	0.00Å
C26	O29	sing	1.43Å	0.00Å
C19	O20	sing	1.43Å	0.00Å
O20	P21	sing	1.61Å	0.00Å
C25	O24	sing	1.43Å	0.00Å
O24	P21	sing	1.61Å	0.00Å
P21	O22	doub	1.48Å	0.00Å
P21	O23	sing	1.61Å	0.00Å
C7	H1	sing	1.09Å	0.00Å
C7	H2	sing	1.09Å	0.00Å
C8	H3	sing	1.09Å	0.00Å
C8	H4	sing	1.09Å	0.00Å
C9	H5	sing	1.09Å	0.00Å
C9	H6	sing	1.09Å	0.00Å
C1	H7	sing	1.09Å	0.00Å
C1	H8	sing	1.09Å	0.00Å
C5	H10	sing	1.09Å	0.00Å
C5	H11	sing	1.09Å	0.00Å
C6	H12	sing	1.09Å	0.00Å
C6	H13	sing	1.09Å	0.00Å
C4	H14	sing	1.09Å	0.00Å
C4	H15	sing	1.09Å	0.00Å
C3	H16	sing	1.09Å	0.00Å
C3	H17	sing	1.09Å	0.00Å
C2	H18	sing	1.09Å	0.00Å
C2	H19	sing	1.09Å	0.00Å
C10	H20	sing	1.09Å	0.00Å
C10	H21	sing	1.09Å	0.00Å
C11	H22	sing	1.09Å	0.00Å
C11	H23	sing	1.09Å	0.00Å
C12	H24	sing	1.09Å	0.00Å
C12	H25	sing	1.09Å	0.00Å
C13	H26	sing	1.09Å	0.00Å
C13	H27	sing	1.09Å	0.00Å
C17	H28	sing	1.09Å	0.00Å
C17	H29	sing	1.09Å	0.00Å
C18	H30	sing	1.09Å	0.00Å
C19	H31	sing	1.09Å	0.00Å
C19	H32	sing	1.09Å	0.00Å
C25	H33	sing	1.09Å	0.00Å
C25	H34	sing	1.09Å	0.00Å
C26	H35	sing	1.09Å	0.00Å
C27	H36	sing	1.09Å	0.00Å
C27	H37	sing	1.09Å	0.00Å
C33	H38	sing	1.09Å	0.00Å
C33	H39	sing	1.09Å	0.00Å
C34	H40	sing	1.09Å	0.00Å
C34	H41	sing	1.09Å	0.00Å
C35	H42	sing	1.09Å	0.00Å
C35	H43	sing	1.09Å	0.00Å
C36	H44	sing	1.09Å	0.00Å
C36	H45	sing	1.09Å	0.00Å
C37	H46	sing	1.09Å	0.00Å
C37	H47	sing	1.09Å	0.00Å
C38	H48	sing	1.09Å	0.00Å
C38	H49	sing	1.09Å	0.00Å
C39	H50	sing	1.09Å	0.00Å
C39	H51	sing	1.09Å	0.00Å
C40	H52	sing	1.09Å	0.00Å
C40	H53	sing	1.09Å	0.00Å
C41	H54	sing	1.09Å	0.00Å
C41	H55	sing	1.09Å	0.00Å
C42	H56	sing	1.09Å	0.00Å
C42	H57	sing	1.09Å	0.00Å
C43	H58	sing	1.09Å	0.00Å
C43	H59	sing	1.09Å	0.00Å
C44	H60	sing	1.09Å	0.00Å
C44	H61	sing	1.09Å	0.00Å
C45	H62	sing	1.09Å	0.00Å
C45	H63	sing	1.09Å	0.00Å
O23	H65	sing	0.97Å	0.00Å
O28	H66	sing	0.97Å	0.00Å
O29	H67	sing	0.97Å	0.00Å
C45	C15	sing	1.53Å	0.00Å
C15	C16	sing	1.53Å	0.00Å
C15	H64	sing	1.09Å	0.00Å
C15	H68	sing	1.09Å	0.00Å
C16	H69	sing	1.09Å	0.00Å
C16	H70	sing	1.09Å	0.00Å
C16	H71	sing	1.09Å	0.00Å
C1	C20	sing	1.53Å	0.00Å
C20	C21	sing	1.53Å	0.00Å
C21	C22	sing	1.53Å	0.00Å
C22	C23	sing	1.53Å	0.00Å
C20	H9	sing	1.09Å	0.00Å
C20	H72	sing	1.09Å	0.00Å
C21	H73	sing	1.09Å	0.00Å
C21	H74	sing	1.09Å	0.00Å
C22	H75	sing	1.09Å	0.00Å
C22	H76	sing	1.09Å	0.00Å
C23	H77	sing	1.09Å	0.00Å
C23	H78	sing	1.09Å	0.00Å
C23	H79	sing	1.09Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C45	C44	C43	90.0°	109.5°
C45	C44	H60	90.0°	109.4°
C45	C44	H61	90.0°	109.4°
C44	C45	H62	90.0°	109.5°
C44	C45	H63	90.0°	109.4°
C44	C45	C15	90.0°	109.5°
C44	C43	C42	90.0°	109.5°
C44	C43	H58	90.0°	109.4°
C44	C43	H59	90.0°	109.4°
C43	C44	H60	90.0°	109.5°
C43	C44	H61	90.0°	109.5°
C1	C2	C3	90.0°	109.5°
C2	C1	H7	90.0°	109.5°
C2	C1	H8	90.0°	109.5°
C1	C2	H18	90.0°	109.5°
C1	C2	H19	90.0°	109.5°
C2	C1	C20	90.0°	109.5°
C43	C42	C41	90.0°	109.5°
C43	C42	H56	90.0°	109.4°
C43	C42	H57	90.0°	109.5°
C42	C43	H58	90.0°	109.5°
C42	C43	H59	90.0°	109.5°
C2	C3	C4	90.0°	109.5°
C2	C3	H16	90.0°	109.4°
C2	C3	H17	90.0°	109.4°
C3	C2	H18	90.0°	109.5°
C3	C2	H19	90.0°	109.5°
C3	C4	C5	90.0°	109.4°
C3	C4	H14	90.0°	109.5°
C3	C4	H15	90.0°	109.4°
C4	C3	H16	90.0°	109.5°
C4	C3	H17	90.0°	109.5°
C42	C41	C40	90.0°	109.5°
C42	C41	H54	90.0°	109.5°
C42	C41	H55	90.0°	109.4°
C41	C42	H56	90.0°	109.5°
C41	C42	H57	90.0°	109.4°
C7	C6	C5	90.0°	109.4°
C6	C7	C8	90.0°	109.5°
C6	C7	H1	90.0°	109.5°
C6	C7	H2	90.0°	109.4°
C7	C6	H12	90.0°	109.4°
C7	C6	H13	90.0°	109.4°
C6	C5	C4	90.0°	109.4°
C6	C5	H10	90.0°	109.5°
C6	C5	H11	90.0°	109.4°
C5	C6	H12	90.0°	109.5°
C5	C6	H13	90.0°	109.5°
C7	C8	C9	90.0°	109.5°
C8	C7	H1	90.0°	109.5°
C8	C7	H2	90.0°	109.5°
C7	C8	H3	90.0°	109.5°
C7	C8	H4	90.0°	109.5°
C4	C5	H10	90.0°	109.5°
C4	C5	H11	90.0°	109.5°
C5	C4	H14	90.0°	109.5°
C5	C4	H15	90.0°	109.5°
C41	C40	C39	90.0°	109.5°
C41	C40	H52	90.0°	109.5°
C41	C40	H53	90.0°	109.5°
C40	C41	H54	90.0°	109.5°
C40	C41	H55	90.0°	109.5°
C40	C39	C38	90.0°	109.5°
C40	C39	H50	90.0°	109.4°
C40	C39	H51	90.0°	109.4°
C39	C40	H52	90.0°	109.4°
C39	C40	H53	90.0°	109.5°
C39	C38	C37	90.0°	109.5°
C39	C38	H48	90.0°	109.5°
C39	C38	H49	90.0°	109.5°
C38	C39	H50	90.0°	109.5°
C38	C39	H51	90.0°	109.5°
C8	C9	C10	90.0°	109.5°
C9	C8	H3	90.0°	109.4°
C9	C8	H4	90.0°	109.5°
C8	C9	H5	90.0°	109.4°
C8	C9	H6	90.0°	109.5°
C9	C10	C11	90.0°	109.5°
C10	C9	H5	90.0°	109.5°
C10	C9	H6	90.0°	109.5°
C9	C10	H20	90.0°	109.5°
C9	C10	H21	90.0°	109.5°
C36	C37	C38	90.0°	109.5°
C37	C36	C35	90.0°	109.5°
C37	C36	H44	90.0°	109.5°
C37	C36	H45	90.0°	109.5°
C36	C37	H46	90.0°	109.5°
C36	C37	H47	90.0°	109.4°
C38	C37	H46	90.0°	109.5°
C38	C37	H47	90.0°	109.4°
C37	C38	H48	90.0°	109.5°
C37	C38	H49	90.0°	109.5°
C10	C11	C12	90.0°	109.5°
C11	C10	H20	90.0°	109.5°
C11	C10	H21	90.0°	109.5°
C10	C11	H22	90.0°	109.5°
C10	C11	H23	90.0°	109.5°
C36	C35	C34	90.0°	109.5°
C36	C35	H42	90.0°	109.5°
C36	C35	H43	90.0°	109.5°
C35	C36	H44	90.0°	109.4°
C35	C36	H45	90.0°	109.5°
C11	C12	C13	90.0°	109.5°
C12	C11	H22	90.0°	109.4°
C12	C11	H23	90.0°	109.5°
C11	C12	H24	90.0°	109.4°
C11	C12	H25	90.0°	109.5°
C35	C34	C33	90.0°	109.5°
C35	C34	H40	90.0°	109.5°
C35	C34	H41	90.0°	109.4°
C34	C35	H42	90.0°	109.5°
C34	C35	H43	90.0°	109.4°
C34	C33	C31	90.0°	109.5°
C34	C33	H38	90.0°	109.5°
C34	C33	H39	90.0°	109.4°
C33	C34	H40	90.0°	109.5°
C33	C34	H41	90.0°	109.5°
C12	C13	C14	90.0°	109.5°
C13	C12	H24	90.0°	109.5°
C13	C12	H25	90.0°	109.5°
C12	C13	H26	90.0°	109.5°
C12	C13	H27	90.0°	109.5°
O15	C14	C13	90.0°	120.0°
O15	C14	O16	90.0°	119.9°
C33	C31	O32	90.0°	120.0°
C33	C31	O30	90.0°	120.0°
C31	C33	H38	90.0°	109.5°
C31	C33	H39	90.0°	109.5°
C13	C14	O16	90.0°	120.1°
C14	C13	H26	90.0°	109.5°
C14	C13	H27	90.0°	109.4°
O32	C31	O30	90.0°	119.9°
C14	O16	C17	90.0°	117.0°
O28	C27	C26	90.0°	109.4°
O28	C27	H36	90.0°	109.5°
O28	C27	H37	90.0°	109.4°
C27	O28	H66	90.0°	114.0°
C31	O30	C18	90.0°	117.0°
O16	C17	C18	90.0°	109.5°
O16	C17	H28	90.0°	109.5°
O16	C17	H29	90.0°	109.4°
C27	C26	C25	90.0°	109.4°
C27	C26	O29	90.0°	109.5°
C27	C26	H35	90.0°	109.4°
C26	C27	H36	90.0°	109.5°
C26	C27	H37	90.0°	109.5°
O30	C18	C17	90.0°	109.4°
O30	C18	C19	90.0°	109.4°
O30	C18	H30	90.0°	109.5°
C17	C18	C19	90.0°	109.5°
C18	C17	H28	90.0°	109.5°
C18	C17	H29	90.0°	109.4°
C17	C18	H30	90.0°	109.5°
C18	C19	O20	90.0°	109.5°
C19	C18	H30	90.0°	109.5°
C18	C19	H31	90.0°	109.5°
C18	C19	H32	90.0°	109.5°
C25	C26	O29	90.0°	109.5°
C26	C25	O24	90.0°	109.4°
C26	C25	H33	90.0°	109.5°
C26	C25	H34	90.0°	109.5°
C25	C26	H35	90.0°	109.5°
O29	C26	H35	90.0°	109.5°
C26	O29	H67	90.0°	114.0°
C19	O20	P21	90.0°	123.0°
O20	C19	H31	90.0°	109.5°
O20	C19	H32	90.0°	109.4°
O20	P21	O24	90.0°	109.5°
O20	P21	O22	90.0°	109.5°
O20	P21	O23	90.0°	109.5°
C25	O24	P21	90.0°	123.0°
O24	C25	H33	90.0°	109.5°
O24	C25	H34	90.0°	109.5°
O24	P21	O22	90.0°	109.5°
O24	P21	O23	90.0°	109.4°
O22	P21	O23	90.0°	109.5°
P21	O23	H65	90.0°	114.0°
H1	C7	H2	90.0°	109.5°
H3	C8	H4	90.0°	109.5°
H5	C9	H6	90.0°	109.5°
H7	C1	H8	90.0°	109.5°
H7	C1	C20	90.0°	109.5°
H8	C1	C20	90.0°	109.4°
H10	C5	H11	90.0°	109.5°
H12	C6	H13	90.0°	109.5°
H14	C4	H15	90.0°	109.5°
H16	C3	H17	90.0°	109.5°
H18	C2	H19	90.0°	109.4°
H20	C10	H21	90.0°	109.4°
H22	C11	H23	90.0°	109.5°
H24	C12	H25	90.0°	109.5°
H26	C13	H27	90.0°	109.4°
H28	C17	H29	90.0°	109.5°
H31	C19	H32	90.0°	109.5°
H33	C25	H34	90.0°	109.5°
H36	C27	H37	90.0°	109.5°
H38	C33	H39	90.0°	109.5°
H40	C34	H41	90.0°	109.4°
H42	C35	H43	90.0°	109.4°
H44	C36	H45	90.0°	109.5°
H46	C37	H47	90.0°	109.5°
H48	C38	H49	90.0°	109.4°
H50	C39	H51	90.0°	109.5°
H52	C40	H53	90.0°	109.4°
H54	C41	H55	90.0°	109.5°
H56	C42	H57	90.0°	109.5°
H58	C43	H59	90.0°	109.5°
H60	C44	H61	90.0°	109.5°
H62	C45	H63	90.0°	109.4°
H62	C45	C15	90.0°	109.5°
H63	C45	C15	90.0°	109.5°
C45	C15	C16	90.0°	109.5°
C45	C15	H64	90.0°	109.4°
C45	C15	H68	90.0°	109.4°
C16	C15	H64	90.0°	109.5°
C16	C15	H68	90.0°	109.5°
C15	C16	H69	90.0°	109.4°
C15	C16	H70	90.0°	109.5°
C15	C16	H71	90.0°	109.4°
H64	C15	H68	90.0°	109.5°
H69	C16	H70	90.0°	109.5°
H69	C16	H71	90.0°	109.5°
H70	C16	H71	90.0°	109.5°
C1	C20	C21	90.0°	109.5°
C1	C20	H9	90.0°	109.5°
C1	C20	H72	90.0°	109.4°
C20	C21	C22	90.0°	109.5°
C21	C20	H9	90.0°	109.5°
C21	C20	H72	90.0°	109.5°
C20	C21	H73	90.0°	109.5°
C20	C21	H74	90.0°	109.4°
C21	C22	C23	90.0°	109.5°
C22	C21	H73	90.0°	109.5°
C22	C21	H74	90.0°	109.5°
C21	C22	H75	90.0°	109.4°
C21	C22	H76	90.0°	109.5°
C23	C22	H75	90.0°	109.5°
C23	C22	H76	90.0°	109.5°
C22	C23	H77	90.0°	109.5°
C22	C23	H78	90.0°	109.4°
C22	C23	H79	90.0°	109.5°
H9	C20	H72	90.0°	109.5°
H73	C21	H74	90.0°	109.5°
H75	C22	H76	90.0°	109.4°
H77	C23	H78	90.0°	109.5°
H77	C23	H79	90.0°	109.5°
H78	C23	H79	90.0°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C45	C44	C43	H60	90.0°	120.0°
C45	C44	C43	H61	90.0°	120.0°
C45	C44	C43	C42	90.0°	180.0°
C45	C44	C43	H58	90.0°	60.0°
C45	C44	C43	H59	90.0°	60.0°
C45	C44	H60	H61	90.0°	119.9°
C44	C45	H62	H63	90.0°	119.9°
C44	C45	H62	C15	90.0°	120.0°
C44	C45	H63	C15	90.0°	120.0°
C44	C45	C15	C16	90.0°	180.0°
C44	C45	C15	H64	90.0°	60.0°
C44	C45	C15	H68	90.0°	60.0°
C44	C43	C42	H58	90.0°	120.0°
C44	C43	C42	H59	90.0°	120.0°
C44	C43	C42	C41	90.0°	180.0°
C44	C43	C42	H56	90.0°	60.0°
C44	C43	C42	H57	90.0°	60.0°
C44	C43	H58	H59	90.0°	120.0°
C43	C44	H60	H61	90.0°	120.1°
C43	C44	C45	H62	90.0°	60.0°
C43	C44	C45	H63	90.0°	60.0°
C43	C44	C45	C15	90.0°	180.0°
C1	C2	C3	H18	90.0°	120.0°
C1	C2	C3	H19	90.0°	120.0°
C1	C2	C3	C4	90.0°	180.0°
C2	C1	H7	H8	90.0°	120.0°
C2	C1	H7	C20	90.0°	120.0°
C2	C1	H8	C20	90.0°	120.0°
C1	C2	C3	H16	90.0°	60.0°
C1	C2	C3	H17	90.0°	60.0°
C1	C2	H18	H19	90.0°	120.0°
C2	C1	C20	C21	90.0°	180.0°
C2	C1	C20	H9	90.0°	60.0°
C2	C1	C20	H72	90.0°	60.0°
C43	C42	C41	H56	90.0°	120.0°
C43	C42	C41	H57	90.0°	120.0°
C43	C42	C41	C40	90.0°	180.0°
C43	C42	C41	H54	90.0°	60.0°
C43	C42	C41	H55	90.0°	60.0°
C43	C42	H56	H57	90.0°	120.0°
C42	C43	H58	H59	90.0°	120.0°
C42	C43	C44	H60	90.0°	60.0°
C42	C43	C44	H61	90.0°	60.0°
C2	C3	C4	H16	90.0°	120.0°
C2	C3	C4	H17	90.0°	120.0°
C2	C3	C4	C5	90.0°	180.0°
C3	C2	C1	H7	90.0°	60.0°
C3	C2	C1	H8	90.0°	60.0°
C2	C3	C4	H14	90.0°	60.0°
C2	C3	C4	H15	90.0°	60.0°
C2	C3	H16	H17	90.0°	119.9°
C3	C2	H18	H19	90.0°	120.0°
C3	C2	C1	C20	90.0°	180.0°
C3	C4	C5	C6	90.0°	180.0°
C3	C4	C5	H14	90.0°	120.0°
C3	C4	C5	H15	90.0°	120.0°
C3	C4	C5	H10	90.0°	60.0°
C3	C4	C5	H11	90.0°	60.0°
C3	C4	H14	H15	90.0°	120.0°
C4	C3	H16	H17	90.0°	120.0°
C4	C3	C2	H18	90.0°	60.0°
C4	C3	C2	H19	90.0°	60.0°
C42	C41	C40	H54	90.0°	120.0°
C42	C41	C40	H55	90.0°	120.0°
C42	C41	C40	C39	90.0°	180.0°
C42	C41	C40	H52	90.0°	60.0°
C42	C41	C40	H53	90.0°	60.0°
C42	C41	H54	H55	90.0°	120.0°
C41	C42	H56	H57	90.0°	120.0°
C41	C42	C43	H58	90.0°	60.0°
C41	C42	C43	H59	90.0°	60.0°
C7	C6	C5	H12	90.0°	120.0°
C7	C6	C5	H13	90.0°	120.0°
C6	C7	C8	H1	90.0°	120.0°
C6	C7	C8	H2	90.0°	120.0°
C7	C6	C5	C4	90.0°	180.0°
C6	C7	C8	C9	90.0°	180.0°
C6	C7	H1	H2	90.0°	120.0°
C6	C7	C8	H3	90.0°	60.0°
C6	C7	C8	H4	90.0°	60.0°
C7	C6	C5	H10	90.0°	60.0°
C7	C6	C5	H11	90.0°	60.0°
C7	C6	H12	H13	90.0°	120.0°
C5	C6	C7	C8	90.0°	180.0°
C6	C5	C4	H10	90.0°	120.0°
C6	C5	C4	H11	90.0°	119.9°
C5	C6	C7	H1	90.0°	60.0°
C5	C6	C7	H2	90.0°	60.0°
C6	C5	H10	H11	90.0°	120.0°
C5	C6	H12	H13	90.0°	120.1°
C6	C5	C4	H14	90.0°	60.0°
C6	C5	C4	H15	90.0°	60.1°
C7	C8	C9	H3	90.0°	120.0°
C7	C8	C9	H4	90.0°	120.0°
C7	C8	C9	C10	90.0°	180.0°
C8	C7	H1	H2	90.0°	120.0°
C7	C8	H3	H4	90.0°	120.0°
C7	C8	C9	H5	90.0°	60.0°
C7	C8	C9	H6	90.0°	60.0°
C8	C7	C6	H12	90.0°	60.0°
C8	C7	C6	H13	90.0°	60.0°
C4	C5	H10	H11	90.0°	120.0°
C4	C5	C6	H12	90.0°	60.0°
C4	C5	C6	H13	90.0°	60.1°
C5	C4	H14	H15	90.0°	120.0°
C5	C4	C3	H16	90.0°	60.0°
C5	C4	C3	H17	90.0°	60.0°
C41	C40	C39	H52	90.0°	120.0°
C41	C40	C39	H53	90.0°	120.1°
C41	C40	C39	C38	90.0°	NaN°
C41	C40	C39	H50	90.0°	60.0°
C41	C40	C39	H51	90.0°	60.0°
C41	C40	H52	H53	90.0°	120.1°
C40	C41	H54	H55	90.0°	120.0°
C40	C41	C42	H56	90.0°	60.0°
C40	C41	C42	H57	90.0°	60.0°
C40	C39	C38	H50	90.0°	120.0°
C40	C39	C38	H51	90.0°	120.0°
C40	C39	C38	C37	90.0°	180.0°
C40	C39	C38	H48	90.0°	60.0°
C40	C39	C38	H49	90.0°	59.9°
C40	C39	H50	H51	90.0°	119.9°
C39	C40	H52	H53	90.0°	119.9°
C39	C40	C41	H54	90.0°	60.0°
C39	C40	C41	H55	90.0°	60.0°
C39	C38	C37	C36	90.0°	180.0°
C39	C38	C37	H48	90.0°	120.0°
C39	C38	C37	H49	90.0°	120.0°
C39	C38	C37	H46	90.0°	60.0°
C39	C38	C37	H47	90.0°	60.0°
C39	C38	H48	H49	90.0°	119.9°
C38	C39	H50	H51	90.0°	120.0°
C38	C39	C40	H52	90.0°	60.0°
C38	C39	C40	H53	90.0°	59.9°
C8	C9	C10	H5	90.0°	120.0°
C8	C9	C10	H6	90.0°	120.0°
C8	C9	C10	C11	90.0°	180.0°
C9	C8	C7	H1	90.0°	60.0°
C9	C8	C7	H2	90.0°	60.0°
C9	C8	H3	H4	90.0°	120.0°
C8	C9	H5	H6	90.0°	120.0°
C8	C9	C10	H20	90.0°	60.0°
C8	C9	C10	H21	90.0°	59.9°
C9	C10	C11	H20	90.0°	120.0°
C9	C10	C11	H21	90.0°	120.1°
C9	C10	C11	C12	90.0°	180.0°
C10	C9	C8	H3	90.0°	60.0°
C10	C9	C8	H4	90.0°	60.0°
C10	C9	H5	H6	90.0°	120.0°
C9	C10	H20	H21	90.0°	120.0°
C9	C10	C11	H22	90.0°	60.0°
C9	C10	C11	H23	90.0°	60.0°
C36	C37	C38	H46	90.0°	120.0°
C36	C37	C38	H47	90.0°	119.9°
C37	C36	C35	H44	90.0°	120.0°
C37	C36	C35	H45	90.0°	120.0°
C37	C36	C35	C34	90.0°	180.0°
C37	C36	C35	H42	90.0°	60.0°
C37	C36	C35	H43	90.0°	60.0°
C37	C36	H44	H45	90.0°	120.0°
C36	C37	H46	H47	90.0°	120.0°
C36	C37	C38	H48	90.0°	60.0°
C36	C37	C38	H49	90.0°	60.0°
C38	C37	C36	C35	90.0°	180.0°
C38	C37	C36	H44	90.0°	60.0°
C38	C37	C36	H45	90.0°	60.0°
C38	C37	H46	H47	90.0°	120.0°
C37	C38	H48	H49	90.0°	120.0°
C37	C38	C39	H50	90.0°	60.0°
C37	C38	C39	H51	90.0°	60.0°
C10	C11	C12	H22	90.0°	120.0°
C10	C11	C12	H23	90.0°	120.1°
C10	C11	C12	C13	90.0°	180.0°
C11	C10	C9	H5	90.0°	60.0°
C11	C10	C9	H6	90.0°	60.0°
C11	C10	H20	H21	90.0°	120.0°
C10	C11	H22	H23	90.0°	120.0°
C10	C11	C12	H24	90.0°	60.0°
C10	C11	C12	H25	90.0°	59.9°
C36	C35	C34	H42	90.0°	120.1°
C36	C35	C34	H43	90.0°	120.0°
C36	C35	C34	C33	90.0°	180.0°
C36	C35	C34	H40	90.0°	60.0°
C36	C35	C34	H41	90.0°	60.0°
C36	C35	H42	H43	90.0°	120.0°
C35	C36	H44	H45	90.0°	120.0°
C35	C36	C37	H46	90.0°	60.0°
C35	C36	C37	H47	90.0°	60.1°
C11	C12	C13	H24	90.0°	120.0°
C11	C12	C13	H25	90.0°	120.0°
C11	C12	C13	C14	90.0°	180.0°
C12	C11	C10	H20	90.0°	60.0°
C12	C11	C10	H21	90.0°	59.9°
C12	C11	H22	H23	90.0°	120.0°
C11	C12	H24	H25	90.0°	120.0°
C11	C12	C13	H26	90.0°	60.0°
C11	C12	C13	H27	90.0°	60.0°
C35	C34	C33	H40	90.0°	120.0°
C35	C34	C33	H41	90.0°	120.0°
C35	C34	C33	C31	90.0°	180.0°
C35	C34	C33	H38	90.0°	60.0°
C35	C34	C33	H39	90.0°	60.0°
C35	C34	H40	H41	90.0°	119.9°
C34	C35	H42	H43	90.0°	119.9°
C34	C35	C36	H44	90.0°	60.0°
C34	C35	C36	H45	90.0°	60.0°
C34	C33	C31	H38	90.0°	120.0°
C34	C33	C31	H39	90.0°	120.0°
C34	C33	C31	O32	90.0°	0.0°
C34	C33	C31	O30	90.0°	180.0°
C34	C33	H38	H39	90.0°	120.0°
C33	C34	H40	H41	90.0°	120.0°
C33	C34	C35	H42	90.0°	59.9°
C33	C34	C35	H43	90.0°	60.0°
C12	C13	C14	O15	90.0°	0.0°
C12	C13	C14	H26	90.0°	120.0°
C12	C13	C14	H27	90.0°	120.0°
C12	C13	C14	O16	90.0°	180.0°
C13	C12	C11	H22	90.0°	60.0°
C13	C12	C11	H23	90.0°	59.9°
C13	C12	H24	H25	90.0°	120.0°
C12	C13	H26	H27	90.0°	120.0°
O15	C14	C13	O16	90.0°	179.9°
O15	C14	O16	C17	90.0°	0.0°
O15	C14	C13	H26	90.0°	120.0°
O15	C14	C13	H27	90.0°	120.1°
C33	C31	O32	O30	90.0°	180.0°
C33	C31	O30	C18	90.0°	180.0°
C31	C33	H38	H39	90.0°	120.0°
C31	C33	C34	H40	90.0°	60.0°
C31	C33	C34	H41	90.0°	60.0°
C13	C14	O16	C17	90.0°	180.0°
C14	C13	C12	H24	90.0°	60.0°
C14	C13	C12	H25	90.0°	60.0°
C14	C13	H26	H27	90.0°	119.9°
O32	C31	O30	C18	90.0°	0.0°
O32	C31	C33	H38	90.0°	120.0°
O32	C31	C33	H39	90.0°	120.0°
C14	O16	C17	C18	90.0°	180.0°
O16	C14	C13	H26	90.0°	59.9°
O16	C14	C13	H27	90.0°	60.0°
C14	O16	C17	H28	90.0°	60.0°
C14	O16	C17	H29	90.0°	60.1°
O28	C27	C26	H36	90.0°	120.0°
O28	C27	C26	H37	90.0°	119.9°
O28	C27	C26	C25	90.0°	175.0°
O28	C27	C26	O29	90.0°	64.9°
O28	C27	C26	H35	90.0°	55.0°
O28	C27	H36	H37	90.0°	120.0°
C31	O30	C18	C17	90.0°	150.0°
C31	O30	C18	C19	90.0°	90.0°
C31	O30	C18	H30	90.0°	30.0°
O30	C31	C33	H38	90.0°	60.0°
O30	C31	C33	H39	90.0°	60.0°
O16	C17	C18	O30	90.0°	65.0°
O16	C17	C18	H28	90.0°	120.0°
O16	C17	C18	H29	90.0°	119.9°
O16	C17	C18	C19	90.0°	54.9°
O16	C17	H28	H29	90.0°	120.0°
O16	C17	C18	H30	90.0°	175.0°
C27	C26	C25	O29	90.0°	120.0°
C27	C26	C25	H35	90.0°	120.0°
C27	C26	O29	H35	90.0°	120.0°
C27	C26	C25	O24	90.0°	175.0°
C27	C26	C25	H33	90.0°	65.0°
C27	C26	C25	H34	90.0°	55.0°
C26	C27	H36	H37	90.0°	120.0°
C26	C27	O28	H66	90.0°	180.0°
C27	C26	O29	H67	90.0°	60.1°
O30	C18	C17	C19	90.0°	120.0°
O30	C18	C17	H30	90.0°	120.0°
O30	C18	C19	H30	90.0°	120.0°
O30	C18	C19	O20	90.0°	65.0°
O30	C18	C17	H28	90.0°	55.0°
O30	C18	C17	H29	90.0°	175.0°
O30	C18	C19	H31	90.0°	175.0°
O30	C18	C19	H32	90.0°	55.0°
C17	C18	C19	H30	90.0°	120.1°
C17	C18	C19	O20	90.0°	55.0°
C18	C17	H28	H29	90.0°	120.0°
C17	C18	C19	H31	90.0°	65.0°
C17	C18	C19	H32	90.0°	175.0°
C18	C19	O20	H31	90.0°	120.0°
C18	C19	O20	H32	90.0°	120.0°
C18	C19	O20	P21	90.0°	179.9°
C19	C18	C17	H28	90.0°	175.0°
C19	C18	C17	H29	90.0°	65.0°
C18	C19	H31	H32	90.0°	120.0°
C25	C26	O29	H35	90.0°	120.1°
C26	C25	O24	H33	90.0°	120.0°
C26	C25	O24	H34	90.0°	120.0°
C26	C25	O24	P21	90.0°	180.0°
C26	C25	H33	H34	90.0°	120.0°
C25	C26	C27	H36	90.0°	55.0°
C25	C26	C27	H37	90.0°	65.1°
C25	C26	O29	H67	90.0°	59.9°
O29	C26	C25	O24	90.0°	65.0°
O29	C26	C25	H33	90.0°	55.0°
O29	C26	C25	H34	90.0°	175.0°
O29	C26	C27	H36	90.0°	175.0°
O29	C26	C27	H37	90.0°	55.0°
C19	O20	P21	O24	90.0°	175.0°
C19	O20	P21	O22	90.0°	55.0°
C19	O20	P21	O23	90.0°	65.1°
O20	C19	C18	H30	90.0°	175.1°
O20	C19	H31	H32	90.0°	119.9°
O20	P21	O24	C25	90.0°	175.0°
O20	P21	O24	O22	90.0°	120.1°
O20	P21	O24	O23	90.0°	120.0°
O20	P21	O22	O23	90.0°	120.0°
P21	O20	C19	H31	90.0°	59.9°
P21	O20	C19	H32	90.0°	60.0°
O20	P21	O23	H65	90.0°	60.0°
C25	O24	P21	O22	90.0°	55.0°
C25	O24	P21	O23	90.0°	65.0°
O24	C25	H33	H34	90.0°	120.0°
O24	C25	C26	H35	90.0°	55.0°
O24	P21	O22	O23	90.0°	120.0°
P21	O24	C25	H33	90.0°	60.1°
P21	O24	C25	H34	90.0°	60.0°
O24	P21	O23	H65	90.0°	60.0°
O22	P21	O23	H65	90.0°	180.0°
H1	C7	C8	H3	90.0°	60.0°
H1	C7	C8	H4	90.0°	180.0°
H1	C7	C6	H12	90.0°	180.0°
H1	C7	C6	H13	90.0°	60.0°
H2	C7	C8	H3	90.0°	180.0°
H2	C7	C8	H4	90.0°	60.0°
H2	C7	C6	H12	90.0°	60.0°
H2	C7	C6	H13	90.0°	180.0°
H3	C8	C9	H5	90.0°	180.0°
H3	C8	C9	H6	90.0°	60.0°
H4	C8	C9	H5	90.0°	60.0°
H4	C8	C9	H6	90.0°	180.0°
H5	C9	C10	H20	90.0°	179.9°
H5	C9	C10	H21	90.0°	60.0°
H6	C9	C10	H20	90.0°	60.0°
H6	C9	C10	H21	90.0°	179.9°
H7	C1	H8	C20	90.0°	120.0°
H7	C1	C2	H18	90.0°	60.0°
H7	C1	C2	H19	90.0°	180.0°
H7	C1	C20	C21	90.0°	60.0°
H7	C1	C20	H9	90.0°	180.0°
H7	C1	C20	H72	90.0°	60.0°
H8	C1	C2	H18	90.0°	179.9°
H8	C1	C2	H19	90.0°	60.0°
H8	C1	C20	C21	90.0°	60.0°
H8	C1	C20	H9	90.0°	60.0°
H8	C1	C20	H72	90.0°	180.0°
H10	C5	C6	H12	90.0°	179.9°
H10	C5	C6	H13	90.0°	60.0°
H10	C5	C4	H14	90.0°	180.0°
H10	C5	C4	H15	90.0°	60.0°
H11	C5	C6	H12	90.0°	59.9°
H11	C5	C6	H13	90.0°	180.0°
H11	C5	C4	H14	90.0°	60.0°
H11	C5	C4	H15	90.0°	180.0°
H14	C4	C3	H16	90.0°	180.0°
H14	C4	C3	H17	90.0°	60.0°
H15	C4	C3	H16	90.0°	60.0°
H15	C4	C3	H17	90.0°	180.0°
H16	C3	C2	H18	90.0°	60.1°
H16	C3	C2	H19	90.0°	180.0°
H17	C3	C2	H18	90.0°	180.0°
H17	C3	C2	H19	90.0°	60.0°
H18	C2	C1	C20	90.0°	60.0°
H19	C2	C1	C20	90.0°	60.0°
H20	C10	C11	H22	90.0°	180.0°
H20	C10	C11	H23	90.0°	60.0°
H21	C10	C11	H22	90.0°	60.0°
H21	C10	C11	H23	90.0°	180.0°
H22	C11	C12	H24	90.0°	180.0°
H22	C11	C12	H25	90.0°	60.0°
H23	C11	C12	H24	90.0°	60.0°
H23	C11	C12	H25	90.0°	180.0°
H24	C12	C13	H26	90.0°	180.0°
H24	C12	C13	H27	90.0°	60.0°
H25	C12	C13	H26	90.0°	60.0°
H25	C12	C13	H27	90.0°	180.0°
H28	C17	C18	H30	90.0°	65.0°
H29	C17	C18	H30	90.0°	55.0°
H30	C18	C19	H31	90.0°	55.0°
H30	C18	C19	H32	90.0°	65.0°
H33	C25	C26	H35	90.0°	175.0°
H34	C25	C26	H35	90.0°	65.0°
H35	C26	C27	H36	90.0°	65.0°
H35	C26	C27	H37	90.0°	174.9°
H35	C26	O29	H67	90.0°	180.0°
H36	C27	O28	H66	90.0°	59.9°
H37	C27	O28	H66	90.0°	60.1°
H38	C33	C34	H40	90.0°	180.0°
H38	C33	C34	H41	90.0°	60.0°
H39	C33	C34	H40	90.0°	60.0°
H39	C33	C34	H41	90.0°	180.0°
H40	C34	C35	H42	90.0°	180.0°
H40	C34	C35	H43	90.0°	60.1°
H41	C34	C35	H42	90.0°	60.1°
H41	C34	C35	H43	90.0°	180.0°
H42	C35	C36	H44	90.0°	180.0°
H42	C35	C36	H45	90.0°	60.0°
H43	C35	C36	H44	90.0°	60.0°
H43	C35	C36	H45	90.0°	180.0°
H44	C36	C37	H46	90.0°	180.0°
H44	C36	C37	H47	90.0°	59.9°
H45	C36	C37	H46	90.0°	60.0°
H45	C36	C37	H47	90.0°	180.0°
H46	C37	C38	H48	90.0°	180.0°
H46	C37	C38	H49	90.0°	60.0°
H47	C37	C38	H48	90.0°	59.9°
H47	C37	C38	H49	90.0°	179.9°
H48	C38	C39	H50	90.0°	180.0°
H48	C38	C39	H51	90.0°	60.0°
H49	C38	C39	H50	90.0°	60.0°
H49	C38	C39	H51	90.0°	179.9°
H50	C39	C40	H52	90.0°	180.0°
H50	C39	C40	H53	90.0°	60.1°
H51	C39	C40	H52	90.0°	60.0°
H51	C39	C40	H53	90.0°	179.9°
H52	C40	C41	H54	90.0°	180.0°
H52	C40	C41	H55	90.0°	60.0°
H53	C40	C41	H54	90.0°	60.1°
H53	C40	C41	H55	90.0°	180.0°
H54	C41	C42	H56	90.0°	180.0°
H54	C41	C42	H57	90.0°	60.0°
H55	C41	C42	H56	90.0°	60.0°
H55	C41	C42	H57	90.0°	180.0°
H56	C42	C43	H58	90.0°	180.0°
H56	C42	C43	H59	90.0°	60.0°
H57	C42	C43	H58	90.0°	60.0°
H57	C42	C43	H59	90.0°	180.0°
H58	C43	C44	H60	90.0°	180.0°
H58	C43	C44	H61	90.0°	60.0°
H59	C43	C44	H60	90.0°	60.0°
H59	C43	C44	H61	90.0°	180.0°
H60	C44	C45	H62	90.0°	180.0°
H60	C44	C45	H63	90.0°	60.0°
H60	C44	C45	C15	90.0°	60.0°
H61	C44	C45	H62	90.0°	60.1°
H61	C44	C45	H63	90.0°	180.0°
H61	C44	C45	C15	90.0°	60.0°
H62	C45	H63	C15	90.0°	120.0°
H62	C45	C15	C16	90.0°	60.0°
H62	C45	C15	H64	90.0°	180.0°
H62	C45	C15	H68	90.0°	60.0°
H63	C45	C15	C16	90.0°	60.0°
H63	C45	C15	H64	90.0°	60.0°
H63	C45	C15	H68	90.0°	180.0°
C45	C15	C16	H64	90.0°	120.0°
C45	C15	C16	H68	90.0°	120.0°
C45	C15	H64	H68	90.0°	120.0°
C45	C15	C16	H69	90.0°	60.0°
C45	C15	C16	H70	90.0°	60.0°
C45	C15	C16	H71	90.0°	180.0°
C16	C15	H64	H68	90.0°	120.0°
C15	C16	H69	H70	90.0°	120.0°
C15	C16	H69	H71	90.0°	120.0°
C15	C16	H70	H71	90.0°	120.0°
H64	C15	C16	H69	90.0°	180.0°
H64	C15	C16	H70	90.0°	60.0°
H64	C15	C16	H71	90.0°	60.0°
H68	C15	C16	H69	90.0°	60.0°
H68	C15	C16	H70	90.0°	180.0°
H68	C15	C16	H71	90.0°	60.0°
H69	C16	H70	H71	90.0°	120.0°
C1	C20	C21	H9	90.0°	120.0°
C1	C20	C21	H72	90.0°	120.0°
C1	C20	C21	C22	90.0°	180.0°
C1	C20	H9	H72	90.0°	120.0°
C1	C20	C21	H73	90.0°	60.0°
C1	C20	C21	H74	90.0°	60.0°
C20	C21	C22	H73	90.0°	120.0°
C20	C21	C22	H74	90.0°	120.0°
C20	C21	C22	C23	90.0°	180.0°
C21	C20	H9	H72	90.0°	120.0°
C20	C21	H73	H74	90.0°	120.0°
C20	C21	C22	H75	90.0°	60.0°
C20	C21	C22	H76	90.0°	59.9°
C21	C22	C23	H75	90.0°	120.0°
C21	C22	C23	H76	90.0°	120.0°
C22	C21	C20	H9	90.0°	60.0°
C22	C21	C20	H72	90.0°	60.0°
C22	C21	H73	H74	90.0°	120.0°
C21	C22	H75	H76	90.0°	119.9°
C21	C22	C23	H77	90.0°	60.0°
C21	C22	C23	H78	90.0°	60.0°
C21	C22	C23	H79	90.0°	180.0°
C23	C22	C21	H73	90.0°	60.0°
C23	C22	C21	H74	90.0°	60.0°
C23	C22	H75	H76	90.0°	120.0°
C22	C23	H77	H78	90.0°	120.0°
C22	C23	H77	H79	90.0°	120.0°
C22	C23	H78	H79	90.0°	120.0°
H9	C20	C21	H73	90.0°	180.0°
H9	C20	C21	H74	90.0°	60.0°
H72	C20	C21	H73	90.0°	60.0°
H72	C20	C21	H74	90.0°	180.0°
H73	C21	C22	H75	90.0°	180.0°
H73	C21	C22	H76	90.0°	60.1°
H74	C21	C22	H75	90.0°	60.0°
H74	C21	C22	H76	90.0°	179.9°
H75	C22	C23	H77	90.0°	180.0°
H75	C22	C23	H78	90.0°	60.0°
H75	C22	C23	H79	90.0°	60.0°
H76	C22	C23	H77	90.0°	60.0°
H76	C22	C23	H78	90.0°	180.0°
H76	C22	C23	H79	90.0°	60.0°
H77	C23	H78	H79	90.0°	120.0°

Release date:	2025-02-05
Definition date:	2024-01-22
Last modified:	2025-01-31
Release status:	REL
Processing site:	PDBE