IP9

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	O1	sing	1.43Å	1.34Å
C1	C2	sing	1.53Å	1.56Å
C1	C6	sing	1.53Å	1.55Å
C1	H1	sing	1.09Å	1.10Å
O1	P1	sing	1.61Å	1.52Å
C2	O2	sing	1.43Å	1.43Å
C2	C3	sing	1.53Å	1.56Å
C2	H2	sing	1.09Å	1.10Å
O2	HO2	sing	0.97Å	0.95Å
C3	O3	sing	1.43Å	1.35Å
C3	C4	sing	1.53Å	1.56Å
C3	H3	sing	1.09Å	1.10Å
O3	P3	sing	1.61Å	1.52Å
C4	O4	sing	1.43Å	1.35Å
C4	C5	sing	1.53Å	1.56Å
C4	H4	sing	1.09Å	1.10Å
O4	P4	sing	1.61Å	1.52Å
C5	O5	sing	1.43Å	1.34Å
C5	C6	sing	1.53Å	1.55Å
C5	H5	sing	1.09Å	1.10Å
O5	P5	sing	1.61Å	1.52Å
C6	O6	sing	1.43Å	1.43Å
C6	H6	sing	1.09Å	1.10Å
O6	HO6	sing	0.97Å	0.95Å
P1	O1P	doub	1.48Å	1.48Å
P1	O2P	sing	1.61Å	1.51Å
P1	O3P	sing	1.61Å	1.52Å
O2P	HO2P	sing	0.97Å	0.95Å
O3P	C7	sing	1.43Å	1.34Å
P3	O4P	doub	1.48Å	1.48Å
P3	O5P	sing	1.61Å	1.51Å
P3	O6P	sing	1.61Å	1.51Å
O5P	HO5P	sing	0.97Å	0.95Å
O6P	HO6P	sing	0.97Å	0.95Å
P4	O7P	sing	1.61Å	1.51Å
P4	O8P	sing	1.61Å	1.51Å
P4	O9P	doub	1.48Å	1.48Å
O7P	HO7P	sing	0.97Å	0.95Å
O8P	HO8P	sing	0.97Å	0.95Å
P5	OPF	sing	1.61Å	1.51Å
P5	OPG	doub	1.48Å	1.48Å
P5	OPH	sing	1.61Å	1.51Å
OPF	HOP1	sing	0.97Å	0.95Å
OPH	HOP3	sing	0.97Å	0.95Å
C7	C8	sing	1.53Å	1.55Å
C7	H16	sing	1.09Å	1.10Å
C7	H17	sing	1.09Å	1.10Å
C8	C9	sing	1.53Å	1.56Å
C8	O19	sing	1.45Å	1.35Å
C9	O20	sing	1.45Å	1.35Å
C9	H18	sing	1.09Å	1.10Å
C9	H19	sing	1.09Å	1.10Å
O19	C10	sing	1.34Å	1.25Å
O20	C11	sing	1.34Å	1.24Å
C10	O21	doub	1.21Å	1.22Å
C10	C12	sing	1.51Å	1.46Å
C11	C13	sing	1.51Å	1.45Å
C11	O22	doub	1.21Å	1.22Å
C8	H20	sing	1.09Å	1.10Å
C12	C14	sing	1.53Å	1.56Å
C12	H21	sing	1.09Å	1.10Å
C12	H22	sing	1.09Å	1.10Å
C13	C15	sing	1.53Å	1.55Å
C13	H23	sing	1.09Å	1.10Å
C13	H24	sing	1.09Å	1.10Å
C14	H25	sing	1.09Å	1.10Å
C14	H26	sing	1.09Å	1.10Å
C14	C16	sing	1.53Å	1.55Å
C15	H27	sing	1.09Å	1.10Å
C15	H28	sing	1.09Å	1.10Å
C15	C17	sing	1.53Å	1.55Å
C16	H29	sing	1.09Å	1.10Å
C16	C18	sing	1.53Å	1.55Å
C16	H30	sing	1.09Å	1.10Å
C17	H31	sing	1.09Å	1.10Å
C17	H32	sing	1.09Å	1.10Å
C17	C19	sing	1.53Å	1.55Å
C18	C20	sing	1.53Å	1.55Å
C18	H33	sing	1.09Å	1.10Å
C18	H34	sing	1.09Å	1.10Å
C19	H35	sing	1.09Å	1.10Å
C19	C21	sing	1.53Å	1.55Å
C19	H36	sing	1.09Å	1.10Å
C20	C22	sing	1.53Å	1.55Å
C20	H37	sing	1.09Å	1.10Å
C20	H38	sing	1.09Å	1.10Å
C21	H39	sing	1.09Å	1.10Å
C21	H40	sing	1.09Å	1.10Å
C21	C23	sing	1.53Å	1.55Å
C22	H41	sing	1.09Å	1.10Å
C22	H42	sing	1.09Å	1.10Å
C22	C24	sing	1.53Å	1.54Å
C23	C25	sing	1.53Å	1.54Å
C23	H43	sing	1.09Å	1.10Å
C23	H44	sing	1.09Å	1.10Å
C24	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
C25	H50	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	C2	112.7°	109.5°
O1	C1	C6	105.9°	109.4°
O1	C1	H1	110.2°	109.5°
C1	O1	P1	130.3°	123.0°
C2	C1	C6	111.0°	109.5°
C2	C1	H1	105.1°	109.5°
C1	C2	O2	110.4°	109.5°
C1	C2	C3	111.7°	109.4°
C1	C2	H2	107.8°	109.5°
C6	C1	H1	112.0°	109.4°
C1	C6	C5	112.4°	109.5°
C1	C6	O6	109.6°	109.5°
C1	C6	H6	107.5°	109.4°
O1	P1	O1P	110.3°	109.4°
O1	P1	O2P	110.2°	109.4°
O1	P1	O3P	108.0°	109.5°
O2	C2	C3	110.7°	109.5°
O2	C2	H2	108.8°	109.5°
C2	O2	HO2	109.5°	114.0°
C3	C2	H2	107.4°	109.5°
C2	C3	O3	108.6°	109.4°
C2	C3	C4	112.1°	109.5°
C2	C3	H3	108.1°	109.5°
O3	C3	C4	108.8°	109.5°
O3	C3	H3	111.4°	109.4°
C3	O3	P3	129.6°	123.0°
C4	C3	H3	107.8°	109.5°
C3	C4	O4	108.8°	109.4°
C3	C4	C5	112.6°	109.5°
C3	C4	H4	107.2°	109.5°
O3	P3	O4P	111.1°	109.4°
O3	P3	O5P	109.1°	109.5°
O3	P3	O6P	108.4°	109.5°
O4	C4	C5	107.5°	109.5°
O4	C4	H4	112.3°	109.5°
C4	O4	P4	129.4°	123.0°
C5	C4	H4	108.4°	109.5°
C4	C5	O5	108.4°	109.5°
C4	C5	C6	112.0°	109.5°
C4	C5	H5	108.0°	109.5°
O4	P4	O7P	108.5°	109.5°
O4	P4	O8P	109.0°	109.5°
O4	P4	O9P	111.0°	109.5°
O5	C5	C6	108.0°	109.5°
O5	C5	H5	112.0°	109.5°
C5	O5	P5	130.1°	123.0°
C6	C5	H5	108.5°	109.4°
C5	C6	O6	109.7°	109.5°
C5	C6	H6	107.3°	109.4°
O5	P5	OPF	108.9°	109.5°
O5	P5	OPG	111.3°	109.5°
O5	P5	OPH	108.3°	109.5°
O6	C6	H6	110.3°	109.5°
C6	O6	HO6	109.5°	114.0°
O1P	P1	O2P	110.0°	109.5°
O1P	P1	O3P	109.9°	109.5°
O2P	P1	O3P	108.3°	109.5°
P1	O2P	HO2P	109.5°	114.0°
P1	O3P	C7	127.3°	123.0°
O3P	C7	C8	110.4°	109.5°
O3P	C7	H16	109.1°	109.5°
O3P	C7	H17	109.1°	109.4°
O4P	P3	O5P	109.8°	109.4°
O4P	P3	O6P	109.6°	109.5°
O5P	P3	O6P	108.8°	109.5°
P3	O5P	HO5P	109.5°	113.9°
P3	O6P	HO6P	109.5°	114.0°
O7P	P4	O8P	109.1°	109.5°
O7P	P4	O9P	109.4°	109.4°
P4	O7P	HO7P	109.5°	114.0°
O8P	P4	O9P	109.8°	109.5°
P4	O8P	HO8P	109.5°	114.0°
OPF	P5	OPG	109.9°	109.4°
OPF	P5	OPH	108.8°	109.4°
P5	OPF	HOP1	109.5°	114.0°
OPG	P5	OPH	109.6°	109.5°
P5	OPH	HOP3	109.5°	114.0°
C8	C7	H16	109.2°	109.5°
C8	C7	H17	109.2°	109.4°
C7	C8	C9	110.2°	109.5°
C7	C8	O19	113.1°	109.5°
C7	C8	H20	105.9°	109.4°
H16	C7	H17	109.8°	109.5°
C9	C8	O19	107.7°	109.5°
C8	C9	O20	110.9°	109.5°
C8	C9	H18	109.0°	109.5°
C8	C9	H19	109.0°	109.5°
C9	C8	H20	111.5°	109.5°
C8	O19	C10	135.7°	117.0°
O19	C8	H20	108.5°	109.5°
O20	C9	H18	109.0°	109.4°
O20	C9	H19	109.0°	109.5°
C9	O20	C11	127.2°	117.0°
H18	C9	H19	109.9°	109.5°
O19	C10	O21	113.7°	120.0°
O19	C10	C12	128.1°	120.0°
O20	C11	C13	120.5°	120.0°
O20	C11	O22	119.5°	120.0°
O21	C10	C12	118.1°	120.0°
C10	C12	C14	116.2°	109.5°
C10	C12	H21	107.3°	109.5°
C10	C12	H22	107.3°	109.5°
C13	C11	O22	120.0°	120.0°
C11	C13	C15	112.2°	109.5°
C11	C13	H23	108.6°	109.4°
C11	C13	H24	108.5°	109.4°
C14	C12	H21	107.3°	109.5°
C14	C12	H22	107.3°	109.5°
C12	C14	H25	108.3°	109.4°
C12	C14	H26	108.4°	109.5°
C12	C14	C16	112.9°	109.5°
H21	C12	H22	111.6°	109.4°
C15	C13	H23	108.6°	109.5°
C15	C13	H24	108.6°	109.5°
C13	C15	H27	108.3°	109.5°
C13	C15	H28	108.3°	109.5°
C13	C15	C17	113.1°	109.4°
H23	C13	H24	110.4°	109.5°
H25	C14	H26	110.5°	109.5°
H25	C14	C16	108.4°	109.5°
H26	C14	C16	108.4°	109.5°
C14	C16	H29	108.2°	109.5°
C14	C16	C18	113.2°	109.5°
C14	C16	H30	108.3°	109.5°
H27	C15	H28	110.6°	109.5°
H27	C15	C17	108.3°	109.5°
H28	C15	C17	108.2°	109.5°
C15	C17	H31	108.5°	109.4°
C15	C17	H32	108.5°	109.5°
C15	C17	C19	112.5°	109.4°
H29	C16	C18	108.2°	109.5°
H29	C16	H30	110.7°	109.5°
C18	C16	H30	108.2°	109.5°
C16	C18	C20	112.4°	109.5°
C16	C18	H33	108.5°	109.4°
C16	C18	H34	108.5°	109.5°
H31	C17	H32	110.5°	109.5°
H31	C17	C19	108.5°	109.5°
H32	C17	C19	108.5°	109.5°
C17	C19	H35	108.5°	109.5°
C17	C19	C21	112.6°	109.4°
C17	C19	H36	108.4°	109.4°
C20	C18	H33	108.5°	109.4°
C20	C18	H34	108.5°	109.5°
C18	C20	C22	112.3°	109.5°
C18	C20	H37	108.5°	109.4°
C18	C20	H38	108.5°	109.5°
H33	C18	H34	110.4°	109.5°
H35	C19	C21	108.4°	109.5°
H35	C19	H36	110.4°	109.5°
C21	C19	H36	108.5°	109.4°
C19	C21	H39	108.3°	109.5°
C19	C21	H40	108.4°	109.5°
C19	C21	C23	112.8°	109.5°
C22	C20	H37	108.5°	109.5°
C22	C20	H38	108.5°	109.5°
C20	C22	H41	109.3°	109.4°
C20	C22	H42	109.3°	109.5°
C20	C22	C24	110.0°	109.5°
H37	C20	H38	110.4°	109.5°
H39	C21	H40	110.5°	109.5°
H39	C21	C23	108.4°	109.4°
H40	C21	C23	108.4°	109.5°
C21	C23	C25	109.7°	109.5°
C21	C23	H43	109.4°	109.5°
C21	C23	H44	109.4°	109.5°
H41	C22	H42	109.7°	109.5°
H41	C22	C24	109.3°	109.5°
H42	C22	C24	109.3°	109.5°
C22	C24	H45	109.5°	109.5°
C22	C24	H46	109.5°	109.5°
C22	C24	H47	109.5°	109.5°
C25	C23	H43	109.4°	109.4°
C25	C23	H44	109.4°	109.5°
C23	C25	H48	109.5°	109.5°
C23	C25	H49	109.4°	109.5°
C23	C25	H50	109.5°	109.5°
H43	C23	H44	109.5°	109.5°
H45	C24	H46	109.5°	109.5°
H45	C24	H47	109.4°	109.4°
H46	C24	H47	109.5°	109.5°
H48	C25	H49	109.5°	109.5°
H48	C25	H50	109.4°	109.5°
H49	C25	H50	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	C6	118.6°	120.0°
O1	C1	C2	H1	120.1°	120.0°
O1	C1	C6	H1	120.2°	120.0°
O1	C1	C2	O2	50.3°	60.0°
O1	C1	C2	C3	173.9°	180.0°
O1	C1	C2	H2	68.4°	60.0°
O1	C1	C6	C5	178.0°	180.0°
O1	C1	C6	O6	59.7°	60.0°
O1	C1	C6	H6	60.1°	60.0°
C1	O1	P1	O1P	75.2°	55.0°
C1	O1	P1	O2P	46.5°	65.0°
C1	O1	P1	O3P	164.6°	175.0°
C2	C1	C6	H1	117.1°	120.0°
C2	C1	O1	P1	74.9°	120.0°
C1	C2	O2	C3	124.2°	120.0°
C1	C2	O2	H2	118.0°	120.0°
C1	C2	C3	H2	117.9°	120.0°
C1	C2	O2	HO2	180.0°	60.0°
C1	C2	C3	O3	173.8°	180.0°
C1	C2	C3	C4	53.5°	60.0°
C1	C2	C3	H3	65.2°	60.0°
C2	C1	C6	C5	55.3°	60.0°
C2	C1	C6	O6	177.6°	180.0°
C2	C1	C6	H6	62.5°	60.0°
C6	C1	O1	P1	163.5°	120.0°
C6	C1	C2	O2	68.3°	60.0°
C6	C1	C2	C3	55.3°	60.0°
C6	C1	C2	H2	173.0°	180.0°
C1	C6	C5	C4	53.1°	60.0°
C1	C6	C5	O5	172.4°	180.0°
C1	C6	C5	O6	122.2°	120.1°
C1	C6	C5	H6	118.0°	120.0°
C1	C6	C5	H5	65.9°	60.0°
C1	C6	O6	H6	118.1°	120.0°
C1	C6	O6	HO6	134.4°	60.0°
H1	C1	O1	P1	42.1°	0.0°
H1	C1	C2	O2	170.4°	180.0°
H1	C1	C2	C3	66.0°	60.0°
H1	C1	C2	H2	51.7°	60.0°
H1	C1	C6	C5	61.8°	60.0°
H1	C1	C6	O6	60.5°	60.0°
H1	C1	C6	H6	179.6°	180.0°
O1	P1	O1P	O2P	121.8°	120.0°
O1	P1	O1P	O3P	119.0°	120.0°
O1	P1	O2P	O3P	118.0°	120.0°
O1	P1	O2P	HO2P	121.9°	60.0°
O1	P1	O3P	C7	45.2°	175.0°
O2	C2	C3	H2	118.6°	120.0°
O2	C2	C3	O3	50.4°	60.0°
O2	C2	C3	C4	69.9°	60.0°
O2	C2	C3	H3	171.3°	180.0°
C3	C2	O2	HO2	55.9°	179.9°
C2	C3	O3	C4	122.3°	120.0°
C2	C3	O3	H3	118.9°	120.0°
C2	C3	C4	H3	118.8°	120.0°
C2	C3	O3	P3	129.2°	120.0°
C2	C3	C4	O4	170.5°	180.0°
C2	C3	C4	C5	51.3°	60.0°
C2	C3	C4	H4	67.9°	60.0°
H2	C2	O2	HO2	61.9°	60.0°
H2	C2	C3	O3	68.3°	60.0°
H2	C2	C3	C4	171.4°	180.0°
H2	C2	C3	H3	52.7°	59.9°
O3	C3	C4	H3	120.9°	120.0°
O3	C3	C4	O4	69.3°	60.0°
O3	C3	C4	C5	171.5°	180.0°
O3	C3	C4	H4	52.4°	60.0°
C3	O3	P3	O4P	38.3°	55.0°
C3	O3	P3	O5P	82.9°	65.0°
C3	O3	P3	O6P	158.8°	175.0°
C4	C3	O3	P3	108.5°	120.0°
C3	C4	O4	C5	122.3°	120.0°
C3	C4	O4	H4	118.5°	120.0°
C3	C4	C5	H4	118.4°	120.0°
C3	C4	O4	P4	127.6°	120.0°
C3	C4	C5	O5	169.9°	180.0°
C3	C4	C5	C6	50.9°	60.0°
C3	C4	C5	H5	68.5°	60.0°
H3	C3	O3	P3	10.3°	0.0°
H3	C3	C4	O4	51.6°	60.0°
H3	C3	C4	C5	67.5°	60.0°
H3	C3	C4	H4	173.3°	180.0°
O3	P3	O4P	O5P	120.7°	120.0°
O3	P3	O4P	O6P	119.8°	120.0°
O3	P3	O5P	O6P	118.1°	120.0°
O3	P3	O5P	HO5P	122.0°	60.0°
O3	P3	O6P	HO6P	121.4°	180.0°
O4	C4	C5	H4	121.7°	120.0°
O4	C4	C5	O5	70.2°	60.1°
O4	C4	C5	C6	170.8°	180.0°
O4	C4	C5	H5	51.4°	60.0°
C4	O4	P4	O7P	162.1°	175.0°
C4	O4	P4	O8P	79.1°	65.0°
C4	O4	P4	O9P	41.9°	55.0°
C5	C4	O4	P4	110.1°	120.0°
C4	C5	O5	C6	121.5°	120.0°
C4	C5	O5	H5	119.1°	120.0°
C4	C5	C6	H5	119.1°	120.0°
C4	C5	O5	P5	136.7°	120.0°
C4	C5	C6	O6	175.3°	180.0°
C4	C5	C6	H6	64.8°	60.0°
H4	C4	O4	P4	9.1°	0.0°
H4	C4	C5	O5	51.5°	60.0°
H4	C4	C5	C6	67.6°	60.0°
H4	C4	C5	H5	173.1°	180.0°
O4	P4	O7P	O8P	118.7°	120.0°
O4	P4	O7P	O9P	121.2°	120.0°
O4	P4	O8P	O9P	121.7°	120.0°
O4	P4	O7P	HO7P	121.2°	180.0°
O4	P4	O8P	HO8P	121.7°	60.0°
O5	C5	C6	H5	121.6°	120.0°
O5	C5	C6	O6	65.4°	60.0°
O5	C5	C6	H6	54.5°	60.0°
C5	O5	P5	OPF	93.8°	65.0°
C5	O5	P5	OPG	27.6°	55.0°
C5	O5	P5	OPH	148.1°	175.0°
C6	C5	O5	P5	101.7°	120.0°
C5	C6	O6	H6	118.0°	120.0°
C5	C6	O6	HO6	10.5°	180.0°
H5	C5	O5	P5	17.7°	0.0°
H5	C5	C6	O6	56.3°	60.0°
H5	C5	C6	H6	176.1°	180.0°
O5	P5	OPF	OPG	122.2°	120.0°
O5	P5	OPF	OPH	117.8°	120.0°
O5	P5	OPG	OPH	119.7°	120.0°
O5	P5	OPF	HOP1	122.1°	60.0°
O5	P5	OPH	HOP3	121.6°	180.0°
H6	C6	O6	HO6	107.4°	60.0°
O1P	P1	O2P	O3P	120.1°	120.1°
O1P	P1	O2P	HO2P	0.0°	180.0°
O1P	P1	O3P	C7	75.2°	55.0°
O2P	P1	O3P	C7	164.6°	65.0°
O3P	P1	O2P	HO2P	120.1°	60.0°
P1	O3P	C7	C8	173.0°	180.0°
P1	O3P	C7	H16	53.0°	60.0°
P1	O3P	C7	H17	67.0°	60.0°
O3P	C7	C8	H16	120.0°	120.0°
O3P	C7	C8	H17	120.0°	119.9°
O3P	C7	H16	H17	119.6°	120.0°
O3P	C7	C8	C9	166.9°	175.0°
O3P	C7	C8	O19	72.4°	65.0°
O3P	C7	C8	H20	46.2°	55.0°
O4P	P3	O5P	O6P	119.9°	120.0°
O4P	P3	O5P	HO5P	0.0°	180.0°
O4P	P3	O6P	HO6P	0.0°	60.0°
O5P	P3	O6P	HO6P	120.1°	60.0°
O6P	P3	O5P	HO5P	119.9°	60.0°
O7P	P4	O8P	O9P	119.9°	120.0°
O7P	P4	O8P	HO8P	119.9°	60.0°
O8P	P4	O7P	HO7P	120.1°	60.0°
O9P	P4	O7P	HO7P	0.0°	60.0°
O9P	P4	O8P	HO8P	0.0°	180.0°
OPF	P5	OPG	OPH	119.5°	120.0°
OPF	P5	OPH	HOP3	120.2°	60.0°
OPG	P5	OPF	HOP1	0.0°	180.0°
OPG	P5	OPH	HOP3	0.0°	59.9°
OPH	P5	OPF	HOP1	120.0°	60.0°
C8	C7	H16	H17	119.7°	120.0°
C7	C8	C9	O19	123.8°	120.0°
C7	C8	C9	H20	117.2°	120.0°
C7	C8	O19	H20	117.1°	120.0°
C7	C8	C9	O20	175.5°	175.0°
C7	C8	C9	H18	64.5°	55.0°
C7	C8	C9	H19	55.5°	65.0°
C7	C8	O19	C10	85.5°	150.0°
H16	C7	C8	C9	46.9°	55.0°
H16	C7	C8	O19	167.6°	175.0°
H16	C7	C8	H20	73.7°	65.0°
H17	C7	C8	C9	73.1°	65.1°
H17	C7	C8	O19	47.6°	55.0°
H17	C7	C8	H20	166.2°	174.9°
C9	C8	O19	H20	120.8°	120.0°
C8	C9	O20	H18	120.0°	120.0°
C8	C9	O20	H19	120.0°	120.0°
C8	C9	H18	H19	119.4°	120.0°
C9	C8	O19	C10	152.4°	90.0°
C8	C9	O20	C11	172.6°	180.0°
O19	C8	C9	O20	51.7°	65.0°
O19	C8	C9	H18	171.7°	175.0°
O19	C8	C9	H19	68.4°	55.0°
C8	O19	C10	O21	171.2°	0.0°
C8	O19	C10	C12	11.6°	180.0°
O20	C9	H18	H19	119.4°	120.0°
C9	O20	C11	C13	118.0°	180.0°
C9	O20	C11	O22	64.2°	0.0°
O20	C9	C8	H20	67.3°	55.0°
H18	C9	O20	C11	52.6°	60.0°
H18	C9	C8	H20	52.7°	65.0°
H19	C9	O20	C11	67.4°	60.0°
H19	C9	C8	H20	172.7°	175.0°
O19	C10	O21	C12	177.6°	180.0°
C10	O19	C8	H20	31.6°	30.0°
O19	C10	C12	C14	68.6°	180.0°
O19	C10	C12	H21	171.4°	60.0°
O19	C10	C12	H22	51.4°	60.0°
O20	C11	C13	O22	177.8°	180.0°
O20	C11	C13	C15	78.7°	180.0°
O20	C11	C13	H23	41.3°	60.0°
O20	C11	C13	H24	161.3°	60.0°
O21	C10	C12	C14	114.2°	0.0°
O21	C10	C12	H21	5.7°	120.0°
O21	C10	C12	H22	125.8°	120.0°
C10	C12	C14	H21	120.0°	120.0°
C10	C12	C14	H22	120.0°	120.1°
C10	C12	H21	H22	117.2°	120.0°
C10	C12	C14	H25	18.0°	60.0°
C10	C12	C14	H26	101.9°	60.0°
C10	C12	C14	C16	138.0°	180.0°
C11	C13	C15	H23	120.0°	120.0°
C11	C13	C15	H24	120.0°	120.0°
C11	C13	H23	H24	118.8°	119.9°
C11	C13	C15	H27	57.5°	60.0°
C11	C13	C15	H28	62.5°	60.0°
C11	C13	C15	C17	177.6°	180.0°
O22	C11	C13	C15	103.5°	0.0°
O22	C11	C13	H23	136.5°	120.0°
O22	C11	C13	H24	16.5°	120.0°
C14	C12	H21	H22	117.3°	120.0°
C12	C14	H25	H26	118.6°	120.0°
C12	C14	H25	C16	122.8°	119.9°
C12	C14	H26	C16	122.8°	120.0°
C12	C14	C16	H29	65.0°	60.0°
C12	C14	C16	C18	175.0°	180.0°
C12	C14	C16	H30	55.0°	60.0°
H21	C12	C14	H25	138.0°	180.0°
H21	C12	C14	H26	18.0°	60.0°
H21	C12	C14	C16	102.0°	60.0°
H22	C12	C14	H25	102.0°	60.0°
H22	C12	C14	H26	138.1°	180.0°
H22	C12	C14	C16	18.1°	59.9°
C15	C13	H23	H24	118.9°	120.1°
C13	C15	H27	H28	118.5°	120.0°
C13	C15	H27	C17	123.0°	120.0°
C13	C15	H28	C17	123.0°	120.0°
C13	C15	C17	H31	62.9°	60.0°
C13	C15	C17	H32	57.1°	60.0°
C13	C15	C17	C19	177.1°	180.0°
H23	C13	C15	H27	177.5°	180.0°
H23	C13	C15	H28	57.5°	60.0°
H23	C13	C15	C17	62.4°	60.0°
H24	C13	C15	H27	62.4°	60.0°
H24	C13	C15	H28	177.6°	180.0°
H24	C13	C15	C17	57.6°	60.0°
H25	C14	H26	C16	118.6°	120.0°
H25	C14	C16	H29	175.0°	59.9°
H25	C14	C16	C18	55.0°	60.1°
H25	C14	C16	H30	65.0°	180.0°
H26	C14	C16	H29	55.0°	180.0°
H26	C14	C16	C18	65.0°	60.0°
H26	C14	C16	H30	175.0°	60.0°
C14	C16	H29	C18	123.1°	120.0°
C14	C16	H29	H30	118.5°	120.0°
C14	C16	C18	H30	120.0°	120.0°
C14	C16	C18	C20	179.9°	180.0°
C14	C16	C18	H33	60.1°	60.1°
C14	C16	C18	H34	59.9°	59.9°
H27	C15	H28	C17	118.5°	120.1°
H27	C15	C17	H31	177.0°	180.0°
H27	C15	C17	H32	62.9°	60.0°
H27	C15	C17	C19	57.1°	60.0°
H28	C15	C17	H31	57.1°	59.9°
H28	C15	C17	H32	177.1°	180.0°
H28	C15	C17	C19	62.9°	60.0°
C15	C17	H31	H32	118.8°	120.0°
C15	C17	H31	C19	122.5°	119.9°
C15	C17	H32	C19	122.5°	120.0°
C15	C17	C19	H35	62.1°	60.0°
C15	C17	C19	C21	177.9°	180.0°
C15	C17	C19	H36	57.9°	60.1°
H29	C16	C18	H30	120.0°	120.0°
H29	C16	C18	C20	59.9°	60.0°
H29	C16	C18	H33	179.9°	60.0°
H29	C16	C18	H34	60.1°	180.0°
C16	C18	C20	H33	120.0°	119.9°
C16	C18	C20	H34	120.0°	120.1°
C16	C18	H33	H34	118.8°	120.0°
C16	C18	C20	C22	174.7°	180.0°
C16	C18	C20	H37	65.3°	60.0°
C16	C18	C20	H38	54.7°	60.0°
H30	C16	C18	C20	60.1°	60.0°
H30	C16	C18	H33	59.9°	180.0°
H30	C16	C18	H34	179.9°	60.0°
H31	C17	H32	C19	118.7°	120.0°
H31	C17	C19	H35	177.9°	59.9°
H31	C17	C19	C21	57.9°	60.1°
H31	C17	C19	H36	62.1°	180.0°
H32	C17	C19	H35	57.9°	180.0°
H32	C17	C19	C21	62.1°	60.0°
H32	C17	C19	H36	177.9°	59.9°
C17	C19	H35	C21	122.5°	120.0°
C17	C19	H35	H36	118.7°	120.0°
C17	C19	C21	H36	120.0°	119.9°
C17	C19	C21	H39	60.8°	60.0°
C17	C19	C21	H40	59.2°	60.0°
C17	C19	C21	C23	179.2°	180.0°
C20	C18	H33	H34	118.8°	120.0°
C18	C20	C22	H37	120.0°	120.0°
C18	C20	C22	H38	120.0°	120.0°
C18	C20	H37	H38	118.9°	120.0°
C18	C20	C22	H41	57.9°	60.1°
C18	C20	C22	H42	177.9°	60.0°
C18	C20	C22	C24	62.1°	180.0°
H33	C18	C20	C22	54.7°	60.1°
H33	C18	C20	H37	174.7°	180.0°
H33	C18	C20	H38	65.3°	60.0°
H34	C18	C20	C22	65.3°	59.9°
H34	C18	C20	H37	54.7°	60.1°
H34	C18	C20	H38	174.7°	179.9°
H35	C19	C21	H36	120.0°	120.1°
H35	C19	C21	H39	179.2°	60.0°
H35	C19	C21	H40	60.8°	180.0°
H35	C19	C21	C23	59.2°	60.0°
C19	C21	H39	H40	118.6°	120.0°
C19	C21	H39	C23	122.8°	120.0°
C19	C21	H40	C23	122.8°	120.0°
C19	C21	C23	C25	179.0°	180.0°
C19	C21	C23	H43	61.0°	60.0°
C19	C21	C23	H44	59.0°	60.0°
H36	C19	C21	H39	59.2°	179.9°
H36	C19	C21	H40	179.2°	59.9°
H36	C19	C21	C23	60.8°	60.1°
C22	C20	H37	H38	118.8°	120.0°
C20	C22	H41	H42	119.8°	120.0°
C20	C22	H41	C24	120.5°	119.9°
C20	C22	H42	C24	120.5°	120.0°
C20	C22	C24	H45	180.0°	180.0°
C20	C22	C24	H46	60.0°	60.0°
C20	C22	C24	H47	60.0°	60.0°
H37	C20	C22	H41	62.1°	180.0°
H37	C20	C22	H42	57.9°	60.0°
H37	C20	C22	C24	177.9°	60.0°
H38	C20	C22	H41	177.9°	60.0°
H38	C20	C22	H42	62.1°	180.0°
H38	C20	C22	C24	57.9°	60.0°
H39	C21	H40	C23	118.6°	120.0°
H39	C21	C23	C25	59.0°	60.0°
H39	C21	C23	H43	179.0°	180.0°
H39	C21	C23	H44	61.0°	60.0°
H40	C21	C23	C25	61.0°	60.0°
H40	C21	C23	H43	59.0°	60.0°
H40	C21	C23	H44	179.0°	180.0°
C21	C23	C25	H43	120.0°	120.0°
C21	C23	C25	H44	120.0°	120.0°
C21	C23	H43	H44	119.9°	120.0°
C21	C23	C25	H48	180.0°	60.0°
C21	C23	C25	H49	60.0°	60.0°
C21	C23	C25	H50	60.0°	180.0°
H41	C22	H42	C24	119.8°	120.0°
H41	C22	C24	H45	60.0°	60.0°
H41	C22	C24	H46	180.0°	180.0°
H41	C22	C24	H47	60.0°	59.9°
H42	C22	C24	H45	60.0°	60.0°
H42	C22	C24	H46	60.0°	60.0°
H42	C22	C24	H47	180.0°	180.0°
C22	C24	H45	H46	120.0°	120.0°
C22	C24	H45	H47	120.0°	120.0°
C22	C24	H46	H47	120.0°	120.0°
C25	C23	H43	H44	119.9°	120.0°
C23	C25	H48	H49	120.0°	120.0°
C23	C25	H48	H50	120.0°	120.1°
C23	C25	H49	H50	120.0°	120.0°
H43	C23	C25	H48	60.0°	180.0°
H43	C23	C25	H49	180.0°	60.0°
H43	C23	C25	H50	60.0°	60.0°
H44	C23	C25	H48	60.0°	60.0°
H44	C23	C25	H49	60.0°	180.0°
H44	C23	C25	H50	180.0°	60.0°
H45	C24	H46	H47	120.0°	120.0°
H48	C25	H49	H50	120.0°	120.0°

Definition date:	2010-07-28
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Replaces:	ITS
Derived from:	3MDB