Obsolete: F22

F22 was replaced with HXA on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	O1	sing	1.34Å	1.26Å
C1	O2	doub	1.21Å	1.25Å
C1	C2	sing	1.51Å	1.52Å
C2	C3	sing	1.53Å	1.54Å
C3	C4	sing	1.51Å	1.38Å
C4	C5	doub	1.31Å	1.39Å
C5	C6	sing	1.51Å	1.40Å
C6	C7	sing	1.51Å	1.39Å
C7	C8	doub	1.31Å	1.39Å
C8	C9	sing	1.51Å	1.39Å
C9	C10	sing	1.51Å	1.39Å
C10	C11	doub	1.31Å	1.39Å
C11	C12	sing	1.51Å	1.39Å
C12	C13	sing	1.51Å	1.40Å
C13	C14	doub	1.31Å	1.38Å
C14	C15	sing	1.51Å	1.40Å
C15	C16	sing	1.51Å	1.38Å
C16	C17	doub	1.31Å	1.40Å
C17	C18	sing	1.51Å	1.38Å
C18	C19	sing	1.51Å	1.40Å
C19	C20	doub	1.31Å	1.38Å
C20	C21	sing	1.51Å	1.39Å
C21	C22	sing	1.53Å	1.53Å
O1	H1	sing	0.97Å	0.95Å
C2	H2C1	sing	1.09Å	1.10Å
C2	H2C2	sing	1.09Å	1.10Å
C3	H3C1	sing	1.09Å	1.10Å
C3	H3C2	sing	1.09Å	1.10Å
C4	H4	sing	1.08Å	1.08Å
C5	H5	sing	1.08Å	1.08Å
C6	H6C1	sing	1.09Å	1.10Å
C6	H6C2	sing	1.09Å	1.10Å
C7	H7	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C9	H9C1	sing	1.09Å	1.10Å
C9	H9C2	sing	1.09Å	1.10Å
C10	H10	sing	1.08Å	1.08Å
C11	H11	sing	1.08Å	1.08Å
C12	H121	sing	1.09Å	1.10Å
C12	H122	sing	1.09Å	1.10Å
C13	H13	sing	1.08Å	1.08Å
C14	H14	sing	1.08Å	1.08Å
C15	H15	sing	1.09Å	1.10Å
C16	H16	sing	1.08Å	1.08Å
C17	H171	sing	1.08Å	1.08Å
C15	H172	sing	1.09Å	1.10Å
C18	H181	sing	1.09Å	1.10Å
C18	H182	sing	1.09Å	1.10Å
C19	H19	sing	1.08Å	1.08Å
C20	H20	sing	1.08Å	1.08Å
C21	H211	sing	1.09Å	1.10Å
C21	H212	sing	1.09Å	1.10Å
C22	H221	sing	1.09Å	1.10Å
C22	H222	sing	1.09Å	1.10Å
C22	H223	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	O2	125.6°	120.0°
O1	C1	C2	116.8°	120.0°
C1	O1	H1	109.5°	117.0°
O2	C1	C2	117.6°	120.0°
C1	C2	C3	112.0°	109.5°
C1	C2	H2C1	108.6°	109.4°
C1	C2	H2C2	108.0°	109.5°
C2	C3	C4	111.1°	109.5°
C3	C2	H2C1	108.6°	109.5°
C3	C2	H2C2	108.0°	109.5°
C2	C3	H3C1	108.9°	109.5°
C2	C3	H3C2	108.6°	109.5°
C3	C4	C5	121.3°	120.0°
C4	C3	H3C1	108.9°	109.5°
C4	C3	H3C2	108.5°	109.5°
C3	C4	H4	119.4°	120.0°
C4	C5	C6	120.6°	120.0°
C5	C4	H4	119.3°	120.0°
C4	C5	H5	119.7°	120.0°
C5	C6	C7	109.3°	109.5°
C6	C5	H5	119.7°	120.0°
C5	C6	H6C1	109.6°	109.5°
C5	C6	H6C2	109.6°	109.5°
C6	C7	C8	120.6°	120.0°
C7	C6	H6C1	109.5°	109.5°
C7	C6	H6C2	109.6°	109.4°
C6	C7	H7	119.7°	120.0°
C7	C8	C9	120.2°	120.0°
C8	C7	H7	119.7°	120.0°
C7	C8	H8	119.9°	120.0°
C8	C9	C10	109.9°	109.5°
C9	C8	H8	119.9°	120.0°
C8	C9	H9C1	109.3°	109.5°
C8	C9	H9C2	109.2°	109.5°
C9	C10	C11	120.9°	120.0°
C10	C9	H9C1	109.3°	109.5°
C10	C9	H9C2	109.2°	109.4°
C9	C10	H10	119.5°	120.0°
C10	C11	C12	120.5°	120.0°
C11	C10	H10	119.5°	120.0°
C10	C11	H11	119.7°	120.0°
C11	C12	C13	109.6°	109.5°
C12	C11	H11	119.8°	120.0°
C11	C12	H121	109.4°	109.4°
C11	C12	H122	109.4°	109.5°
C12	C13	C14	121.1°	120.0°
C13	C12	H121	109.4°	109.5°
C13	C12	H122	109.4°	109.5°
C12	C13	H13	119.4°	120.0°
C13	C14	C15	120.8°	120.0°
C14	C13	H13	119.5°	120.0°
C13	C14	H14	119.6°	120.0°
C14	C15	C16	109.5°	109.4°
C15	C14	H14	119.6°	120.0°
C14	C15	H15	109.5°	109.4°
C14	C15	H172	109.5°	109.4°
C15	C16	C17	119.8°	120.0°
C16	C15	H15	109.5°	109.5°
C15	C16	H16	120.1°	120.0°
C16	C15	H172	109.5°	109.5°
C16	C17	C18	119.2°	120.0°
C17	C16	H16	120.1°	120.0°
C16	C17	H171	120.4°	120.0°
C17	C18	C19	109.5°	109.5°
C18	C17	H171	120.4°	120.0°
C17	C18	H181	109.5°	109.4°
C17	C18	H182	109.4°	109.5°
C18	C19	C20	120.6°	120.0°
C19	C18	H181	109.4°	109.4°
C19	C18	H182	109.4°	109.5°
C18	C19	H19	119.7°	120.0°
C19	C20	C21	120.9°	120.0°
C20	C19	H19	119.7°	120.0°
C19	C20	H20	119.6°	120.0°
C20	C21	C22	110.8°	109.5°
C21	C20	H20	119.6°	120.0°
C20	C21	H211	109.0°	109.5°
C20	C21	H212	108.7°	109.5°
C22	C21	H211	109.0°	109.5°
C22	C21	H212	108.7°	109.5°
C21	C22	H221	109.5°	109.5°
C21	C22	H222	109.5°	109.5°
C21	C22	H223	109.5°	109.5°
H2C1	C2	H2C2	111.5°	109.5°
H3C1	C3	H3C2	110.8°	109.5°
H6C1	C6	H6C2	109.3°	109.5°
H9C1	C9	H9C2	109.9°	109.4°
H121	C12	H122	109.6°	109.5°
H15	C15	H172	109.5°	109.5°
H181	C18	H182	109.5°	109.5°
H211	C21	H212	110.5°	109.4°
H221	C22	H222	109.5°	109.4°
H221	C22	H223	109.4°	109.5°
H222	C22	H223	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	O2	C2	179.6°	179.7°
O1	C1	C2	C3	126.7°	180.0°
O1	C1	C2	H2C1	113.3°	60.0°
O1	C1	C2	H2C2	7.8°	60.0°
O2	C1	C2	C3	53.6°	0.3°
O2	C1	O1	H1	0.0°	0.1°
O2	C1	C2	H2C1	66.4°	119.7°
O2	C1	C2	H2C2	172.5°	120.3°
C1	C2	C3	H2C1	120.0°	120.0°
C1	C2	C3	H2C2	118.9°	120.0°
C1	C2	C3	C4	173.8°	180.0°
C2	C1	O1	H1	179.6°	179.7°
C1	C2	H2C1	H2C2	119.0°	120.0°
C1	C2	C3	H3C1	53.8°	60.0°
C1	C2	C3	H3C2	66.9°	60.0°
C2	C3	C4	H3C1	120.0°	120.0°
C2	C3	C4	H3C2	119.3°	120.0°
C2	C3	C4	C5	103.9°	127.8°
C3	C2	H2C1	H2C2	118.9°	120.0°
C2	C3	H3C1	H3C2	119.3°	120.0°
C2	C3	C4	H4	76.1°	52.3°
C3	C4	C5	H4	180.0°	179.9°
C3	C4	C5	C6	0.7°	7.1°
C4	C3	C2	H2C1	66.2°	60.0°
C4	C3	C2	H2C2	54.9°	60.0°
C4	C3	H3C1	H3C2	119.3°	120.0°
C3	C4	C5	H5	179.3°	172.8°
C4	C5	C6	H5	180.0°	180.0°
C4	C5	C6	C7	125.9°	126.5°
C5	C4	C3	H3C1	136.0°	7.8°
C5	C4	C3	H3C2	15.4°	112.2°
C4	C5	C6	H6C1	5.9°	113.5°
C4	C5	C6	H6C2	114.1°	6.5°
C5	C6	C7	H6C1	120.0°	120.0°
C5	C6	C7	H6C2	120.1°	120.0°
C5	C6	C7	C8	86.2°	127.8°
C6	C5	C4	H4	179.3°	172.8°
C5	C6	H6C1	H6C2	120.1°	120.1°
C5	C6	C7	H7	93.8°	52.2°
C6	C7	C8	H7	180.0°	179.9°
C6	C7	C8	C9	1.2°	7.2°
C7	C6	C5	H5	54.1°	53.5°
C7	C6	H6C1	H6C2	120.1°	119.9°
C6	C7	C8	H8	178.8°	172.8°
C7	C8	C9	H8	180.0°	180.0°
C7	C8	C9	C10	119.1°	126.5°
C8	C7	C6	H6C1	153.8°	7.7°
C8	C7	C6	H6C2	33.9°	112.2°
C7	C8	C9	H9C1	120.9°	113.5°
C7	C8	C9	H9C2	0.7°	6.5°
C8	C9	C10	H9C1	120.0°	120.0°
C8	C9	C10	H9C2	119.8°	120.0°
C8	C9	C10	C11	119.1°	126.9°
C9	C8	C7	H7	178.8°	172.9°
C8	C9	H9C1	H9C2	119.8°	120.0°
C8	C9	C10	H10	60.9°	53.1°
C9	C10	C11	H10	180.0°	180.0°
C9	C10	C11	C12	1.2°	7.7°
C10	C9	C8	H8	60.9°	53.5°
C10	C9	H9C1	H9C2	119.8°	120.0°
C9	C10	C11	H11	178.8°	172.3°
C10	C11	C12	H11	180.0°	180.0°
C10	C11	C12	C13	91.9°	126.9°
C11	C10	C9	H9C1	0.9°	6.9°
C11	C10	C9	H9C2	121.1°	113.1°
C10	C11	C12	H121	28.1°	113.1°
C10	C11	C12	H122	148.2°	6.9°
C11	C12	C13	H121	120.0°	120.0°
C11	C12	C13	H122	119.9°	120.0°
C11	C12	C13	C14	154.0°	126.4°
C12	C11	C10	H10	178.8°	172.3°
C11	C12	H121	H122	119.9°	120.0°
C11	C12	C13	H13	26.0°	53.5°
C12	C13	C14	H13	180.0°	180.0°
C12	C13	C14	C15	0.2°	7.2°
C13	C12	C11	H11	88.1°	53.1°
C13	C12	H121	H122	120.0°	120.0°
C12	C13	C14	H14	179.8°	172.8°
C13	C14	C15	H14	180.0°	179.9°
C13	C14	C15	C16	126.7°	127.7°
C14	C13	C12	H121	34.1°	6.5°
C14	C13	C12	H122	86.0°	113.5°
C13	C14	C15	H15	113.3°	112.3°
C13	C14	C15	H172	6.7°	7.7°
C14	C15	C16	H15	120.0°	120.0°
C14	C15	C16	H172	120.0°	120.0°
C14	C15	C16	C17	140.7°	123.4°
C15	C14	C13	H13	179.8°	172.8°
C14	C15	H15	H172	120.0°	120.0°
C14	C15	C16	H16	39.3°	56.6°
C15	C16	C17	H16	180.0°	179.9°
C15	C16	C17	C18	0.7°	8.0°
C16	C15	C14	H14	53.3°	52.2°
C16	C15	H15	H172	120.0°	120.1°
C15	C16	C17	H171	179.3°	172.0°
C16	C17	C18	H171	180.0°	180.0°
C16	C17	C18	C19	158.6°	119.7°
C17	C16	C15	H15	99.3°	3.5°
C17	C16	C15	H172	20.7°	116.6°
C16	C17	C18	H181	81.4°	120.4°
C16	C17	C18	H182	38.7°	0.4°
C17	C18	C19	H181	120.0°	119.9°
C17	C18	C19	H182	120.0°	120.0°
C17	C18	C19	C20	137.5°	127.8°
C18	C17	C16	H16	179.3°	172.1°
C17	C18	H181	H182	120.0°	120.0°
C17	C18	C19	H19	42.4°	52.3°
C18	C19	C20	H19	180.0°	179.9°
C18	C19	C20	C21	0.6°	7.2°
C19	C18	C17	H171	21.4°	60.2°
C19	C18	H181	H182	120.0°	120.1°
C18	C19	C20	H20	179.4°	172.8°
C19	C20	C21	H20	180.0°	180.0°
C19	C20	C21	C22	110.1°	126.5°
C20	C19	C18	H181	102.4°	7.9°
C20	C19	C18	H182	17.6°	112.2°
C19	C20	C21	H211	129.9°	113.5°
C19	C20	C21	H212	9.4°	6.5°
C20	C21	C22	H211	120.0°	120.0°
C20	C21	C22	H212	119.4°	120.1°
C21	C20	C19	H19	179.4°	172.8°
C20	C21	H211	H212	119.4°	120.0°
C20	C21	C22	H221	42.4°	180.0°
C20	C21	C22	H222	162.4°	60.0°
C20	C21	C22	H223	77.6°	59.9°
C22	C21	C20	H20	69.9°	53.5°
C22	C21	H211	H212	119.5°	120.0°
C21	C22	H221	H222	120.0°	120.0°
C21	C22	H221	H223	120.0°	120.1°
C21	C22	H222	H223	120.0°	120.0°
H2C1	C2	C3	H3C1	173.8°	180.0°
H2C1	C2	C3	H3C2	53.1°	60.0°
H2C2	C2	C3	H3C1	65.1°	60.0°
H2C2	C2	C3	H3C2	174.2°	180.0°
H3C1	C3	C4	H4	44.0°	172.3°
H3C2	C3	C4	H4	164.6°	67.7°
H4	C4	C5	H5	0.7°	7.2°
H5	C5	C6	H6C1	174.1°	66.5°
H5	C5	C6	H6C2	65.9°	173.5°
H6C1	C6	C7	H7	26.2°	172.2°
H6C2	C6	C7	H7	146.2°	67.8°
H7	C7	C8	H8	1.2°	7.1°
H8	C8	C9	H9C1	59.1°	66.5°
H8	C8	C9	H9C2	179.3°	173.5°
H9C1	C9	C10	H10	179.1°	173.1°
H9C2	C9	C10	H10	58.9°	66.9°
H10	C10	C11	H11	1.2°	7.7°
H11	C11	C12	H121	151.9°	66.9°
H11	C11	C12	H122	31.9°	173.1°
H121	C12	C13	H13	145.9°	173.5°
H122	C12	C13	H13	94.0°	66.5°
H13	C13	C14	H14	0.2°	7.1°
H14	C14	C15	H15	66.7°	67.8°
H14	C14	C15	H172	173.3°	172.2°
H15	C15	C16	H16	80.7°	176.6°
H16	C16	C17	H171	0.7°	8.0°
H16	C16	C15	H172	159.3°	63.4°
H171	C17	C18	H181	98.6°	59.7°
H171	C17	C18	H182	141.4°	179.7°
H181	C18	C19	H19	77.6°	172.2°
H182	C18	C19	H19	162.4°	67.8°
H19	C19	C20	H20	0.6°	7.2°
H20	C20	C21	H211	50.1°	66.5°
H20	C20	C21	H212	170.6°	173.5°
H211	C21	C22	H221	77.6°	60.0°
H211	C21	C22	H222	42.4°	NaN°
H211	C21	C22	H223	162.4°	60.1°
H212	C21	C22	H221	161.8°	59.9°
H212	C21	C22	H222	78.2°	60.1°
H212	C21	C22	H223	41.8°	180.0°
H221	C22	H222	H223	120.0°	120.0°

Definition date:	2008-06-02
Last modified:	2008-10-14
Release status:	OBS
Processing site:	EBI
Replaced by:	HXA
Derived from:	2VV0