W9C

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O14	C5	sing	1.22Å	1.20Å
C5	O15	doub	1.22Å	1.20Å
C5	C1	sing	1.51Å	1.57Å
C1	C4	sing	1.56Å	1.59Å
C1	C3	sing	1.57Å	1.64Å
C1	C2	sing	1.56Å	1.59Å
C4	C12	sing	1.55Å	1.55Å
C4	C13	sing	1.53Å	1.55Å
C4	H4	sing	1.10Å	1.10Å
C12	C6	sing	1.57Å	1.54Å
C12	H121	sing	1.08Å	1.10Å
C12	H122	sing	1.09Å	1.10Å
C6	C10	sing	1.56Å	1.54Å
C6	C2	sing	1.56Å	1.57Å
C6	H6	sing	1.08Å	1.10Å
C10	C3	sing	1.56Å	1.55Å
C10	H101	sing	1.08Å	1.10Å
C10	H102	sing	1.10Å	1.10Å
C3	C11	sing	1.52Å	1.54Å
C3	C9	sing	1.52Å	1.58Å
C11	O19	doub	1.21Å	1.20Å
C11	H11	sing	1.08Å	1.08Å
C9	C18	sing	1.54Å	1.52Å
C9	C16	sing	1.55Å	1.54Å
C9	H9	sing	1.10Å	1.10Å
C18	C24	sing	1.56Å	1.54Å
C18	H181	sing	1.09Å	1.10Å
C18	H182	sing	1.09Å	1.10Å
C24	C22	sing	1.55Å	1.55Å
C24	H241	sing	1.09Å	1.10Å
C24	H242	sing	1.09Å	1.10Å
C22	C25	sing	1.53Å	1.52Å
C22	C16	sing	1.53Å	1.54Å
C22	H22	sing	1.09Å	1.10Å
C25	H251	sing	1.09Å	1.10Å
C25	H252	sing	1.09Å	1.10Å
C25	H253	sing	1.09Å	1.10Å
C16	C7	sing	1.50Å	1.53Å
C16	H16	sing	1.09Å	1.10Å
C7	C2	sing	1.52Å	1.54Å
C7	H71	sing	1.09Å	1.10Å
C7	H72	sing	1.09Å	1.10Å
C2	C8	sing	1.53Å	1.55Å
C8	O17	sing	1.43Å	1.44Å
C8	H81	sing	1.09Å	1.10Å
C8	H82	sing	1.09Å	1.10Å
O17	C52	sing	1.43Å	1.40Å
C52	O56	sing	1.43Å	1.42Å
C52	C53	sing	1.53Å	1.53Å
C52	H52	sing	1.09Å	1.10Å
O56	C56	sing	1.43Å	1.45Å
C56	C61	sing	1.53Å	1.51Å
C56	C55	sing	1.53Å	1.54Å
C56	H56	sing	1.09Å	1.10Å
C61	H611	sing	1.09Å	1.10Å
C61	H612	sing	1.09Å	1.10Å
C61	H613	sing	1.09Å	1.10Å
C55	O64	sing	1.43Å	1.43Å
C55	C54	sing	1.53Å	1.54Å
C55	H55	sing	1.09Å	1.10Å
O64	C65	sing	1.43Å	1.43Å
C65	H651	sing	1.09Å	1.10Å
C65	H652	sing	1.09Å	1.10Å
C65	H653	sing	1.09Å	1.10Å
C54	O60	sing	1.43Å	1.43Å
C54	C53	sing	1.53Å	1.54Å
C54	H54	sing	1.09Å	1.10Å
O60	H60	sing	0.97Å	0.95Å
C53	O57	sing	1.43Å	1.43Å
C53	H53	sing	1.09Å	1.10Å
O57	H57	sing	0.97Å	0.95Å
C13	C20	sing	1.53Å	1.53Å
C13	C21	sing	1.53Å	1.53Å
C13	H13	sing	1.09Å	1.10Å
C20	H201	sing	1.09Å	1.10Å
C20	H202	sing	1.09Å	1.10Å
C20	H203	sing	1.09Å	1.10Å
C21	H211	sing	1.09Å	1.10Å
C21	H212	sing	1.09Å	1.10Å
C21	H213	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O14	C5	O15	120.0°	120.0°
O14	C5	C1	120.7°	120.0°
O15	C5	C1	119.3°	120.0°
C5	C1	C4	115.2°	114.9°
C5	C1	C3	115.1°	116.4°
C5	C1	C2	115.7°	116.6°
C4	C1	C3	105.8°	104.1°
C4	C1	C2	103.7°	101.8°
C1	C4	C12	102.7°	105.3°
C1	C4	C13	115.9°	111.8°
C1	C4	H4	106.8°	111.3°
C3	C1	C2	99.5°	100.9°
C1	C3	C10	101.3°	101.1°
C1	C3	C11	116.8°	114.2°
C1	C3	C9	106.8°	107.2°
C1	C2	C6	90.3°	95.7°
C1	C2	C7	111.9°	113.4°
C1	C2	C8	117.5°	113.5°
C12	C4	C13	116.2°	111.9°
C12	C4	H4	107.3°	108.7°
C4	C12	C6	102.2°	102.3°
C4	C12	H121	111.3°	112.2°
C4	C12	H122	111.3°	110.1°
C13	C4	H4	107.3°	107.9°
C4	C13	C20	112.3°	109.4°
C4	C13	C21	115.6°	109.4°
C4	C13	H13	106.7°	109.5°
C6	C12	H121	111.3°	112.1°
C6	C12	H122	111.3°	109.6°
C12	C6	C10	106.0°	101.6°
C12	C6	C2	101.8°	98.8°
C12	C6	H6	113.2°	116.2°
H121	C12	H122	109.5°	110.2°
C10	C6	C2	108.9°	104.2°
C10	C6	H6	113.3°	116.5°
C6	C10	C3	102.5°	105.6°
C6	C10	H101	111.2°	112.7°
C6	C10	H102	111.2°	108.7°
C2	C6	H6	112.8°	117.0°
C6	C2	C7	118.2°	112.4°
C6	C2	C8	114.7°	112.5°
C3	C10	H101	111.2°	112.7°
C3	C10	H102	111.2°	108.7°
C10	C3	C11	110.8°	113.6°
C10	C3	C9	113.4°	107.4°
H101	C10	H102	109.4°	108.2°
C11	C3	C9	107.8°	112.5°
C3	C11	O19	123.7°	120.0°
C3	C11	H11	118.1°	120.0°
C3	C9	C18	121.9°	115.9°
C3	C9	C16	111.0°	107.7°
C3	C9	H9	107.1°	112.0°
O19	C11	H11	118.1°	120.0°
C18	C9	C16	101.0°	99.6°
C18	C9	H9	107.6°	109.2°
C9	C18	C24	103.3°	100.9°
C9	C18	H181	111.0°	110.9°
C9	C18	H182	111.0°	110.8°
C16	C9	H9	107.5°	111.8°
C9	C16	C22	101.9°	102.8°
C9	C16	C7	112.0°	107.3°
C9	C16	H16	106.7°	111.2°
C24	C18	H181	111.0°	111.0°
C24	C18	H182	111.0°	110.7°
C18	C24	C22	107.2°	105.4°
C18	C24	H241	110.0°	110.1°
C18	C24	H242	110.0°	110.3°
H181	C18	H182	109.5°	111.9°
C22	C24	H241	110.0°	110.0°
C22	C24	H242	110.1°	110.2°
C24	C22	C25	113.1°	110.2°
C24	C22	C16	102.3°	105.0°
C24	C22	H22	108.1°	109.8°
H241	C24	H242	109.4°	110.7°
C25	C22	C16	116.3°	111.7°
C25	C22	H22	108.5°	110.3°
C22	C25	H251	109.5°	109.5°
C22	C25	H252	109.4°	109.5°
C22	C25	H253	109.5°	109.5°
C16	C22	H22	108.2°	109.7°
C22	C16	C7	121.7°	119.7°
C22	C16	H16	106.7°	106.6°
H251	C25	H252	109.5°	109.5°
H251	C25	H253	109.4°	109.4°
H252	C25	H253	109.5°	109.4°
C7	C16	H16	106.9°	108.9°
C16	C7	C2	117.0°	111.1°
C16	C7	H71	107.6°	109.5°
C16	C7	H72	107.6°	110.8°
C2	C7	H71	107.6°	108.7°
C2	C7	H72	107.5°	108.2°
C7	C2	C8	104.6°	109.0°
H71	C7	H72	109.5°	108.6°
C2	C8	O17	109.5°	109.4°
C2	C8	H81	109.5°	109.4°
C2	C8	H82	109.5°	109.5°
O17	C8	H81	109.4°	109.5°
O17	C8	H82	109.5°	109.5°
C8	O17	C52	114.3°	114.0°
H81	C8	H82	109.5°	109.5°
O17	C52	O56	109.2°	109.4°
O17	C52	C53	108.6°	109.5°
O17	C52	H52	109.9°	109.5°
O56	C52	C53	111.3°	109.4°
O56	C52	H52	109.7°	109.5°
C52	O56	C56	115.4°	114.1°
C53	C52	H52	108.2°	109.5°
C52	C53	C54	110.8°	109.1°
C52	C53	O57	110.3°	109.5°
C52	C53	H53	107.9°	109.6°
O56	C56	C61	107.1°	109.5°
O56	C56	C55	110.8°	109.4°
O56	C56	H56	109.2°	109.5°
C61	C56	C55	113.3°	109.5°
C61	C56	H56	108.4°	109.5°
C56	C61	H611	109.5°	109.5°
C56	C61	H612	109.4°	109.5°
C56	C61	H613	109.5°	109.5°
C55	C56	H56	108.0°	109.5°
C56	C55	O64	109.7°	109.5°
C56	C55	C54	109.4°	109.2°
C56	C55	H55	106.6°	109.5°
H611	C61	H612	109.5°	109.4°
H611	C61	H613	109.5°	109.5°
H612	C61	H613	109.5°	109.5°
O64	C55	C54	116.2°	109.5°
O64	C55	H55	107.9°	109.5°
C55	O64	C65	119.1°	114.0°
C54	C55	H55	106.6°	109.6°
C55	C54	O60	113.4°	109.6°
C55	C54	C53	109.4°	109.0°
C55	C54	H54	108.0°	109.5°
O64	C65	H651	109.5°	109.5°
O64	C65	H652	109.4°	109.4°
O64	C65	H653	109.5°	109.5°
H651	C65	H652	109.5°	109.4°
H651	C65	H653	109.4°	109.5°
H652	C65	H653	109.5°	109.5°
O60	C54	C53	108.4°	109.5°
O60	C54	H54	109.4°	109.6°
C54	O60	H60	109.5°	114.0°
C53	C54	H54	108.0°	109.6°
C54	C53	O57	110.8°	109.5°
C54	C53	H53	107.8°	109.5°
O57	C53	H53	109.2°	109.6°
C53	O57	H57	109.5°	114.0°
C20	C13	C21	107.9°	109.5°
C20	C13	H13	106.9°	109.5°
C13	C20	H201	109.5°	109.4°
C13	C20	H202	109.4°	109.5°
C13	C20	H203	109.4°	109.5°
C21	C13	H13	107.0°	109.5°
C13	C21	H211	109.5°	109.5°
C13	C21	H212	109.5°	109.5°
C13	C21	H213	109.5°	109.5°
H201	C20	H202	109.5°	109.4°
H201	C20	H203	109.5°	109.5°
H202	C20	H203	109.5°	109.5°
H211	C21	H212	109.5°	109.4°
H211	C21	H213	109.4°	109.4°
H212	C21	H213	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O14	C5	O15	C1	179.1°	179.7°
O14	C5	C1	C4	96.6°	57.6°
O14	C5	C1	C3	139.8°	64.4°
O14	C5	C1	C2	24.6°	176.6°
O15	C5	C1	C4	82.5°	122.1°
O15	C5	C1	C3	41.1°	115.9°
O15	C5	C1	C2	156.4°	3.1°
C5	C1	C4	C3	128.4°	128.5°
C5	C1	C4	C2	127.4°	127.0°
C5	C1	C3	C2	124.3°	127.2°
C5	C1	C4	C12	154.3°	151.8°
C5	C1	C4	C13	26.6°	30.1°
C5	C1	C4	H4	92.9°	90.6°
C5	C1	C2	C6	179.1°	177.0°
C5	C1	C3	C10	171.7°	172.0°
C5	C1	C3	C11	67.9°	65.6°
C5	C1	C3	C9	52.7°	59.8°
C5	C1	C2	C7	60.2°	65.7°
C5	C1	C2	C8	60.8°	59.4°
C4	C1	C3	C2	107.3°	105.2°
C1	C4	C12	C13	127.6°	121.6°
C1	C4	C12	H4	112.4°	119.3°
C1	C4	C13	H4	119.2°	122.7°
C1	C4	C12	C6	11.4°	11.6°
C1	C4	C12	H121	107.4°	108.8°
C1	C4	C12	H122	130.2°	128.1°
C4	C1	C2	C6	52.0°	51.1°
C4	C1	C3	C10	59.9°	60.4°
C4	C1	C3	C11	60.5°	62.0°
C4	C1	C3	C9	178.8°	172.7°
C4	C1	C2	C7	172.7°	168.4°
C4	C1	C2	C8	66.3°	66.5°
C1	C4	C13	C20	87.6°	140.0°
C1	C4	C13	C21	148.1°	100.0°
C1	C4	C13	H13	29.2°	20.0°
C3	C1	C4	C12	77.3°	79.8°
C3	C1	C4	C13	154.9°	158.6°
C3	C1	C4	H4	35.5°	37.8°
C1	C3	C10	C6	14.4°	15.0°
C3	C1	C2	C6	57.0°	55.9°
C1	C3	C10	C11	124.5°	122.8°
C1	C3	C10	C9	114.1°	112.1°
C1	C3	C10	H101	133.2°	138.5°
C1	C3	C10	H102	104.5°	101.5°
C1	C3	C11	C9	120.2°	122.5°
C1	C3	C11	O19	160.5°	120.0°
C1	C3	C11	H11	19.5°	60.0°
C1	C3	C9	C18	174.3°	177.2°
C1	C3	C9	C16	67.1°	72.3°
C1	C3	C9	H9	49.9°	51.0°
C3	C1	C2	C7	63.7°	61.4°
C3	C1	C2	C8	175.3°	173.5°
C2	C1	C4	C12	26.9°	24.8°
C2	C1	C4	C13	100.9°	96.8°
C2	C1	C4	H4	139.7°	142.4°
C1	C2	C6	C12	60.1°	58.3°
C1	C2	C6	C10	51.5°	46.2°
C1	C2	C6	C7	115.2°	118.2°
C1	C2	C6	C8	120.7°	118.3°
C1	C2	C6	H6	178.2°	176.4°
C2	C1	C3	C10	47.4°	44.8°
C2	C1	C3	C11	167.8°	167.2°
C2	C1	C3	C9	71.5°	67.5°
C1	C2	C7	C16	51.8°	58.9°
C1	C2	C7	C8	128.2°	127.5°
C1	C2	C7	H71	172.9°	179.3°
C1	C2	C7	H72	69.3°	62.9°
C1	C2	C8	O17	154.8°	170.0°
C1	C2	C8	H81	85.2°	50.1°
C1	C2	C8	H82	34.8°	70.0°
C12	C4	C13	H4	120.1°	119.5°
C4	C12	C6	H121	118.8°	120.5°
C4	C12	C6	H122	118.8°	116.8°
C4	C12	H121	H122	123.4°	123.1°
C4	C12	C6	C10	66.9°	62.8°
C4	C12	C6	C2	46.9°	43.7°
C4	C12	C6	H6	168.3°	169.7°
C12	C4	C13	C20	151.7°	102.2°
C12	C4	C13	C21	27.3°	17.8°
C12	C4	C13	H13	91.5°	137.8°
C13	C4	C12	C6	139.0°	133.2°
C13	C4	C12	H121	20.2°	12.9°
C13	C4	C12	H122	102.2°	110.3°
C4	C13	C20	C21	128.5°	120.0°
C4	C13	C20	H13	116.7°	120.0°
C4	C13	C21	H13	118.7°	120.0°
C4	C13	C20	H201	180.0°	176.0°
C4	C13	C20	H202	60.0°	56.1°
C4	C13	C20	H203	60.0°	64.0°
C4	C13	C21	H211	180.0°	84.5°
C4	C13	C21	H212	60.0°	155.5°
C4	C13	C21	H213	60.0°	35.5°
H4	C4	C12	C6	101.0°	107.7°
H4	C4	C12	H121	140.2°	131.9°
H4	C4	C12	H122	17.8°	8.8°
H4	C4	C13	C20	31.6°	17.3°
H4	C4	C13	C21	92.7°	137.3°
H4	C4	C13	H13	148.5°	102.7°
C6	C12	H121	H122	123.4°	122.4°
C12	C6	C10	C2	108.8°	102.3°
C12	C6	C10	H6	124.8°	127.3°
C12	C6	C2	H6	121.7°	125.4°
C12	C6	C10	C3	84.8°	82.4°
C12	C6	C10	H101	156.3°	154.1°
C12	C6	C10	H102	34.1°	34.1°
C12	C6	C2	C7	175.3°	176.4°
C12	C6	C2	C8	60.6°	60.1°
H121	C12	C6	C10	174.3°	176.7°
H121	C12	C6	C2	71.9°	76.7°
H121	C12	C6	H6	49.5°	49.2°
H122	C12	C6	C10	51.9°	54.0°
H122	C12	C6	C2	165.7°	160.5°
H122	C12	C6	H6	72.9°	73.5°
C10	C6	C2	H6	126.7°	130.2°
C6	C10	C3	H101	118.9°	123.5°
C6	C10	C3	H102	118.9°	116.5°
C6	C10	H101	H102	123.2°	120.2°
C6	C10	C3	C11	138.9°	137.8°
C6	C10	C3	C9	99.7°	97.1°
C10	C6	C2	C7	63.7°	72.0°
C10	C6	C2	C8	172.2°	164.5°
C2	C6	C10	C3	24.0°	19.9°
C2	C6	C10	H101	94.9°	103.7°
C2	C6	C10	H102	142.9°	136.4°
C6	C2	C7	C16	51.0°	48.2°
C6	C2	C7	C8	128.9°	125.5°
C6	C2	C7	H71	70.1°	72.2°
C6	C2	C7	H72	172.1°	170.0°
C6	C2	C8	O17	50.6°	82.7°
C6	C2	C8	H81	170.6°	157.4°
C6	C2	C8	H82	69.4°	37.3°
H6	C6	C10	C3	150.4°	150.3°
H6	C6	C10	H101	31.5°	26.8°
H6	C6	C10	H102	90.7°	93.1°
H6	C6	C2	C7	63.0°	58.2°
H6	C6	C2	C8	61.1°	65.3°
C3	C10	H101	H102	123.2°	120.3°
C10	C3	C11	C9	124.6°	122.3°
C10	C3	C11	O19	45.3°	124.7°
C10	C3	C11	H11	134.7°	55.2°
C10	C3	C9	C18	75.0°	74.9°
C10	C3	C9	C16	43.7°	35.6°
C10	C3	C9	H9	160.7°	158.9°
H101	C10	C3	C11	102.2°	98.7°
H101	C10	C3	C9	19.2°	26.4°
H102	C10	C3	C11	20.0°	21.3°
H102	C10	C3	C9	141.4°	146.4°
C3	C11	O19	H11	180.0°	179.9°
C11	C3	C9	C18	48.0°	50.9°
C11	C3	C9	C16	166.7°	161.4°
C11	C3	C9	H9	76.3°	75.3°
C9	C3	C11	O19	79.3°	2.4°
C9	C3	C11	H11	100.7°	177.5°
C3	C9	C18	C16	123.4°	115.2°
C3	C9	C18	H9	124.1°	127.6°
C3	C9	C16	H9	116.7°	123.5°
C3	C9	C18	C24	164.1°	163.6°
C3	C9	C18	H181	45.2°	45.9°
C3	C9	C18	H182	76.9°	79.1°
C3	C9	C16	C22	179.7°	169.5°
C3	C9	C16	C7	48.0°	63.3°
C3	C9	C16	H16	68.7°	55.8°
C18	C9	C16	H9	112.6°	115.3°
C9	C18	C24	H181	119.0°	117.7°
C9	C18	C24	H182	119.0°	117.4°
C9	C18	H181	H182	122.9°	124.3°
C9	C18	C24	C22	17.1°	31.6°
C9	C18	C24	H241	136.7°	150.2°
C9	C18	C24	H242	102.6°	87.3°
C18	C9	C16	C22	49.7°	48.2°
C18	C9	C16	C7	178.6°	175.4°
C18	C9	C16	H16	61.9°	65.5°
C16	C9	C18	C24	40.7°	48.5°
C16	C9	C18	H181	78.3°	69.3°
C16	C9	C18	H182	159.7°	165.7°
C9	C16	C22	C24	38.2°	28.4°
C9	C16	C22	C25	85.5°	91.0°
C9	C16	C22	C7	125.5°	118.8°
C9	C16	C22	H16	111.7°	117.1°
C9	C16	C22	H22	152.2°	146.3°
C9	C16	C7	H16	116.6°	120.6°
C9	C16	C7	C2	40.4°	55.5°
C9	C16	C7	H71	161.5°	175.5°
C9	C16	C7	H72	80.7°	64.8°
H9	C9	C18	C24	71.8°	68.8°
H9	C9	C18	H181	169.2°	173.5°
H9	C9	C18	H182	47.2°	48.5°
H9	C9	C16	C22	62.9°	67.0°
H9	C9	C16	C7	68.8°	60.1°
H9	C9	C16	H16	174.6°	179.2°
C24	C18	H181	H182	122.9°	124.2°
C18	C24	C22	H241	119.7°	118.7°
C18	C24	C22	H242	119.7°	119.0°
C18	C24	H241	H242	121.0°	122.2°
C18	C24	C22	C25	112.7°	122.4°
C18	C24	C22	C16	13.1°	1.9°
C18	C24	C22	H22	127.1°	116.0°
H181	C18	C24	C22	101.9°	86.1°
H181	C18	C24	H241	17.8°	32.6°
H181	C18	C24	H242	138.4°	155.0°
H182	C18	C24	C22	136.1°	148.9°
H182	C18	C24	H241	104.3°	92.4°
H182	C18	C24	H242	16.4°	30.0°
C22	C24	H241	H242	121.0°	122.0°
C24	C22	C25	C16	118.0°	116.3°
C24	C22	C25	H22	119.9°	121.4°
C24	C22	C16	H22	113.9°	118.0°
C24	C22	C25	H251	180.0°	58.5°
C24	C22	C25	H252	60.0°	178.6°
C24	C22	C25	H253	60.0°	61.4°
C24	C22	C16	C7	163.7°	147.2°
C24	C22	C16	H16	73.5°	88.7°
H241	C24	C22	C25	127.6°	118.9°
H241	C24	C22	C16	106.5°	120.7°
H241	C24	C22	H22	7.5°	2.7°
H242	C24	C22	C25	7.0°	3.4°
H242	C24	C22	C16	132.8°	117.1°
H242	C24	C22	H22	113.2°	125.0°
C25	C22	C16	H22	122.3°	122.6°
C22	C25	H251	H252	120.0°	120.0°
C22	C25	H251	H253	120.0°	120.0°
C22	C25	H252	H253	120.0°	120.0°
C25	C22	C16	C7	40.0°	27.8°
C25	C22	C16	H16	162.7°	151.8°
C16	C22	C25	H251	62.0°	57.8°
C16	C22	C25	H252	178.0°	62.3°
C16	C22	C25	H253	58.0°	177.7°
C22	C16	C7	H16	122.7°	122.9°
C22	C16	C7	C2	161.2°	172.0°
C22	C16	C7	H71	77.8°	68.0°
C22	C16	C7	H72	40.1°	51.7°
H22	C22	C25	H251	60.1°	179.9°
H22	C22	C25	H252	59.9°	60.0°
H22	C22	C25	H253	179.9°	60.0°
H22	C22	C16	C7	82.3°	94.8°
H22	C22	C16	H16	40.4°	29.2°
H251	C25	H252	H253	120.0°	120.0°
C16	C7	C2	H71	121.1°	120.5°
C16	C7	C2	H72	121.1°	121.8°
C16	C7	H71	H72	116.6°	121.1°
C16	C7	C2	C8	179.9°	173.7°
H16	C16	C7	C2	76.2°	65.1°
H16	C16	C7	H71	44.9°	54.9°
H16	C16	C7	H72	162.8°	174.7°
C2	C7	H71	H72	116.6°	117.5°
C7	C2	C8	O17	80.4°	42.6°
C7	C2	C8	H81	39.6°	77.3°
C7	C2	C8	H82	159.6°	162.6°
H71	C7	C2	C8	58.9°	53.2°
H72	C7	C2	C8	59.0°	64.5°
C2	C8	O17	H81	120.0°	119.9°
C2	C8	O17	H82	120.0°	120.0°
C2	C8	H81	H82	120.0°	120.1°
C2	C8	O17	C52	173.8°	179.9°
O17	C8	H81	H82	120.0°	120.0°
C8	O17	C52	O56	144.0°	70.0°
C8	O17	C52	C53	94.4°	170.1°
C8	O17	C52	H52	23.7°	50.0°
H81	C8	O17	C52	53.8°	60.0°
H82	C8	O17	C52	66.2°	60.0°
O17	C52	O56	C53	119.9°	120.0°
O17	C52	O56	H52	120.5°	120.0°
O17	C52	C53	H52	119.2°	120.1°
O17	C52	O56	C56	174.7°	178.9°
O17	C52	C53	C54	146.7°	177.6°
O17	C52	C53	O57	90.3°	62.6°
O17	C52	C53	H53	28.9°	57.7°
O56	C52	C53	H52	120.5°	120.0°
C52	O56	C56	C61	90.3°	58.8°
C52	O56	C56	C55	33.7°	61.1°
C52	O56	C56	H56	152.6°	178.8°
O56	C52	C53	C54	26.4°	57.7°
O56	C52	C53	O57	149.5°	177.5°
O56	C52	C53	H53	91.3°	62.3°
C53	C52	O56	C56	65.4°	61.2°
C52	C53	C54	C55	34.5°	57.0°
C52	C53	C54	O60	89.7°	176.9°
C52	C53	C54	O57	122.7°	119.9°
C52	C53	C54	H53	117.8°	119.9°
C52	C53	C54	H54	151.9°	62.9°
C52	C53	O57	H53	118.4°	120.2°
C52	C53	O57	H57	180.0°	60.0°
H52	C52	O56	C56	54.2°	58.8°
H52	C52	C53	C54	94.1°	62.3°
H52	C52	C53	O57	29.0°	57.5°
H52	C52	C53	H53	148.1°	177.8°
O56	C56	C61	C55	122.5°	119.9°
O56	C56	C61	H56	117.7°	120.0°
O56	C56	C55	H56	119.6°	120.0°
O56	C56	C61	H611	180.0°	60.0°
O56	C56	C61	H612	60.0°	180.0°
O56	C56	C61	H613	60.0°	60.0°
O56	C56	C55	O64	158.8°	62.3°
O56	C56	C55	C54	30.3°	57.6°
O56	C56	C55	H55	84.6°	177.6°
C61	C56	C55	H56	120.1°	120.0°
C56	C61	H611	H612	120.0°	120.0°
C56	C61	H611	H613	120.0°	120.1°
C56	C61	H612	H613	120.0°	120.1°
C61	C56	C55	O64	80.9°	177.7°
C61	C56	C55	C54	150.6°	62.4°
C61	C56	C55	H55	35.7°	57.6°
C55	C56	C61	H611	57.5°	179.9°
C55	C56	C61	H612	62.5°	60.1°
C55	C56	C61	H613	177.5°	59.9°
C56	C55	O64	C54	124.7°	119.7°
C56	C55	O64	H55	115.7°	120.1°
C56	C55	C54	H55	114.9°	120.0°
C56	C55	O64	C65	81.0°	89.9°
C56	C55	C54	O60	56.6°	176.8°
C56	C55	C54	C53	64.6°	57.0°
C56	C55	C54	H54	178.1°	63.0°
H56	C56	C61	H611	62.3°	60.0°
H56	C56	C61	H612	177.7°	60.0°
H56	C56	C61	H613	57.7°	180.0°
H56	C56	C55	O64	39.2°	57.7°
H56	C56	C55	C54	89.3°	177.6°
H56	C56	C55	H55	155.8°	62.4°
H611	C61	H612	H613	120.0°	120.0°
O64	C55	C54	H55	120.3°	120.1°
C55	O64	C65	H651	180.0°	180.0°
C55	O64	C65	H652	60.0°	60.1°
C55	O64	C65	H653	60.0°	59.9°
O64	C55	C54	O60	68.2°	56.9°
O64	C55	C54	C53	170.6°	62.9°
O64	C55	C54	H54	53.2°	177.1°
C54	C55	O64	C65	43.7°	150.3°
C55	C54	O60	C53	121.7°	119.5°
C55	C54	O60	H54	120.7°	120.2°
C55	C54	C53	H54	117.4°	119.9°
C55	C54	O60	H60	180.0°	180.0°
C55	C54	C53	O57	88.2°	176.9°
C55	C54	C53	H53	152.4°	62.9°
H55	C55	O64	C65	163.3°	30.2°
H55	C55	C54	O60	171.5°	63.2°
H55	C55	C54	C53	50.3°	177.0°
H55	C55	C54	H54	67.1°	57.0°
O64	C65	H651	H652	120.0°	119.9°
O64	C65	H651	H653	120.0°	120.1°
O64	C65	H652	H653	120.0°	120.0°
H651	C65	H652	H653	120.0°	120.0°
O60	C54	C53	H54	118.4°	120.2°
O60	C54	C53	O57	147.6°	63.3°
O60	C54	C53	H53	28.2°	56.9°
C53	C54	O60	H60	58.3°	60.5°
C54	C53	O57	H53	118.6°	120.2°
C54	C53	O57	H57	57.0°	179.6°
H54	C54	O60	H60	59.3°	59.8°
H54	C54	C53	O57	29.2°	57.0°
H54	C54	C53	H53	90.3°	177.2°
H53	C53	O57	H57	61.6°	60.2°
C20	C13	C21	H13	114.7°	120.1°
C13	C20	H201	H202	120.0°	120.0°
C13	C20	H201	H203	120.0°	120.0°
C13	C20	H202	H203	120.0°	120.1°
C20	C13	C21	H211	53.4°	155.6°
C20	C13	C21	H212	66.6°	35.6°
C20	C13	C21	H213	173.4°	84.5°
C21	C13	C20	H201	51.5°	64.0°
C21	C13	C20	H202	171.5°	176.0°
C21	C13	C20	H203	68.5°	56.0°
C13	C21	H211	H212	120.0°	120.0°
C13	C21	H211	H213	120.0°	120.0°
C13	C21	H212	H213	120.0°	120.1°
H13	C13	C20	H201	63.3°	56.0°
H13	C13	C20	H202	56.7°	63.9°
H13	C13	C20	H203	176.7°	176.0°
H13	C13	C21	H211	61.3°	35.5°
H13	C13	C21	H212	178.7°	84.5°
H13	C13	C21	H213	58.7°	155.4°
H201	C20	H202	H203	120.0°	120.0°
H211	C21	H212	H213	120.0°	119.9°

Release date:	2023-11-01
Definition date:	2023-09-27
Last modified:	2023-10-27
Release status:	REL
Processing site:	RCSB
Derived from:	8EVR