EL6

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C3I	C3H	sing	1.53Å	1.53Å
C2I	C2H	sing	1.53Å	1.53Å
C3H	C3G	sing	1.53Å	1.53Å
C2H	C2G	sing	1.53Å	1.53Å
C2E	C2D	sing	1.53Å	1.53Å
C2E	C2F	sing	1.53Å	1.53Å
C3G	C3F	sing	1.53Å	1.53Å
C3F	C3E	sing	1.53Å	1.53Å
C2G	C2F	sing	1.53Å	1.53Å
C2C	C2D	sing	1.53Å	1.53Å
C2C	C2B	sing	1.53Å	1.53Å
C1	C2	sing	1.53Å	1.53Å
C28	C29	sing	1.53Å	1.53Å
C28	C27	sing	1.53Å	1.53Å
C26	C27	sing	1.53Å	1.53Å
C26	C25	sing	1.53Å	1.52Å
C24	C23	sing	1.53Å	1.53Å
C24	C25	sing	1.53Å	1.52Å
C2A	C2B	sing	1.53Å	1.53Å
C2A	C29	sing	1.53Å	1.53Å
C23	C22	sing	1.53Å	1.52Å
C3E	C3D	sing	1.53Å	1.53Å
O21	C2	sing	1.45Å	1.40Å
O21	C21	sing	1.34Å	1.40Å
C3	C2	sing	1.53Å	1.52Å
C3	O31	sing	1.45Å	1.40Å
O32	C31	doub	1.21Å	1.18Å
C22	C21	sing	1.51Å	1.52Å
C3D	C3C	sing	1.53Å	1.53Å
C21	O22	doub	1.21Å	1.18Å
C31	O31	sing	1.34Å	1.40Å
C31	C32	sing	1.51Å	1.52Å
C3C	C3B	sing	1.53Å	1.53Å
C33	C32	sing	1.53Å	1.52Å
C33	C34	sing	1.53Å	1.52Å
C34	C35	sing	1.53Å	1.52Å
C35	C36	sing	1.53Å	1.53Å
C36	C37	sing	1.53Å	1.53Å
C37	C38	sing	1.53Å	1.53Å
C3A	C3B	sing	1.53Å	1.53Å
C3A	C39	sing	1.53Å	1.53Å
C38	C39	sing	1.53Å	1.53Å
C1	H1	sing	1.09Å	1.10Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C2	H4	sing	1.09Å	1.10Å
C3	H5	sing	1.09Å	1.10Å
C3	H6	sing	1.09Å	1.10Å
C32	H7	sing	1.09Å	1.10Å
C32	H8	sing	1.09Å	1.10Å
C33	H9	sing	1.09Å	1.10Å
C33	H10	sing	1.09Å	1.10Å
C34	H11	sing	1.09Å	1.10Å
C34	H12	sing	1.09Å	1.10Å
C35	H13	sing	1.09Å	1.10Å
C35	H14	sing	1.09Å	1.10Å
C36	H15	sing	1.09Å	1.10Å
C36	H16	sing	1.09Å	1.10Å
C37	H17	sing	1.09Å	1.10Å
C37	H18	sing	1.09Å	1.10Å
C38	H19	sing	1.09Å	1.10Å
C38	H20	sing	1.09Å	1.10Å
C39	H21	sing	1.09Å	1.10Å
C39	H22	sing	1.09Å	1.10Å
C3A	H23	sing	1.09Å	1.10Å
C3A	H24	sing	1.09Å	1.10Å
C3B	H25	sing	1.09Å	1.10Å
C3B	H26	sing	1.09Å	1.10Å
C3C	H27	sing	1.09Å	1.10Å
C3C	H28	sing	1.09Å	1.10Å
C3D	H29	sing	1.09Å	1.10Å
C3D	H30	sing	1.09Å	1.10Å
C3E	H31	sing	1.09Å	1.10Å
C3E	H32	sing	1.09Å	1.10Å
C3F	H33	sing	1.09Å	1.10Å
C3F	H34	sing	1.09Å	1.10Å
C3G	H35	sing	1.09Å	1.10Å
C3G	H36	sing	1.09Å	1.10Å
C3H	H37	sing	1.09Å	1.10Å
C3H	H38	sing	1.09Å	1.10Å
C3I	H39	sing	1.09Å	1.10Å
C3I	H40	sing	1.09Å	1.10Å
C3I	H41	sing	1.09Å	1.10Å
C22	H42	sing	1.09Å	1.10Å
C22	H43	sing	1.09Å	1.10Å
C23	H44	sing	1.09Å	1.10Å
C23	H45	sing	1.09Å	1.10Å
C24	H46	sing	1.09Å	1.10Å
C24	H47	sing	1.09Å	1.10Å
C25	H48	sing	1.09Å	1.10Å
C25	H49	sing	1.09Å	1.10Å
C26	H50	sing	1.09Å	1.10Å
C26	H51	sing	1.09Å	1.10Å
C27	H52	sing	1.09Å	1.10Å
C27	H53	sing	1.09Å	1.10Å
C28	H54	sing	1.09Å	1.10Å
C28	H55	sing	1.09Å	1.10Å
C29	H56	sing	1.09Å	1.10Å
C29	H57	sing	1.09Å	1.10Å
C2A	H58	sing	1.09Å	1.10Å
C2A	H59	sing	1.09Å	1.10Å
C2B	H60	sing	1.09Å	1.10Å
C2B	H61	sing	1.09Å	1.10Å
C2C	H62	sing	1.09Å	1.10Å
C2C	H63	sing	1.09Å	1.10Å
C2D	H64	sing	1.09Å	1.10Å
C2D	H65	sing	1.09Å	1.10Å
C2E	H66	sing	1.09Å	1.10Å
C2E	H67	sing	1.09Å	1.10Å
C2F	H68	sing	1.09Å	1.10Å
C2F	H69	sing	1.09Å	1.10Å
C2G	H70	sing	1.09Å	1.10Å
C2G	H71	sing	1.09Å	1.10Å
C2H	H72	sing	1.09Å	1.10Å
C2H	H73	sing	1.09Å	1.10Å
C2I	H74	sing	1.09Å	1.10Å
C2I	H75	sing	1.09Å	1.10Å
C2I	H76	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C3I	C3H	C3G	109.8°	109.5°
C3I	C3H	H37	109.4°	109.5°
C3I	C3H	H38	109.4°	109.5°
C3H	C3I	H39	109.5°	109.5°
C3H	C3I	H40	109.5°	109.5°
C3H	C3I	H41	109.5°	109.4°
C2I	C2H	C2G	109.3°	109.5°
C2I	C2H	H72	109.5°	109.5°
C2I	C2H	H73	109.5°	109.5°
C2H	C2I	H74	109.5°	109.5°
C2H	C2I	H75	109.4°	109.5°
C2H	C2I	H76	109.5°	109.5°
C3H	C3G	C3F	110.0°	109.5°
C3H	C3G	H35	109.3°	109.5°
C3H	C3G	H36	109.4°	109.5°
C3G	C3H	H37	109.4°	109.4°
C3G	C3H	H38	109.4°	109.5°
C2H	C2G	C2F	109.4°	109.5°
C2H	C2G	H70	109.5°	109.5°
C2H	C2G	H71	109.5°	109.5°
C2G	C2H	H72	109.5°	109.5°
C2G	C2H	H73	109.5°	109.5°
C2D	C2E	C2F	109.1°	109.5°
C2E	C2D	C2C	109.4°	109.5°
C2E	C2D	H64	109.5°	109.5°
C2E	C2D	H65	109.5°	109.4°
C2D	C2E	H66	109.6°	109.5°
C2D	C2E	H67	109.5°	109.4°
C2E	C2F	C2G	109.7°	109.5°
C2F	C2E	H66	109.6°	109.5°
C2F	C2E	H67	109.6°	109.5°
C2E	C2F	H68	109.4°	109.5°
C2E	C2F	H69	109.4°	109.5°
C3G	C3F	C3E	109.5°	109.5°
C3G	C3F	H33	109.5°	109.5°
C3G	C3F	H34	109.4°	109.5°
C3F	C3G	H35	109.3°	109.4°
C3F	C3G	H36	109.3°	109.5°
C3F	C3E	C3D	109.7°	109.5°
C3F	C3E	H31	109.4°	109.5°
C3F	C3E	H32	109.4°	109.5°
C3E	C3F	H33	109.4°	109.4°
C3E	C3F	H34	109.5°	109.4°
C2G	C2F	H68	109.4°	109.5°
C2G	C2F	H69	109.4°	109.4°
C2F	C2G	H70	109.5°	109.5°
C2F	C2G	H71	109.5°	109.4°
C2D	C2C	C2B	109.5°	109.5°
C2D	C2C	H62	109.4°	109.5°
C2D	C2C	H63	109.5°	109.4°
C2C	C2D	H64	109.5°	109.5°
C2C	C2D	H65	109.5°	109.5°
C2C	C2B	C2A	109.6°	109.5°
C2C	C2B	H60	109.4°	109.5°
C2C	C2B	H61	109.4°	109.5°
C2B	C2C	H62	109.5°	109.6°
C2B	C2C	H63	109.5°	109.5°
C1	C2	O21	109.3°	109.5°
C1	C2	C3	109.7°	109.5°
C2	C1	H1	109.5°	109.5°
C2	C1	H2	109.5°	109.5°
C2	C1	H3	109.5°	109.5°
C1	C2	H4	109.1°	109.5°
C29	C28	C27	110.1°	109.4°
C28	C29	C2A	109.1°	109.5°
C29	C28	H54	109.3°	109.5°
C29	C28	H55	109.4°	109.4°
C28	C29	H56	109.5°	109.5°
C28	C29	H57	109.6°	109.5°
C28	C27	C26	109.1°	109.4°
C28	C27	H52	109.6°	109.5°
C28	C27	H53	109.6°	109.4°
C27	C28	H54	109.3°	109.5°
C27	C28	H55	109.3°	109.5°
C27	C26	C25	109.0°	109.5°
C27	C26	H50	109.6°	109.5°
C27	C26	H51	109.6°	109.5°
C26	C27	H52	109.6°	109.5°
C26	C27	H53	109.5°	109.5°
C26	C25	C24	109.4°	109.5°
C26	C25	H48	109.5°	109.5°
C26	C25	H49	109.5°	109.4°
C25	C26	H50	109.6°	109.5°
C25	C26	H51	109.6°	109.5°
C23	C24	C25	109.3°	109.5°
C24	C23	C22	109.1°	109.5°
C24	C23	H44	109.6°	109.5°
C24	C23	H45	109.6°	109.5°
C23	C24	H46	109.5°	109.6°
C23	C24	H47	109.5°	109.5°
C25	C24	H46	109.5°	109.5°
C25	C24	H47	109.5°	109.5°
C24	C25	H48	109.5°	109.5°
C24	C25	H49	109.5°	109.5°
C2B	C2A	C29	109.1°	109.5°
C2B	C2A	H58	109.5°	109.5°
C2B	C2A	H59	109.6°	109.4°
C2A	C2B	H60	109.5°	109.4°
C2A	C2B	H61	109.4°	109.4°
C2A	C29	H56	109.6°	109.5°
C2A	C29	H57	109.6°	109.5°
C29	C2A	H58	109.6°	109.5°
C29	C2A	H59	109.5°	109.5°
C23	C22	C21	109.4°	109.5°
C23	C22	H42	109.5°	109.5°
C23	C22	H43	109.5°	109.5°
C22	C23	H44	109.5°	109.4°
C22	C23	H45	109.6°	109.5°
C3E	C3D	C3C	109.9°	109.5°
C3E	C3D	H29	109.4°	109.4°
C3E	C3D	H30	109.3°	109.4°
C3D	C3E	H31	109.4°	109.5°
C3D	C3E	H32	109.4°	109.5°
C2	O21	C21	115.7°	117.0°
O21	C2	C3	108.7°	109.4°
O21	C2	H4	110.9°	109.5°
O21	C21	C22	119.3°	120.0°
O21	C21	O22	120.9°	120.0°
C2	C3	O31	109.3°	109.5°
C3	C2	H4	109.1°	109.5°
C2	C3	H5	109.5°	109.5°
C2	C3	H6	109.5°	109.4°
C3	O31	C31	114.9°	117.0°
O31	C3	H5	109.5°	109.5°
O31	C3	H6	109.5°	109.5°
O32	C31	O31	120.5°	120.0°
O32	C31	C32	119.3°	120.0°
C22	C21	O22	119.8°	120.0°
C21	C22	H42	109.5°	109.4°
C21	C22	H43	109.5°	109.5°
C3D	C3C	C3B	109.4°	109.5°
C3D	C3C	H27	109.5°	109.5°
C3D	C3C	H28	109.5°	109.5°
C3C	C3D	H29	109.4°	109.5°
C3C	C3D	H30	109.4°	109.5°
O31	C31	C32	120.3°	120.0°
C31	C32	C33	109.2°	109.4°
C31	C32	H7	109.5°	109.5°
C31	C32	H8	109.5°	109.5°
C3C	C3B	C3A	109.2°	109.5°
C3C	C3B	H25	109.6°	109.5°
C3C	C3B	H26	109.5°	109.5°
C3B	C3C	H27	109.5°	109.5°
C3B	C3C	H28	109.5°	109.5°
C32	C33	C34	109.8°	109.5°
C33	C32	H7	109.6°	109.4°
C33	C32	H8	109.6°	109.4°
C32	C33	H9	109.4°	109.5°
C32	C33	H10	109.4°	109.5°
C33	C34	C35	109.3°	109.5°
C34	C33	H9	109.4°	109.5°
C34	C33	H10	109.4°	109.5°
C33	C34	H11	109.5°	109.4°
C33	C34	H12	109.5°	109.5°
C34	C35	C36	109.1°	109.5°
C35	C34	H11	109.5°	109.5°
C35	C34	H12	109.5°	109.5°
C34	C35	H13	109.6°	109.5°
C34	C35	H14	109.6°	109.5°
C35	C36	C37	109.5°	109.5°
C36	C35	H13	109.5°	109.5°
C36	C35	H14	109.6°	109.5°
C35	C36	H15	109.5°	109.5°
C35	C36	H16	109.5°	109.5°
C36	C37	C38	109.7°	109.5°
C37	C36	H15	109.5°	109.5°
C37	C36	H16	109.5°	109.5°
C36	C37	H17	109.4°	109.5°
C36	C37	H18	109.4°	109.5°
C37	C38	C39	110.0°	109.5°
C38	C37	H17	109.4°	109.4°
C38	C37	H18	109.4°	109.4°
C37	C38	H19	109.3°	109.5°
C37	C38	H20	109.3°	109.4°
C3B	C3A	C39	109.9°	109.5°
C3B	C3A	H23	109.3°	109.4°
C3B	C3A	H24	109.3°	109.4°
C3A	C3B	H25	109.5°	109.5°
C3A	C3B	H26	109.5°	109.5°
C3A	C39	C38	109.7°	109.5°
C3A	C39	H21	109.4°	109.5°
C3A	C39	H22	109.4°	109.5°
C39	C3A	H23	109.4°	109.5°
C39	C3A	H24	109.4°	109.5°
C39	C38	H19	109.3°	109.5°
C39	C38	H20	109.3°	109.5°
C38	C39	H21	109.4°	109.5°
C38	C39	H22	109.4°	109.5°
H1	C1	H2	109.5°	109.4°
H1	C1	H3	109.4°	109.5°
H2	C1	H3	109.5°	109.5°
H5	C3	H6	109.5°	109.5°
H7	C32	H8	109.5°	109.6°
H9	C33	H10	109.5°	109.4°
H11	C34	H12	109.5°	109.5°
H13	C35	H14	109.5°	109.4°
H15	C36	H16	109.5°	109.4°
H17	C37	H18	109.5°	109.5°
H19	C38	H20	109.5°	109.5°
H21	C39	H22	109.5°	109.4°
H23	C3A	H24	109.5°	109.5°
H25	C3B	H26	109.5°	109.4°
H27	C3C	H28	109.5°	109.4°
H29	C3D	H30	109.5°	109.5°
H31	C3E	H32	109.5°	109.4°
H33	C3F	H34	109.5°	109.4°
H35	C3G	H36	109.5°	109.5°
H37	C3H	H38	109.5°	109.5°
H39	C3I	H40	109.5°	109.4°
H39	C3I	H41	109.4°	109.4°
H40	C3I	H41	109.5°	109.5°
H42	C22	H43	109.5°	109.5°
H44	C23	H45	109.5°	109.4°
H46	C24	H47	109.4°	109.4°
H48	C25	H49	109.4°	109.5°
H50	C26	H51	109.5°	109.4°
H52	C27	H53	109.5°	109.5°
H54	C28	H55	109.5°	109.5°
H56	C29	H57	109.5°	109.4°
H58	C2A	H59	109.5°	109.4°
H60	C2B	H61	109.5°	109.4°
H62	C2C	H63	109.5°	109.4°
H64	C2D	H65	109.5°	109.5°
H66	C2E	H67	109.5°	109.5°
H68	C2F	H69	109.5°	109.5°
H70	C2G	H71	109.5°	109.5°
H72	C2H	H73	109.5°	109.4°
H74	C2I	H75	109.5°	109.5°
H74	C2I	H76	109.5°	109.4°
H75	C2I	H76	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C3I	C3H	C3G	H37	120.1°	120.0°
C3I	C3H	C3G	H38	120.1°	120.0°
C3I	C3H	C3G	C3F	65.8°	179.9°
C3I	C3H	C3G	H35	174.1°	60.0°
C3I	C3H	C3G	H36	54.3°	60.0°
C3I	C3H	H37	H38	119.9°	120.0°
C3H	C3I	H39	H40	120.0°	120.0°
C3H	C3I	H39	H41	120.0°	119.9°
C3H	C3I	H40	H41	120.0°	120.0°
C2I	C2H	C2G	H72	120.0°	120.1°
C2I	C2H	C2G	H73	120.0°	120.0°
C2I	C2H	C2G	C2F	173.7°	180.0°
C2I	C2H	C2G	H70	66.3°	60.0°
C2I	C2H	C2G	H71	53.7°	60.1°
C2I	C2H	H72	H73	120.1°	119.9°
C2H	C2I	H74	H75	120.0°	120.1°
C2H	C2I	H74	H76	120.0°	120.0°
C2H	C2I	H75	H76	120.0°	120.0°
C3H	C3G	C3F	H35	120.1°	120.0°
C3H	C3G	C3F	H36	120.1°	120.0°
C3H	C3G	C3F	C3E	150.0°	180.0°
C3H	C3G	C3F	H33	30.1°	60.0°
C3H	C3G	C3F	H34	90.0°	60.0°
C3H	C3G	H35	H36	119.8°	120.0°
C3G	C3H	H37	H38	119.8°	120.0°
C3G	C3H	C3I	H39	180.0°	180.0°
C3G	C3H	C3I	H40	60.0°	60.0°
C3G	C3H	C3I	H41	60.0°	60.0°
C2H	C2G	C2F	C2E	74.8°	180.0°
C2H	C2G	C2F	H70	120.0°	120.1°
C2H	C2G	C2F	H71	120.0°	120.0°
C2H	C2G	C2F	H68	165.1°	60.0°
C2H	C2G	C2F	H69	45.2°	60.0°
C2H	C2G	H70	H71	120.0°	120.0°
C2G	C2H	H72	H73	120.1°	120.0°
C2G	C2H	C2I	H74	180.0°	180.0°
C2G	C2H	C2I	H75	60.0°	60.0°
C2G	C2H	C2I	H76	60.0°	60.0°
C2D	C2E	C2F	H66	120.0°	120.1°
C2D	C2E	C2F	H67	119.9°	119.9°
C2D	C2E	C2F	C2G	172.5°	180.0°
C2E	C2D	C2C	H64	120.0°	120.0°
C2E	C2D	C2C	H65	120.0°	119.9°
C2E	C2D	C2C	C2B	64.7°	180.0°
C2E	C2D	C2C	H62	55.3°	59.9°
C2E	C2D	C2C	H63	175.3°	60.0°
C2E	C2D	H64	H65	120.1°	119.9°
C2D	C2E	H66	H67	120.2°	120.0°
C2D	C2E	C2F	H68	52.4°	59.9°
C2D	C2E	C2F	H69	67.5°	60.1°
C2E	C2F	C2G	H68	120.0°	120.0°
C2E	C2F	C2G	H69	120.1°	120.0°
C2F	C2E	C2D	C2C	135.7°	180.0°
C2F	C2E	C2D	H64	104.3°	59.9°
C2F	C2E	C2D	H65	15.7°	60.0°
C2F	C2E	H66	H67	120.2°	120.0°
C2E	C2F	H68	H69	119.9°	120.0°
C2E	C2F	C2G	H70	165.2°	59.9°
C2E	C2F	C2G	H71	45.1°	60.0°
C3G	C3F	C3E	H33	120.0°	120.0°
C3G	C3F	C3E	H34	120.0°	120.1°
C3G	C3F	C3E	C3D	67.7°	180.0°
C3G	C3F	C3E	H31	52.4°	60.0°
C3G	C3F	C3E	H32	172.3°	60.0°
C3G	C3F	H33	H34	120.0°	120.1°
C3F	C3G	H35	H36	119.7°	120.0°
C3F	C3G	C3H	H37	54.3°	60.0°
C3F	C3G	C3H	H38	174.1°	60.0°
C3F	C3E	C3D	H31	120.0°	120.0°
C3F	C3E	C3D	H32	120.1°	120.0°
C3F	C3E	C3D	C3C	74.4°	180.0°
C3F	C3E	C3D	H29	45.7°	60.0°
C3F	C3E	C3D	H30	165.6°	60.0°
C3F	C3E	H31	H32	119.9°	120.0°
C3E	C3F	H33	H34	120.0°	119.9°
C3E	C3F	C3G	H35	89.9°	60.0°
C3E	C3F	C3G	H36	29.9°	60.0°
C2G	C2F	C2E	H66	67.6°	59.9°
C2G	C2F	C2E	H67	52.5°	60.1°
C2G	C2F	H68	H69	119.9°	120.0°
C2F	C2G	H70	H71	120.0°	119.9°
C2F	C2G	C2H	H72	53.7°	59.9°
C2F	C2G	C2H	H73	66.3°	60.0°
C2D	C2C	C2B	H62	120.0°	120.1°
C2D	C2C	C2B	H63	120.0°	119.9°
C2D	C2C	C2B	C2A	154.4°	180.0°
C2D	C2C	C2B	H60	85.6°	60.0°
C2D	C2C	C2B	H61	34.4°	60.0°
C2D	C2C	H62	H63	120.0°	119.9°
C2C	C2D	H64	H65	120.0°	120.0°
C2C	C2D	C2E	H66	104.3°	60.0°
C2C	C2D	C2E	H67	15.8°	60.0°
C2C	C2B	C2A	H60	120.0°	120.1°
C2C	C2B	C2A	H61	120.0°	120.0°
C2C	C2B	C2A	C29	164.1°	180.0°
C2C	C2B	C2A	H58	44.1°	59.9°
C2C	C2B	C2A	H59	76.0°	60.0°
C2C	C2B	H60	H61	119.9°	120.0°
C2B	C2C	H62	H63	120.0°	120.1°
C2B	C2C	C2D	H64	175.3°	60.0°
C2B	C2C	C2D	H65	55.3°	60.1°
C1	C2	O21	C3	119.7°	120.0°
C1	C2	O21	H4	120.4°	120.0°
C1	C2	O21	C21	101.0°	90.0°
C1	C2	C3	H4	119.5°	120.0°
C1	C2	C3	O31	179.0°	55.0°
C2	C1	H1	H2	120.0°	120.0°
C2	C1	H1	H3	120.0°	120.1°
C2	C1	H2	H3	120.0°	120.1°
C1	C2	C3	H5	61.1°	175.0°
C1	C2	C3	H6	59.0°	65.0°
C29	C28	C27	H54	120.1°	120.0°
C29	C28	C27	H55	120.1°	119.9°
C29	C28	C27	C26	160.8°	NaN°
C28	C29	C2A	C2B	83.9°	180.0°
C28	C29	C2A	H56	119.9°	120.1°
C28	C29	C2A	H57	120.0°	120.0°
C29	C28	C27	H52	79.3°	60.0°
C29	C28	C27	H53	40.8°	60.1°
C29	C28	H54	H55	119.8°	119.9°
C28	C29	H56	H57	120.2°	120.0°
C28	C29	C2A	H58	36.0°	59.9°
C28	C29	C2A	H59	156.1°	60.0°
C28	C27	C26	H52	119.9°	120.0°
C28	C27	C26	H53	119.9°	119.9°
C28	C27	C26	C25	175.5°	180.0°
C27	C28	C29	C2A	121.4°	180.0°
C28	C27	C26	H50	64.6°	59.9°
C28	C27	C26	H51	55.6°	60.0°
C28	C27	H52	H53	120.2°	120.0°
C27	C28	H54	H55	119.7°	120.1°
C27	C28	C29	H56	1.4°	59.9°
C27	C28	C29	H57	118.7°	60.0°
C27	C26	C25	H50	119.9°	120.1°
C27	C26	C25	H51	119.9°	120.0°
C27	C26	C25	C24	159.5°	180.0°
C27	C26	C25	H48	39.5°	59.9°
C27	C26	C25	H49	80.5°	60.0°
C27	C26	H50	H51	120.2°	120.0°
C26	C27	H52	H53	120.1°	120.0°
C26	C27	C28	H54	40.7°	60.0°
C26	C27	C28	H55	79.1°	60.1°
C26	C25	C24	C23	95.2°	180.0°
C26	C25	C24	H48	120.0°	120.0°
C26	C25	C24	H49	120.0°	119.9°
C26	C25	C24	H46	24.7°	59.9°
C26	C25	C24	H47	144.8°	60.0°
C26	C25	H48	H49	120.1°	119.9°
C25	C26	H50	H51	120.2°	120.0°
C25	C26	C27	H52	55.6°	60.0°
C25	C26	C27	H53	64.5°	60.1°
C23	C24	C25	H46	120.0°	120.1°
C23	C24	C25	H47	120.0°	120.0°
C24	C23	C22	H44	120.0°	120.1°
C24	C23	C22	H45	120.0°	120.0°
C24	C23	C22	C21	169.8°	180.0°
C24	C23	C22	H42	49.8°	60.0°
C24	C23	C22	H43	70.2°	60.0°
C24	C23	H44	H45	120.2°	120.0°
C23	C24	H46	H47	120.1°	120.0°
C23	C24	C25	H48	24.7°	60.0°
C23	C24	C25	H49	144.7°	60.1°
C25	C24	C23	C22	67.5°	180.0°
C25	C24	C23	H44	172.6°	60.0°
C25	C24	C23	H45	52.5°	60.0°
C25	C24	H46	H47	120.0°	119.9°
C24	C25	H48	H49	120.0°	120.0°
C24	C25	C26	H50	80.5°	59.9°
C24	C25	C26	H51	39.6°	60.0°
C2B	C2A	C29	H58	119.9°	120.1°
C2B	C2A	C29	H59	120.0°	120.0°
C2B	C2A	C29	H56	36.0°	59.9°
C2B	C2A	C29	H57	156.1°	60.0°
C2B	C2A	H58	H59	120.2°	119.9°
C2A	C2B	H60	H61	119.9°	119.9°
C2A	C2B	C2C	H62	34.4°	59.9°
C2A	C2B	C2C	H63	85.6°	60.1°
C2A	C29	C28	H54	1.3°	59.9°
C2A	C29	C28	H55	118.5°	60.1°
C2A	C29	H56	H57	120.2°	119.9°
C29	C2A	H58	H59	120.1°	119.9°
C29	C2A	C2B	H60	75.9°	59.9°
C29	C2A	C2B	H61	44.1°	60.0°
C23	C22	C21	O21	22.0°	180.0°
C23	C22	C21	H42	120.0°	120.0°
C23	C22	C21	H43	120.0°	120.0°
C23	C22	C21	O22	157.5°	0.0°
C23	C22	H42	H43	120.0°	120.0°
C22	C23	H44	H45	120.1°	120.0°
C22	C23	C24	H46	172.5°	60.0°
C22	C23	C24	H47	52.5°	60.0°
C3E	C3D	C3C	H29	120.1°	120.0°
C3E	C3D	C3C	H30	120.0°	120.0°
C3E	C3D	C3C	C3B	155.0°	180.0°
C3E	C3D	C3C	H27	85.1°	60.0°
C3E	C3D	C3C	H28	35.0°	60.0°
C3E	C3D	H29	H30	119.8°	120.0°
C3D	C3E	H31	H32	119.9°	120.0°
C3D	C3E	C3F	H33	172.3°	60.0°
C3D	C3E	C3F	H34	52.3°	60.0°
O21	C2	C3	H4	121.1°	120.0°
O21	C2	C3	O31	59.5°	65.0°
C2	O21	C21	C22	174.2°	180.0°
C2	O21	C21	O22	5.4°	0.0°
O21	C2	C1	H1	180.0°	60.0°
O21	C2	C1	H2	60.0°	179.9°
O21	C2	C1	H3	60.0°	60.0°
O21	C2	C3	H5	179.5°	55.0°
O21	C2	C3	H6	60.5°	175.0°
C21	O21	C2	C3	139.4°	150.0°
O21	C21	C22	O22	179.6°	180.0°
C21	O21	C2	H4	19.4°	30.0°
O21	C21	C22	H42	97.9°	60.0°
O21	C21	C22	H43	142.1°	60.0°
C2	C3	O31	H5	120.0°	120.0°
C2	C3	O31	H6	120.0°	120.0°
C2	C3	O31	C31	177.4°	180.0°
C3	C2	C1	H1	60.9°	60.0°
C3	C2	C1	H2	179.0°	60.0°
C3	C2	C1	H3	59.0°	180.0°
C2	C3	H5	H6	120.1°	120.0°
C3	O31	C31	O32	0.0°	0.0°
C3	O31	C31	C32	179.9°	180.0°
O31	C3	C2	H4	61.6°	175.0°
O31	C3	H5	H6	120.1°	120.0°
O32	C31	O31	C32	179.9°	180.0°
O32	C31	C32	C33	17.1°	0.0°
O32	C31	C32	H7	102.9°	119.9°
O32	C31	C32	H8	137.0°	119.9°
C21	C22	H42	H43	120.0°	120.0°
C21	C22	C23	H44	70.3°	60.0°
C21	C22	C23	H45	49.8°	60.0°
C3D	C3C	C3B	H27	120.0°	120.0°
C3D	C3C	C3B	H28	120.0°	120.0°
C3D	C3C	C3B	C3A	71.7°	180.0°
C3D	C3C	C3B	H25	48.2°	60.0°
C3D	C3C	C3B	H26	168.3°	60.0°
C3D	C3C	H27	H28	120.1°	120.0°
C3C	C3D	H29	H30	119.8°	120.0°
C3C	C3D	C3E	H31	165.6°	60.0°
C3C	C3D	C3E	H32	45.7°	60.0°
O22	C21	C22	H42	82.5°	120.0°
O22	C21	C22	H43	37.5°	120.0°
O31	C31	C32	C33	162.8°	180.0°
C31	O31	C3	H5	62.6°	60.0°
C31	O31	C3	H6	57.4°	60.0°
O31	C31	C32	H7	77.2°	60.1°
O31	C31	C32	H8	42.9°	60.1°
C31	C32	C33	H7	119.9°	120.0°
C31	C32	C33	H8	119.9°	120.0°
C31	C32	C33	C34	135.4°	180.0°
C31	C32	H7	H8	120.1°	120.1°
C31	C32	C33	H9	104.6°	60.0°
C31	C32	C33	H10	15.3°	60.0°
C3C	C3B	C3A	H25	120.0°	120.0°
C3C	C3B	C3A	H26	119.9°	120.0°
C3C	C3B	C3A	C39	169.8°	180.0°
C3C	C3B	C3A	H23	49.7°	60.0°
C3C	C3B	C3A	H24	70.2°	60.0°
C3C	C3B	H25	H26	120.1°	120.0°
C3B	C3C	H27	H28	120.0°	120.0°
C3B	C3C	C3D	H29	34.9°	60.0°
C3B	C3C	C3D	H30	85.0°	60.1°
C32	C33	C34	H9	120.0°	120.0°
C32	C33	C34	H10	120.1°	120.0°
C32	C33	C34	C35	179.4°	180.0°
C33	C32	H7	H8	120.2°	120.0°
C32	C33	H9	H10	119.9°	120.0°
C32	C33	C34	H11	60.7°	60.0°
C32	C33	C34	H12	59.4°	60.0°
C33	C34	C35	H11	120.0°	120.0°
C33	C34	C35	H12	120.0°	120.0°
C33	C34	C35	C36	173.6°	180.0°
C34	C33	C32	H7	15.5°	60.1°
C34	C33	C32	H8	104.7°	60.0°
C34	C33	H9	H10	119.8°	120.0°
C33	C34	H11	H12	120.1°	120.0°
C33	C34	C35	H13	53.6°	60.0°
C33	C34	C35	H14	66.5°	60.0°
C34	C35	C36	H13	120.0°	120.0°
C34	C35	C36	H14	120.0°	120.0°
C34	C35	C36	C37	179.8°	180.0°
C35	C34	C33	H9	59.3°	60.0°
C35	C34	C33	H10	60.6°	60.0°
C35	C34	H11	H12	120.1°	120.0°
C34	C35	H13	H14	120.2°	120.0°
C34	C35	C36	H15	60.2°	60.0°
C34	C35	C36	H16	59.8°	60.0°
C35	C36	C37	H15	120.0°	120.0°
C35	C36	C37	H16	120.0°	120.0°
C35	C36	C37	C38	157.3°	180.0°
C36	C35	C34	H11	66.4°	60.0°
C36	C35	C34	H12	53.6°	60.0°
C36	C35	H13	H14	120.1°	120.0°
C35	C36	H15	H16	120.0°	120.0°
C35	C36	C37	H17	37.2°	60.0°
C35	C36	C37	H18	82.7°	60.1°
C36	C37	C38	H17	120.0°	120.0°
C36	C37	C38	H18	120.0°	120.0°
C36	C37	C38	C39	157.7°	180.0°
C37	C36	C35	H13	59.9°	60.0°
C37	C36	C35	H14	60.2°	60.0°
C37	C36	H15	H16	120.0°	120.0°
C36	C37	H17	H18	119.9°	120.0°
C36	C37	C38	H19	82.3°	60.0°
C36	C37	C38	H20	37.6°	60.0°
C37	C38	C39	C3A	63.2°	180.0°
C37	C38	C39	H19	120.1°	120.0°
C37	C38	C39	H20	120.1°	120.0°
C38	C37	C36	H15	82.8°	60.0°
C38	C37	C36	H16	37.3°	60.0°
C38	C37	H17	H18	119.8°	120.0°
C37	C38	H19	H20	119.8°	120.0°
C37	C38	C39	H21	56.8°	60.0°
C37	C38	C39	H22	176.7°	60.0°
C3B	C3A	C39	H23	120.1°	119.9°
C3B	C3A	C39	H24	120.0°	120.0°
C3B	C3A	C39	C38	178.1°	180.0°
C3B	C3A	C39	H21	61.9°	60.0°
C3B	C3A	C39	H22	58.0°	60.0°
C3B	C3A	H23	H24	119.8°	119.9°
C3A	C3B	H25	H26	120.1°	120.0°
C3A	C3B	C3C	H27	168.3°	60.0°
C3A	C3B	C3C	H28	48.3°	60.0°
C3A	C39	C38	H21	120.0°	120.0°
C3A	C39	C38	H22	120.1°	120.0°
C3A	C39	C38	H19	56.8°	60.1°
C3A	C39	C38	H20	176.7°	60.0°
C3A	C39	H21	H22	119.9°	120.0°
C39	C3A	H23	H24	119.8°	120.1°
C39	C3A	C3B	H25	70.3°	60.0°
C39	C3A	C3B	H26	49.8°	60.0°
C39	C38	C37	H17	37.6°	60.0°
C39	C38	C37	H18	82.3°	60.0°
C39	C38	H19	H20	119.8°	120.0°
C38	C39	H21	H22	119.9°	120.0°
C38	C39	C3A	H23	58.0°	60.1°
C38	C39	C3A	H24	61.9°	60.0°
H1	C1	H2	H3	120.0°	119.9°
H1	C1	C2	H4	58.5°	180.0°
H2	C1	C2	H4	61.5°	60.0°
H3	C1	C2	H4	178.5°	60.0°
H4	C2	C3	H5	58.4°	65.0°
H4	C2	C3	H6	178.4°	55.0°
H7	C32	C33	H9	135.5°	179.9°
H7	C32	C33	H10	104.6°	60.0°
H8	C32	C33	H9	15.3°	60.0°
H8	C32	C33	H10	135.3°	180.0°
H9	C33	C34	H11	179.3°	180.0°
H9	C33	C34	H12	60.6°	60.1°
H10	C33	C34	H11	59.4°	60.0°
H10	C33	C34	H12	179.4°	180.0°
H11	C34	C35	H13	173.6°	179.9°
H11	C34	C35	H14	53.5°	60.0°
H12	C34	C35	H13	66.3°	60.0°
H12	C34	C35	H14	173.6°	180.0°
H13	C35	C36	H15	179.8°	NaN°
H13	C35	C36	H16	60.1°	60.1°
H14	C35	C36	H15	59.8°	60.1°
H14	C35	C36	H16	179.8°	180.0°
H15	C36	C37	H17	157.2°	179.9°
H15	C36	C37	H18	37.3°	60.0°
H16	C36	C37	H17	82.8°	60.0°
H16	C36	C37	H18	157.3°	180.0°
H17	C37	C38	H19	157.7°	180.0°
H17	C37	C38	H20	82.4°	59.9°
H18	C37	C38	H19	37.8°	60.0°
H18	C37	C38	H20	157.7°	180.0°
H19	C38	C39	H21	176.9°	179.9°
H19	C38	C39	H22	63.2°	60.0°
H20	C38	C39	H21	63.2°	60.0°
H20	C38	C39	H22	56.7°	180.0°
H21	C39	C3A	H23	178.0°	179.9°
H21	C39	C3A	H24	58.1°	60.0°
H22	C39	C3A	H23	62.0°	60.0°
H22	C39	C3A	H24	178.1°	180.0°
H23	C3A	C3B	H25	169.6°	180.0°
H23	C3A	C3B	H26	70.3°	60.0°
H24	C3A	C3B	H25	49.8°	60.1°
H24	C3A	C3B	H26	169.9°	180.0°
H25	C3B	C3C	H27	71.7°	180.0°
H25	C3B	C3C	H28	168.2°	60.1°
H26	C3B	C3C	H27	48.4°	60.1°
H26	C3B	C3C	H28	71.7°	180.0°
H27	C3C	C3D	H29	154.9°	179.9°
H27	C3C	C3D	H30	35.0°	60.0°
H28	C3C	C3D	H29	85.1°	60.0°
H28	C3C	C3D	H30	155.0°	180.0°
H29	C3D	C3E	H31	74.3°	180.0°
H29	C3D	C3E	H32	165.8°	60.0°
H30	C3D	C3E	H31	45.5°	60.0°
H30	C3D	C3E	H32	74.4°	180.0°
H31	C3E	C3F	H33	67.6°	180.0°
H31	C3E	C3F	H34	172.4°	60.1°
H32	C3E	C3F	H33	52.3°	60.0°
H32	C3E	C3F	H34	67.7°	180.0°
H33	C3F	C3G	H35	150.1°	180.0°
H33	C3F	C3G	H36	90.0°	60.0°
H34	C3F	C3G	H35	30.1°	60.0°
H34	C3F	C3G	H36	150.0°	180.0°
H35	C3G	C3H	H37	65.8°	180.0°
H35	C3G	C3H	H38	54.1°	60.0°
H36	C3G	C3H	H37	174.3°	60.0°
H36	C3G	C3H	H38	65.8°	180.0°
H37	C3H	C3I	H39	60.0°	60.0°
H37	C3H	C3I	H40	60.1°	180.0°
H37	C3H	C3I	H41	179.9°	59.9°
H38	C3H	C3I	H39	59.9°	60.0°
H38	C3H	C3I	H40	180.0°	60.0°
H38	C3H	C3I	H41	60.0°	180.0°
H39	C3I	H40	H41	120.0°	120.0°
H42	C22	C23	H44	169.7°	179.9°
H42	C22	C23	H45	70.2°	60.0°
H43	C22	C23	H44	49.7°	60.0°
H43	C22	C23	H45	169.8°	180.0°
H44	C23	C24	H46	52.5°	180.0°
H44	C23	C24	H47	67.5°	60.0°
H45	C23	C24	H46	67.5°	60.0°
H45	C23	C24	H47	172.4°	NaN°
H46	C24	C25	H48	144.7°	179.9°
H46	C24	C25	H49	95.3°	60.0°
H47	C24	C25	H48	95.3°	60.0°
H47	C24	C25	H49	24.7°	180.0°
H48	C25	C26	H50	159.5°	180.0°
H48	C25	C26	H51	80.4°	60.1°
H49	C25	C26	H50	39.5°	60.1°
H49	C25	C26	H51	159.6°	180.0°
H50	C26	C27	H52	175.5°	179.9°
H50	C26	C27	H53	55.4°	60.0°
H51	C26	C27	H52	64.4°	60.0°
H51	C26	C27	H53	175.5°	180.0°
H52	C27	C28	H54	160.6°	180.0°
H52	C27	C28	H55	40.8°	59.9°
H53	C27	C28	H54	79.3°	60.0°
H53	C27	C28	H55	160.9°	180.0°
H54	C28	C29	H56	118.6°	180.0°
H54	C28	C29	H57	121.3°	60.0°
H55	C28	C29	H56	121.5°	60.0°
H55	C28	C29	H57	1.4°	180.0°
H56	C29	C2A	H58	156.0°	180.0°
H56	C29	C2A	H59	83.9°	60.1°
H57	C29	C2A	H58	83.9°	60.1°
H57	C29	C2A	H59	36.2°	180.0°
H58	C2A	C2B	H60	164.2°	180.0°
H58	C2A	C2B	H61	75.9°	60.1°
H59	C2A	C2B	H60	44.0°	60.1°
H59	C2A	C2B	H61	164.0°	180.0°
H60	C2B	C2C	H62	154.5°	180.0°
H60	C2B	C2C	H63	34.5°	60.0°
H61	C2B	C2C	H62	85.6°	60.0°
H61	C2B	C2C	H63	154.4°	180.0°
H62	C2C	C2D	H64	64.7°	179.9°
H62	C2C	C2D	H65	175.3°	60.0°
H63	C2C	C2D	H64	55.3°	60.0°
H63	C2C	C2D	H65	64.7°	179.9°
H64	C2D	C2E	H66	15.6°	180.0°
H64	C2D	C2E	H67	135.8°	60.0°
H65	C2D	C2E	H66	135.7°	60.0°
H65	C2D	C2E	H67	104.2°	NaN°
H66	C2E	C2F	H68	172.4°	180.0°
H66	C2E	C2F	H69	52.5°	60.0°
H67	C2E	C2F	H68	67.5°	60.0°
H67	C2E	C2F	H69	172.6°	180.0°
H68	C2F	C2G	H70	45.1°	180.0°
H68	C2F	C2G	H71	74.9°	60.0°
H69	C2F	C2G	H70	74.8°	60.0°
H69	C2F	C2G	H71	165.2°	NaN°
H70	C2G	C2H	H72	173.7°	180.0°
H70	C2G	C2H	H73	53.7°	60.0°
H71	C2G	C2H	H72	66.2°	60.0°
H71	C2G	C2H	H73	173.7°	180.0°
H72	C2H	C2I	H74	60.0°	59.9°
H72	C2H	C2I	H75	60.0°	179.9°
H72	C2H	C2I	H76	179.9°	60.1°
H73	C2H	C2I	H74	60.0°	60.0°
H73	C2H	C2I	H75	180.0°	60.0°
H73	C2H	C2I	H76	60.0°	180.0°
H74	C2I	H75	H76	120.0°	119.9°

Release date:	2020-11-04
Definition date:	2020-01-10
Last modified:	2020-10-30
Release status:	REL
Processing site:	PDBJ
Derived from:	6LOD