CLA

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
MG	NA	sing	1.90Å	2.18Å
MG	NB	sing	1.90Å	2.10Å
MG	NC	sing	1.90Å	2.11Å
MG	ND	sing	1.90Å	2.04Å
CHA	C1A	sing	1.40Å	1.38Å
CHA	C4D	doub	1.41Å	1.39Å
CHA	CBD	sing	1.50Å	1.53Å
CHB	C4A	doub	1.39Å	1.40Å
CHB	C1B	sing	1.40Å	1.34Å
CHB	HHB	sing	1.08Å	1.08Å
CHC	C4B	sing	1.39Å	1.39Å
CHC	C1C	doub	1.42Å	1.43Å
CHC	HHC	sing	1.08Å	1.08Å
CHD	C4C	sing	1.42Å	1.41Å
CHD	C1D	doub	1.40Å	1.42Å
CHD	HHD	sing	1.08Å	1.08Å
NA	C1A	doub	1.34Å	1.38Å
NA	C4A	sing	1.34Å	1.33Å
C1A	C2A	sing	1.51Å	1.51Å
C2A	C3A	sing	1.56Å	1.53Å
C2A	CAA	sing	1.53Å	1.57Å
C2A	H2A	sing	1.09Å	1.10Å
C3A	C4A	sing	1.51Å	1.51Å
C3A	CMA	sing	1.53Å	1.53Å
C3A	H3A	sing	1.09Å	1.10Å
CMA	HMA1	sing	1.09Å	1.10Å
CMA	HMA2	sing	1.09Å	1.10Å
CMA	HMA3	sing	1.09Å	1.10Å
CAA	CBA	sing	1.53Å	1.48Å
CAA	HAA1	sing	1.09Å	1.10Å
CAA	HAA2	sing	1.09Å	1.10Å
CBA	CGA	sing	1.51Å	1.46Å
CBA	HBA1	sing	1.09Å	1.10Å
CBA	HBA2	sing	1.09Å	1.10Å
CGA	O1A	doub	1.21Å	1.21Å
CGA	O2A	sing	1.34Å	1.34Å
O2A	C1	sing	1.45Å	1.48Å
NB	C1B	sing	1.38Å	1.35Å	Aromatic
NB	C4B	sing	1.38Å	1.39Å	Aromatic
C1B	C2B	doub	1.38Å	1.45Å	Aromatic
C2B	C3B	sing	1.41Å	1.36Å	Aromatic
C2B	CMB	sing	1.51Å	1.50Å
C3B	C4B	doub	1.41Å	1.48Å	Aromatic
C3B	CAB	sing	1.47Å	1.50Å
CMB	HMB1	sing	1.09Å	1.10Å
CMB	HMB2	sing	1.09Å	1.10Å
CMB	HMB3	sing	1.09Å	1.10Å
CAB	CBB	doub	1.33Å	1.27Å
CAB	HAB	sing	1.08Å	1.08Å
CBB	HBB1	sing	1.08Å	1.08Å
CBB	HBB2	sing	1.08Å	1.08Å
NC	C1C	sing	1.34Å	1.37Å
NC	C4C	doub	1.35Å	1.38Å
C1C	C2C	sing	1.41Å	1.46Å
C2C	C3C	doub	1.38Å	1.38Å
C2C	CMC	sing	1.51Å	1.51Å
C3C	C4C	sing	1.41Å	1.47Å
C3C	CAC	sing	1.51Å	1.51Å
CMC	HMC1	sing	1.09Å	1.10Å
CMC	HMC2	sing	1.09Å	1.10Å
CMC	HMC3	sing	1.09Å	1.10Å
CAC	CBC	sing	1.53Å	1.54Å
CAC	HAC1	sing	1.09Å	1.10Å
CAC	HAC2	sing	1.09Å	1.10Å
CBC	HBC1	sing	1.09Å	1.10Å
CBC	HBC2	sing	1.09Å	1.10Å
CBC	HBC3	sing	1.09Å	1.10Å
ND	C1D	sing	1.37Å	1.34Å
ND	C4D	sing	1.35Å	1.37Å
C1D	C2D	sing	1.39Å	1.42Å
C2D	C3D	doub	1.41Å	1.40Å
C2D	CMD	sing	1.51Å	1.54Å
C3D	C4D	sing	1.39Å	1.40Å
C3D	CAD	sing	1.46Å	1.44Å
CMD	HMD1	sing	1.09Å	1.10Å
CMD	HMD2	sing	1.09Å	1.10Å
CMD	HMD3	sing	1.09Å	1.10Å
CAD	OBD	doub	1.21Å	1.24Å
CAD	CBD	sing	1.53Å	1.55Å
CBD	CGD	sing	1.51Å	1.54Å
CBD	HBD	sing	1.09Å	1.10Å
CGD	O1D	doub	1.21Å	1.21Å
CGD	O2D	sing	1.34Å	1.32Å
O2D	CED	sing	1.45Å	1.44Å
CED	HED1	sing	1.09Å	1.10Å
CED	HED2	sing	1.09Å	1.10Å
CED	HED3	sing	1.09Å	1.10Å
C1	C2	sing	1.51Å	1.53Å
C1	H11	sing	1.09Å	1.10Å
C1	H12	sing	1.09Å	1.10Å
C2	C3	doub	1.31Å	1.35Å
C2	H2	sing	1.08Å	1.08Å
C3	C4	sing	1.51Å	1.54Å
C3	C5	sing	1.51Å	1.54Å
C4	H41	sing	1.09Å	1.10Å
C4	H42	sing	1.09Å	1.10Å
C4	H43	sing	1.09Å	1.10Å
C5	C6	sing	1.53Å	1.53Å
C5	H51	sing	1.09Å	1.10Å
C5	H52	sing	1.09Å	1.10Å
C6	C7	sing	1.53Å	1.51Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
C7	C8	sing	1.53Å	1.54Å
C7	H71	sing	1.09Å	1.10Å
C7	H72	sing	1.09Å	1.10Å
C8	C9	sing	1.53Å	1.52Å
C8	C10	sing	1.53Å	1.51Å
C8	H8	sing	1.09Å	1.10Å
C9	H91	sing	1.09Å	1.10Å
C9	H92	sing	1.09Å	1.10Å
C9	H93	sing	1.09Å	1.10Å
C10	C11	sing	1.53Å	1.52Å
C10	H101	sing	1.09Å	1.10Å
C10	H102	sing	1.09Å	1.10Å
C11	C12	sing	1.53Å	1.54Å
C11	H111	sing	1.09Å	1.10Å
C11	H112	sing	1.09Å	1.10Å
C12	C13	sing	1.53Å	1.55Å
C12	H121	sing	1.09Å	1.10Å
C12	H122	sing	1.09Å	1.10Å
C13	C14	sing	1.53Å	1.53Å
C13	C15	sing	1.53Å	1.55Å
C13	H13	sing	1.09Å	1.10Å
C14	H141	sing	1.09Å	1.10Å
C14	H142	sing	1.09Å	1.10Å
C14	H143	sing	1.09Å	1.10Å
C15	C16	sing	1.53Å	1.53Å
C15	H151	sing	1.09Å	1.10Å
C15	H152	sing	1.09Å	1.10Å
C16	C17	sing	1.53Å	1.51Å
C16	H161	sing	1.09Å	1.10Å
C16	H162	sing	1.09Å	1.10Å
C17	C18	sing	1.53Å	1.53Å
C17	H171	sing	1.09Å	1.10Å
C17	H172	sing	1.09Å	1.10Å
C18	C19	sing	1.53Å	1.52Å
C18	C20	sing	1.53Å	1.51Å
C18	H18	sing	1.09Å	1.10Å
C19	H191	sing	1.09Å	1.10Å
C19	H192	sing	1.09Å	1.10Å
C19	H193	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

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
NA	MG	NB	89.5°	100.8°
NA	MG	NC	159.5°	133.5°
NA	MG	ND	88.3°	100.2°
MG	NA	C1A	126.0°	123.7°
MG	NA	C4A	121.7°	119.0°
NB	MG	NC	87.6°	98.8°
NB	MG	ND	158.6°	131.7°
MG	NB	C1B	123.2°	122.5°
MG	NB	C4B	127.6°	122.6°
NC	MG	ND	87.1°	97.3°
MG	NC	C1C	125.7°	122.4°
MG	NC	C4C	124.3°	122.0°
MG	ND	C1D	130.9°	126.8°
MG	ND	C4D	122.0°	116.4°
C1A	CHA	C4D	123.1°	122.6°
C1A	CHA	CBD	130.7°	135.5°
CHA	C1A	NA	124.0°	124.0°
CHA	C1A	C2A	125.9°	129.0°
C4D	CHA	CBD	105.7°	101.8°
CHA	C4D	ND	134.2°	132.1°
CHA	C4D	C3D	115.0°	118.7°
CHA	CBD	CAD	103.6°	106.7°
CHA	CBD	CGD	111.4°	110.0°
CHA	CBD	HBD	111.4°	110.0°
C4A	CHB	C1B	130.6°	130.2°
C4A	CHB	HHB	114.7°	114.9°
CHB	C4A	NA	125.4°	125.7°
CHB	C4A	C3A	123.5°	129.9°
C1B	CHB	HHB	114.7°	114.9°
CHB	C1B	NB	126.5°	120.0°
CHB	C1B	C2B	123.9°	138.1°
C4B	CHC	C1C	126.3°	129.0°
C4B	CHC	HHC	116.9°	115.5°
CHC	C4B	NB	124.5°	121.4°
CHC	C4B	C3B	127.8°	137.3°
C1C	CHC	HHC	116.9°	115.4°
CHC	C1C	NC	125.8°	122.9°
CHC	C1C	C2C	125.5°	134.6°
C4C	CHD	C1D	126.8°	128.8°
C4C	CHD	HHD	116.6°	115.6°
CHD	C4C	NC	125.3°	124.4°
CHD	C4C	C3C	126.3°	133.5°
C1D	CHD	HHD	116.6°	115.6°
CHD	C1D	ND	121.9°	119.0°
CHD	C1D	C2D	126.4°	137.7°
C1A	NA	C4A	111.4°	109.9°
NA	C1A	C2A	110.1°	106.6°
NA	C4A	C3A	111.0°	104.4°
C1A	C2A	C3A	103.2°	102.4°
C1A	C2A	CAA	110.8°	110.8°
C1A	C2A	H2A	110.8°	110.8°
C3A	C2A	CAA	111.4°	110.8°
C3A	C2A	H2A	110.5°	110.8°
C2A	C3A	C4A	104.2°	101.5°
C2A	C3A	CMA	109.9°	111.0°
C2A	C3A	H3A	110.8°	111.1°
CAA	C2A	H2A	110.0°	110.9°
C2A	CAA	CBA	117.0°	109.5°
C2A	CAA	HAA1	107.6°	109.5°
C2A	CAA	HAA2	107.6°	109.5°
C4A	C3A	CMA	109.8°	111.0°
C4A	C3A	H3A	111.2°	111.0°
CMA	C3A	H3A	110.8°	110.9°
C3A	CMA	HMA1	109.5°	109.5°
C3A	CMA	HMA2	109.5°	109.5°
C3A	CMA	HMA3	109.5°	109.5°
HMA1	CMA	HMA2	109.5°	109.4°
HMA1	CMA	HMA3	109.5°	109.5°
HMA2	CMA	HMA3	109.5°	109.4°
CBA	CAA	HAA1	107.5°	109.5°
CBA	CAA	HAA2	107.5°	109.4°
CAA	CBA	CGA	114.0°	109.5°
CAA	CBA	HBA1	108.3°	109.5°
CAA	CBA	HBA2	108.3°	109.4°
HAA1	CAA	HAA2	109.5°	109.5°
CGA	CBA	HBA1	108.3°	109.5°
CGA	CBA	HBA2	108.3°	109.5°
CBA	CGA	O1A	119.0°	120.0°
CBA	CGA	O2A	121.8°	120.0°
HBA1	CBA	HBA2	109.5°	109.5°
O1A	CGA	O2A	119.2°	120.0°
CGA	O2A	C1	119.4°	117.0°
O2A	C1	C2	107.5°	109.4°
O2A	C1	H11	110.0°	109.4°
O2A	C1	H12	110.0°	109.5°
C1B	NB	C4B	108.5°	109.9°
NB	C1B	C2B	109.5°	101.9°
NB	C4B	C3B	107.6°	101.0°
C1B	C2B	C3B	107.7°	108.4°
C1B	C2B	CMB	123.8°	125.8°
C3B	C2B	CMB	128.4°	125.8°
C2B	C3B	C4B	106.5°	107.1°
C2B	C3B	CAB	116.1°	126.4°
C2B	CMB	HMB1	109.5°	109.4°
C2B	CMB	HMB2	109.5°	109.5°
C2B	CMB	HMB3	109.5°	109.5°
C4B	C3B	CAB	137.0°	126.5°
C3B	CAB	CBB	124.1°	120.0°
C3B	CAB	HAB	118.0°	120.0°
HMB1	CMB	HMB2	109.4°	109.5°
HMB1	CMB	HMB3	109.4°	109.5°
HMB2	CMB	HMB3	109.4°	109.5°
CBB	CAB	HAB	118.0°	120.0°
CAB	CBB	HBB1	120.0°	120.0°
CAB	CBB	HBB2	120.0°	120.0°
HBB1	CBB	HBB2	120.0°	120.0°
C1C	NC	C4C	108.6°	108.2°
NC	C1C	C2C	108.7°	102.0°
NC	C4C	C3C	108.4°	101.8°
C1C	C2C	C3C	107.6°	106.3°
C1C	C2C	CMC	125.1°	126.9°
C3C	C2C	CMC	127.2°	126.8°
C2C	C3C	C4C	106.6°	106.3°
C2C	C3C	CAC	128.4°	126.8°
C2C	CMC	HMC1	109.5°	109.5°
C2C	CMC	HMC2	109.4°	109.5°
C2C	CMC	HMC3	109.5°	109.4°
C4C	C3C	CAC	124.9°	126.8°
C3C	CAC	CBC	110.9°	109.4°
C3C	CAC	HAC1	109.1°	109.4°
C3C	CAC	HAC2	109.1°	109.4°
HMC1	CMC	HMC2	109.4°	109.5°
HMC1	CMC	HMC3	109.5°	109.5°
HMC2	CMC	HMC3	109.5°	109.4°
CBC	CAC	HAC1	109.1°	109.5°
CBC	CAC	HAC2	109.1°	109.5°
CAC	CBC	HBC1	109.5°	109.4°
CAC	CBC	HBC2	109.5°	109.5°
CAC	CBC	HBC3	109.5°	109.5°
HAC1	CAC	HAC2	109.5°	109.5°
HBC1	CBC	HBC2	109.5°	109.5°
HBC1	CBC	HBC3	109.5°	109.4°
HBC2	CBC	HBC3	109.4°	109.5°
C1D	ND	C4D	106.0°	108.5°
ND	C1D	C2D	111.7°	102.3°
ND	C4D	C3D	110.8°	108.0°
C1D	C2D	C3D	104.7°	109.6°
C1D	C2D	CMD	128.2°	125.2°
C3D	C2D	CMD	127.1°	125.2°
C2D	C3D	C4D	106.8°	103.9°
C2D	C3D	CAD	145.5°	153.0°
C2D	CMD	HMD1	109.5°	109.5°
C2D	CMD	HMD2	109.5°	109.5°
C2D	CMD	HMD3	109.5°	109.5°
C4D	C3D	CAD	107.6°	102.9°
C3D	CAD	OBD	131.2°	126.3°
C3D	CAD	CBD	107.3°	107.3°
HMD1	CMD	HMD2	109.4°	109.4°
HMD1	CMD	HMD3	109.5°	109.5°
HMD2	CMD	HMD3	109.5°	109.4°
OBD	CAD	CBD	121.5°	126.4°
CAD	CBD	CGD	107.8°	110.0°
CAD	CBD	HBD	111.1°	110.0°
CGD	CBD	HBD	111.3°	110.0°
CBD	CGD	O1D	120.7°	120.0°
CBD	CGD	O2D	118.4°	120.0°
O1D	CGD	O2D	120.9°	120.0°
CGD	O2D	CED	120.3°	117.0°
O2D	CED	HED1	109.5°	109.5°
O2D	CED	HED2	109.5°	109.4°
O2D	CED	HED3	109.5°	109.5°
HED1	CED	HED2	109.5°	109.5°
HED1	CED	HED3	109.4°	109.5°
HED2	CED	HED3	109.5°	109.5°
C2	C1	H11	110.0°	109.5°
C2	C1	H12	110.0°	109.5°
C1	C2	C3	130.4°	120.0°
C1	C2	H2	114.8°	120.0°
H11	C1	H12	109.5°	109.5°
C3	C2	H2	114.8°	120.0°
C2	C3	C4	122.7°	120.0°
C2	C3	C5	124.7°	120.0°
C4	C3	C5	112.6°	120.0°
C3	C4	H41	109.5°	109.5°
C3	C4	H42	109.5°	109.5°
C3	C4	H43	109.5°	109.5°
C3	C5	C6	115.5°	109.5°
C3	C5	H51	108.0°	109.4°
C3	C5	H52	107.9°	109.5°
H41	C4	H42	109.4°	109.5°
H41	C4	H43	109.5°	109.5°
H42	C4	H43	109.5°	109.4°
C6	C5	H51	107.9°	109.5°
C6	C5	H52	108.0°	109.5°
C5	C6	C7	113.2°	109.5°
C5	C6	H61	108.5°	109.5°
C5	C6	H62	108.5°	109.5°
H51	C5	H52	109.5°	109.5°
C7	C6	H61	108.6°	109.5°
C7	C6	H62	108.5°	109.5°
C6	C7	C8	112.0°	109.5°
C6	C7	H71	108.8°	109.5°
C6	C7	H72	108.8°	109.5°
H61	C6	H62	109.5°	109.5°
C8	C7	H71	108.8°	109.5°
C8	C7	H72	108.8°	109.5°
C7	C8	C9	110.7°	109.5°
C7	C8	C10	108.1°	109.4°
C7	C8	H8	109.0°	109.5°
H71	C7	H72	109.5°	109.5°
C9	C8	C10	110.5°	109.5°
C9	C8	H8	109.2°	109.5°
C8	C9	H91	109.5°	109.5°
C8	C9	H92	109.5°	109.4°
C8	C9	H93	109.5°	109.5°
C10	C8	H8	109.3°	109.5°
C8	C10	C11	118.9°	109.4°
C8	C10	H101	107.1°	109.5°
C8	C10	H102	107.0°	109.5°
H91	C9	H92	109.5°	109.5°
H91	C9	H93	109.5°	109.5°
H92	C9	H93	109.5°	109.5°
C11	C10	H101	107.0°	109.5°
C11	C10	H102	107.1°	109.5°
C10	C11	C12	102.5°	109.4°
C10	C11	H111	111.2°	109.5°
C10	C11	H112	111.2°	109.4°
H101	C10	H102	109.5°	109.5°
C12	C11	H111	111.2°	109.5°
C12	C11	H112	111.2°	109.5°
C11	C12	C13	120.2°	109.4°
C11	C12	H121	106.7°	109.5°
C11	C12	H122	106.7°	109.5°
H111	C11	H112	109.4°	109.5°
C13	C12	H121	106.7°	109.4°
C13	C12	H122	106.7°	109.5°
C12	C13	C14	111.7°	109.4°
C12	C13	C15	110.2°	109.5°
C12	C13	H13	107.7°	109.5°
H121	C12	H122	109.4°	109.5°
C14	C13	C15	111.5°	109.5°
C14	C13	H13	107.9°	109.5°
C13	C14	H141	109.5°	109.5°
C13	C14	H142	109.4°	109.5°
C13	C14	H143	109.5°	109.4°
C15	C13	H13	107.7°	109.5°
C13	C15	C16	117.9°	109.4°
C13	C15	H151	107.3°	109.4°
C13	C15	H152	107.3°	109.5°
H141	C14	H142	109.5°	109.5°
H141	C14	H143	109.5°	109.5°
H142	C14	H143	109.5°	109.4°
C16	C15	H151	107.3°	109.5°
C16	C15	H152	107.3°	109.5°
C15	C16	C17	115.4°	109.5°
C15	C16	H161	108.0°	109.5°
C15	C16	H162	108.0°	109.5°
H151	C15	H152	109.5°	109.5°
C17	C16	H161	108.0°	109.5°
C17	C16	H162	108.0°	109.5°
C16	C17	C18	113.1°	109.5°
C16	C17	H171	108.6°	109.5°
C16	C17	H172	108.5°	109.5°
H161	C16	H162	109.5°	109.4°
C18	C17	H171	108.6°	109.5°
C18	C17	H172	108.6°	109.4°
C17	C18	C19	111.9°	109.4°
C17	C18	C20	109.7°	109.5°
C17	C18	H18	108.3°	109.5°
H171	C17	H172	109.5°	109.5°
C19	C18	C20	109.8°	109.5°
C19	C18	H18	108.5°	109.6°
C18	C19	H191	109.5°	109.5°
C18	C19	H192	109.5°	109.5°
C18	C19	H193	109.5°	109.5°
C20	C18	H18	108.6°	109.5°
C18	C20	H201	109.5°	109.5°
C18	C20	H202	109.5°	109.5°
C18	C20	H203	109.5°	109.5°
H191	C19	H192	109.5°	109.5°
H191	C19	H193	109.5°	109.5°
H192	C19	H193	109.5°	109.4°
H201	C20	H202	109.4°	109.5°
H201	C20	H203	109.5°	109.4°
H202	C20	H203	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
NA	MG	NB	NC	159.7°	137.6°
NA	MG	NB	ND	84.1°	114.3°
NA	MG	NC	ND	77.2°	111.6°
MG	NA	C1A	CHA	11.7°	10.1°
MG	NA	C4A	CHB	11.7°	14.2°
MG	NA	C1A	C4A	169.4°	149.3°
MG	NA	C1A	C2A	170.7°	176.1°
MG	NA	C4A	C3A	170.0°	167.4°
NA	MG	NB	C1B	16.2°	5.8°
NA	MG	NB	C4B	174.8°	146.7°
NA	MG	NC	C1C	98.6°	107.9°
NA	MG	NC	C4C	96.1°	105.8°
NA	MG	ND	C1D	179.4°	140.2°
NA	MG	ND	C4D	14.4°	4.4°
NB	MG	NC	ND	159.3°	134.3°
MG	NB	C1B	CHB	9.9°	11.7°
MG	NB	C4B	CHC	9.4°	15.1°
NB	MG	NA	C1A	174.5°	140.1°
NB	MG	NA	C4A	17.1°	6.6°
MG	NB	C1B	C4B	170.8°	155.5°
MG	NB	C1B	C2B	174.2°	171.3°
MG	NB	C4B	C3B	174.2°	170.1°
NB	MG	NC	C1C	16.6°	6.2°
NB	MG	NC	C4C	178.2°	140.1°
NB	MG	ND	C1D	95.1°	105.3°
NB	MG	ND	C4D	98.7°	110.1°
MG	NC	C1C	CHC	13.2°	16.2°
MG	NC	C4C	CHD	14.0°	14.8°
NC	MG	NA	C1A	92.8°	106.5°
NC	MG	NA	C4A	98.8°	106.7°
NC	MG	NB	C1B	176.0°	143.4°
NC	MG	NB	C4B	15.0°	9.0°
MG	NC	C1C	C4C	167.2°	150.4°
MG	NC	C1C	C2C	166.8°	170.8°
MG	NC	C4C	C3C	166.8°	170.9°
NC	MG	ND	C1D	19.3°	3.4°
NC	MG	ND	C4D	174.4°	141.2°
MG	ND	C4D	CHA	11.5°	8.6°
MG	ND	C1D	CHD	12.7°	4.2°
ND	MG	NA	C1A	15.7°	3.9°
ND	MG	NA	C4A	175.9°	142.8°
ND	MG	NB	C1B	100.3°	108.5°
ND	MG	NB	C4B	90.7°	99.1°
ND	MG	NC	C1C	175.9°	140.5°
ND	MG	NC	C4C	18.9°	5.8°
MG	ND	C1D	C4D	167.9°	146.8°
MG	ND	C1D	C2D	169.1°	174.8°
MG	ND	C4D	C3D	170.3°	175.5°
C1A	CHA	C4D	CBD	172.9°	178.4°
CHA	C1A	NA	C2A	177.7°	173.7°
CHA	C1A	NA	C4A	178.9°	139.2°
CHA	C1A	C2A	C3A	179.4°	160.9°
CHA	C1A	C2A	CAA	60.1°	80.9°
CHA	C1A	C2A	H2A	62.2°	42.8°
C1A	CHA	C4D	ND	1.2°	3.1°
C1A	CHA	C4D	C3D	179.4°	168.9°
C1A	CHA	CBD	CAD	179.2°	179.8°
C1A	CHA	CBD	CGD	65.2°	60.9°
C1A	CHA	CBD	HBD	59.7°	60.4°
C4D	CHA	C1A	NA	1.4°	7.6°
C4D	CHA	C1A	C2A	178.6°	179.9°
CHA	C4D	ND	C1D	179.3°	142.1°
CHA	C4D	ND	C3D	178.3°	166.9°
CHA	C4D	C3D	C2D	179.1°	158.7°
CHA	C4D	C3D	CAD	3.1°	17.5°
C4D	CHA	CBD	CAD	8.6°	2.1°
C4D	CHA	CBD	CGD	107.0°	117.2°
C4D	CHA	CBD	HBD	128.2°	121.4°
CBD	CHA	C1A	NA	172.3°	170.2°
CBD	CHA	C1A	C2A	10.4°	2.1°
CBD	CHA	C4D	ND	174.1°	178.4°
CBD	CHA	C4D	C3D	7.7°	12.7°
CHA	CBD	CAD	C3D	7.1°	7.5°
CHA	CBD	CAD	OBD	174.8°	172.5°
CHA	CBD	CAD	CGD	118.1°	119.3°
CHA	CBD	CAD	HBD	119.7°	119.3°
CHA	CBD	CGD	HBD	124.9°	121.4°
CHA	CBD	CGD	O1D	40.8°	0.1°
CHA	CBD	CGD	O2D	140.5°	180.0°
C4A	CHB	C1B	HHB	180.0°	179.9°
CHB	C4A	NA	C1A	178.3°	136.8°
CHB	C4A	NA	C3A	178.3°	178.4°
CHB	C4A	C3A	C2A	177.2°	148.2°
CHB	C4A	C3A	CMA	65.1°	30.2°
CHB	C4A	C3A	H3A	57.8°	93.7°
C4A	CHB	C1B	NB	3.5°	5.5°
C4A	CHB	C1B	C2B	171.8°	178.8°
C1B	CHB	C4A	NA	2.0°	9.3°
C1B	CHB	C4A	C3A	176.0°	172.7°
CHB	C1B	NB	C2B	175.8°	177.0°
CHB	C1B	NB	C4B	179.3°	143.9°
CHB	C1B	C2B	C3B	177.5°	158.3°
CHB	C1B	C2B	CMB	0.3°	21.7°
HHB	CHB	C4A	NA	178.0°	170.6°
HHB	CHB	C4A	C3A	4.0°	7.3°
HHB	CHB	C1B	NB	176.6°	174.6°
HHB	CHB	C1B	C2B	8.2°	1.1°
C4B	CHC	C1C	HHC	180.0°	179.9°
CHC	C4B	NB	C1B	179.7°	140.3°
CHC	C4B	NB	C3B	176.4°	174.7°
CHC	C4B	C3B	C2B	179.1°	152.0°
CHC	C4B	C3B	CAB	7.0°	28.0°
C4B	CHC	C1C	NC	0.8°	11.7°
C4B	CHC	C1C	C2C	179.2°	177.8°
C1C	CHC	C4B	NB	1.4°	5.6°
C1C	CHC	C4B	C3B	174.3°	177.9°
CHC	C1C	NC	C2C	180.0°	173.1°
CHC	C1C	NC	C4C	179.6°	134.2°
CHC	C1C	C2C	C3C	180.0°	149.0°
CHC	C1C	C2C	CMC	1.8°	31.0°
HHC	CHC	C4B	NB	178.6°	174.5°
HHC	CHC	C4B	C3B	5.8°	2.2°
HHC	CHC	C1C	NC	179.2°	168.1°
HHC	CHC	C1C	C2C	0.8°	2.3°
C4C	CHD	C1D	HHD	180.0°	180.0°
CHD	C4C	NC	C1C	178.6°	135.7°
CHD	C4C	NC	C3C	179.2°	174.3°
CHD	C4C	C3C	C2C	178.7°	151.3°
CHD	C4C	C3C	CAC	3.1°	28.6°
C4C	CHD	C1D	ND	2.0°	4.9°
C4C	CHD	C1D	C2D	176.0°	161.5°
C1D	CHD	C4C	NC	0.4°	15.5°
C1D	CHD	C4C	C3C	178.6°	172.2°
CHD	C1D	ND	C2D	178.2°	170.7°
CHD	C1D	ND	C4D	179.5°	142.6°
CHD	C1D	C2D	C3D	179.1°	146.3°
CHD	C1D	C2D	CMD	1.4°	33.6°
HHD	CHD	C4C	NC	179.6°	164.4°
HHD	CHD	C4C	C3C	1.4°	7.8°
HHD	CHD	C1D	ND	178.0°	175.1°
HHD	CHD	C1D	C2D	4.0°	18.5°
NA	C1A	C2A	C3A	1.8°	12.4°
NA	C1A	C2A	CAA	117.5°	105.8°
NA	C1A	C2A	H2A	120.2°	130.6°
C1A	NA	C4A	C3A	0.1°	41.6°
C4A	NA	C1A	C2A	1.3°	34.5°
NA	C4A	C3A	C2A	1.1°	30.1°
NA	C4A	C3A	CMA	116.6°	148.1°
NA	C4A	C3A	H3A	120.5°	88.0°
C1A	C2A	C3A	CAA	119.0°	118.2°
C1A	C2A	C3A	H2A	118.5°	118.2°
C1A	C2A	CAA	H2A	122.8°	123.6°
C1A	C2A	C3A	C4A	1.7°	10.3°
C1A	C2A	C3A	CMA	115.9°	128.4°
C1A	C2A	C3A	H3A	121.3°	107.7°
C1A	C2A	CAA	CBA	96.7°	175.0°
C1A	C2A	CAA	HAA1	142.2°	55.0°
C1A	C2A	CAA	HAA2	24.4°	65.0°
C3A	C2A	CAA	H2A	122.9°	123.5°
C2A	C3A	C4A	CMA	117.7°	118.0°
C2A	C3A	C4A	H3A	119.4°	118.1°
C2A	C3A	CMA	H3A	122.8°	124.0°
C2A	C3A	CMA	HMA1	180.0°	60.0°
C2A	C3A	CMA	HMA2	60.0°	180.0°
C2A	C3A	CMA	HMA3	60.0°	60.0°
C3A	C2A	CAA	CBA	17.6°	72.0°
C3A	C2A	CAA	HAA1	103.5°	168.0°
C3A	C2A	CAA	HAA2	138.7°	47.9°
CAA	C2A	C3A	C4A	117.3°	128.5°
CAA	C2A	C3A	CMA	125.2°	113.4°
CAA	C2A	C3A	H3A	2.4°	10.5°
C2A	CAA	CBA	HAA1	121.1°	120.0°
C2A	CAA	CBA	HAA2	121.1°	120.0°
C2A	CAA	HAA1	HAA2	116.6°	120.1°
C2A	CAA	CBA	CGA	143.2°	180.0°
C2A	CAA	CBA	HBA1	22.5°	60.0°
C2A	CAA	CBA	HBA2	96.2°	60.0°
H2A	C2A	C3A	C4A	120.2°	107.9°
H2A	C2A	C3A	CMA	2.6°	10.2°
H2A	C2A	C3A	H3A	120.1°	134.1°
H2A	C2A	CAA	CBA	140.4°	51.4°
H2A	C2A	CAA	HAA1	19.4°	68.6°
H2A	C2A	CAA	HAA2	98.5°	171.4°
C4A	C3A	CMA	H3A	123.1°	123.9°
C4A	C3A	CMA	HMA1	65.9°	172.1°
C4A	C3A	CMA	HMA2	54.1°	67.9°
C4A	C3A	CMA	HMA3	174.1°	52.0°
C3A	CMA	HMA1	HMA2	120.0°	120.0°
C3A	CMA	HMA1	HMA3	120.0°	120.1°
C3A	CMA	HMA2	HMA3	120.0°	120.0°
H3A	C3A	CMA	HMA1	57.2°	63.9°
H3A	C3A	CMA	HMA2	177.2°	56.0°
H3A	C3A	CMA	HMA3	62.8°	176.0°
HMA1	CMA	HMA2	HMA3	120.0°	120.0°
CBA	CAA	HAA1	HAA2	116.6°	119.9°
CAA	CBA	CGA	HBA1	120.7°	120.0°
CAA	CBA	CGA	HBA2	120.7°	120.0°
CAA	CBA	HBA1	HBA2	117.9°	119.9°
CAA	CBA	CGA	O1A	84.4°	0.0°
CAA	CBA	CGA	O2A	96.7°	180.0°
HAA1	CAA	CBA	CGA	95.8°	60.0°
HAA1	CAA	CBA	HBA1	143.6°	180.0°
HAA1	CAA	CBA	HBA2	24.9°	60.1°
HAA2	CAA	CBA	CGA	22.1°	60.0°
HAA2	CAA	CBA	HBA1	98.6°	60.1°
HAA2	CAA	CBA	HBA2	142.7°	180.0°
CGA	CBA	HBA1	HBA2	117.9°	120.0°
CBA	CGA	O1A	O2A	178.8°	180.0°
CBA	CGA	O2A	C1	175.8°	180.0°
HBA1	CBA	CGA	O1A	36.2°	120.0°
HBA1	CBA	CGA	O2A	142.6°	60.0°
HBA2	CBA	CGA	O1A	154.9°	120.0°
HBA2	CBA	CGA	O2A	23.9°	60.0°
O1A	CGA	O2A	C1	3.0°	0.0°
CGA	O2A	C1	C2	89.1°	180.0°
CGA	O2A	C1	H11	30.6°	60.0°
CGA	O2A	C1	H12	151.2°	60.0°
O2A	C1	C2	H11	119.7°	119.9°
O2A	C1	C2	H12	119.7°	120.0°
O2A	C1	H11	H12	120.9°	120.0°
O2A	C1	C2	C3	55.2°	135.5°
O2A	C1	C2	H2	124.8°	44.6°
NB	C1B	C2B	C3B	1.6°	17.8°
NB	C1B	C2B	CMB	175.6°	162.1°
C1B	NB	C4B	C3B	3.9°	34.4°
C4B	NB	C1B	C2B	3.4°	33.2°
NB	C4B	C3B	C2B	2.9°	21.3°
NB	C4B	C3B	CAB	169.2°	158.7°
C1B	C2B	C3B	CMB	177.0°	179.9°
C1B	C2B	C3B	C4B	0.8°	2.3°
C1B	C2B	C3B	CAB	173.2°	177.7°
C1B	C2B	CMB	HMB1	88.4°	90.0°
C1B	C2B	CMB	HMB2	151.5°	150.0°
C1B	C2B	CMB	HMB3	31.6°	30.0°
C2B	C3B	C4B	CAB	172.1°	180.0°
C3B	C2B	CMB	HMB1	88.2°	90.1°
C3B	C2B	CMB	HMB2	31.8°	29.9°
C3B	C2B	CMB	HMB3	151.8°	150.0°
C2B	C3B	CAB	CBB	161.5°	50.0°
C2B	C3B	CAB	HAB	18.5°	130.0°
CMB	C2B	C3B	C4B	177.9°	177.8°
CMB	C2B	C3B	CAB	3.9°	2.3°
C2B	CMB	HMB1	HMB2	120.0°	120.0°
C2B	CMB	HMB1	HMB3	120.0°	120.0°
C2B	CMB	HMB2	HMB3	120.0°	120.0°
C4B	C3B	CAB	CBB	26.9°	130.0°
C4B	C3B	CAB	HAB	153.1°	50.0°
C3B	CAB	CBB	HAB	180.0°	180.0°
C3B	CAB	CBB	HBB1	180.0°	180.0°
C3B	CAB	CBB	HBB2	0.0°	0.0°
HMB1	CMB	HMB2	HMB3	119.9°	120.0°
CAB	CBB	HBB1	HBB2	180.0°	180.0°
HAB	CAB	CBB	HBB1	0.1°	0.0°
HAB	CAB	CBB	HBB2	180.0°	180.0°
NC	C1C	C2C	C3C	0.0°	22.8°
NC	C1C	C2C	CMC	178.2°	157.2°
C1C	NC	C4C	C3C	0.5°	38.6°
C4C	NC	C1C	C2C	0.4°	38.9°
NC	C4C	C3C	C2C	0.5°	22.2°
NC	C4C	C3C	CAC	177.7°	157.9°
C1C	C2C	C3C	CMC	178.1°	180.0°
C1C	C2C	C3C	C4C	0.3°	0.3°
C1C	C2C	C3C	CAC	177.8°	179.6°
C1C	C2C	CMC	HMC1	180.0°	90.0°
C1C	C2C	CMC	HMC2	60.0°	149.9°
C1C	C2C	CMC	HMC3	60.0°	30.0°
C2C	C3C	C4C	CAC	178.2°	179.9°
C3C	C2C	CMC	HMC1	2.3°	90.0°
C3C	C2C	CMC	HMC2	122.2°	30.1°
C3C	C2C	CMC	HMC3	117.7°	150.0°
C2C	C3C	CAC	CBC	111.9°	95.1°
C2C	C3C	CAC	HAC1	127.9°	144.9°
C2C	C3C	CAC	HAC2	8.3°	25.0°
CMC	C2C	C3C	C4C	177.8°	179.7°
CMC	C2C	C3C	CAC	4.1°	0.4°
C2C	CMC	HMC1	HMC2	120.0°	120.1°
C2C	CMC	HMC1	HMC3	120.0°	120.0°
C2C	CMC	HMC2	HMC3	120.0°	119.9°
C4C	C3C	CAC	CBC	70.3°	85.0°
C4C	C3C	CAC	HAC1	49.9°	35.0°
C4C	C3C	CAC	HAC2	169.5°	154.9°
C3C	CAC	CBC	HAC1	120.2°	120.0°
C3C	CAC	CBC	HAC2	120.2°	120.0°
C3C	CAC	HAC1	HAC2	119.4°	119.9°
C3C	CAC	CBC	HBC1	180.0°	180.0°
C3C	CAC	CBC	HBC2	60.0°	60.0°
C3C	CAC	CBC	HBC3	60.0°	60.0°
HMC1	CMC	HMC2	HMC3	120.0°	120.0°
CBC	CAC	HAC1	HAC2	119.4°	120.1°
CAC	CBC	HBC1	HBC2	120.0°	120.0°
CAC	CBC	HBC1	HBC3	120.0°	120.0°
CAC	CBC	HBC2	HBC3	120.0°	120.1°
HAC1	CAC	CBC	HBC1	59.8°	60.0°
HAC1	CAC	CBC	HBC2	179.9°	180.0°
HAC1	CAC	CBC	HBC3	60.2°	59.9°
HAC2	CAC	CBC	HBC1	59.8°	60.0°
HAC2	CAC	CBC	HBC2	60.2°	59.9°
HAC2	CAC	CBC	HBC3	179.8°	180.0°
HBC1	CBC	HBC2	HBC3	120.0°	120.0°
ND	C1D	C2D	C3D	0.9°	21.5°
ND	C1D	C2D	CMD	179.5°	158.6°
C1D	ND	C4D	C3D	1.1°	24.8°
C4D	ND	C1D	C2D	1.2°	28.0°
ND	C4D	C3D	C2D	0.5°	10.3°
ND	C4D	C3D	CAD	178.3°	173.6°
C1D	C2D	C3D	CMD	179.6°	180.0°
C1D	C2D	C3D	C4D	0.2°	7.4°
C1D	C2D	C3D	CAD	176.1°	164.4°
C1D	C2D	CMD	HMD1	180.0°	90.0°
C1D	C2D	CMD	HMD2	60.0°	150.0°
C1D	C2D	CMD	HMD3	60.0°	30.0°
C2D	C3D	C4D	CAD	177.8°	176.2°
C3D	C2D	CMD	HMD1	0.5°	90.0°
C3D	C2D	CMD	HMD2	119.4°	30.0°
C3D	C2D	CMD	HMD3	120.5°	150.0°
C2D	C3D	CAD	OBD	4.5°	22.2°
C2D	C3D	CAD	CBD	173.3°	157.9°
CMD	C2D	C3D	C4D	179.8°	172.7°
CMD	C2D	C3D	CAD	3.5°	15.5°
C2D	CMD	HMD1	HMD2	120.0°	120.0°
C2D	CMD	HMD1	HMD3	120.0°	120.1°
C2D	CMD	HMD2	HMD3	120.0°	120.0°
C4D	C3D	CAD	OBD	179.2°	166.0°
C4D	C3D	CAD	CBD	3.0°	14.0°
C3D	CAD	OBD	CBD	177.6°	180.0°
C3D	CAD	CBD	CGD	111.0°	126.8°
C3D	CAD	CBD	HBD	126.8°	111.8°
HMD1	CMD	HMD2	HMD3	120.0°	119.9°
OBD	CAD	CBD	CGD	67.1°	53.2°
OBD	CAD	CBD	HBD	55.1°	68.2°
CAD	CBD	CGD	HBD	122.1°	121.4°
CAD	CBD	CGD	O1D	72.2°	117.4°
CAD	CBD	CGD	O2D	106.5°	62.7°
CBD	CGD	O1D	O2D	178.7°	179.9°
CBD	CGD	O2D	CED	153.6°	180.0°
HBD	CBD	CGD	O1D	165.7°	121.3°
HBD	CBD	CGD	O2D	15.6°	58.6°
O1D	CGD	O2D	CED	25.1°	0.1°
CGD	O2D	CED	HED1	180.0°	60.0°
CGD	O2D	CED	HED2	60.0°	60.0°
CGD	O2D	CED	HED3	60.0°	179.9°
O2D	CED	HED1	HED2	120.0°	119.9°
O2D	CED	HED1	HED3	120.0°	120.0°
O2D	CED	HED2	HED3	120.0°	120.0°
HED1	CED	HED2	HED3	119.9°	120.1°
C2	C1	H11	H12	120.9°	120.0°
C1	C2	C3	H2	180.0°	179.9°
C1	C2	C3	C4	2.6°	5.6°
C1	C2	C3	C5	179.3°	174.4°
H11	C1	C2	C3	174.9°	104.6°
H11	C1	C2	H2	5.1°	75.3°
H12	C1	C2	C3	64.5°	15.5°
H12	C1	C2	H2	115.5°	164.6°
C2	C3	C4	C5	178.3°	180.0°
C2	C3	C4	H41	180.0°	84.9°
C2	C3	C4	H42	60.0°	155.0°
C2	C3	C4	H43	60.0°	35.1°
C2	C3	C5	C6	20.7°	95.0°
C2	C3	C5	H51	100.2°	145.0°
C2	C3	C5	H52	141.6°	25.0°
H2	C2	C3	C4	177.4°	174.3°
H2	C2	C3	C5	0.7°	5.7°
C3	C4	H41	H42	120.0°	120.1°
C3	C4	H41	H43	120.0°	120.0°
C3	C4	H42	H43	120.0°	120.0°
C4	C3	C5	C6	161.1°	85.0°
C4	C3	C5	H51	78.0°	35.0°
C4	C3	C5	H52	40.2°	155.0°
C5	C3	C4	H41	1.7°	95.1°
C5	C3	C4	H42	118.2°	24.9°
C5	C3	C4	H43	121.8°	144.9°
C3	C5	C6	H51	120.9°	120.0°
C3	C5	C6	H52	120.9°	120.0°
C3	C5	H51	H52	117.2°	120.0°
C3	C5	C6	C7	64.2°	180.0°
C3	C5	C6	H61	56.4°	60.0°
C3	C5	C6	H62	175.3°	60.0°
H41	C4	H42	H43	120.0°	120.0°
C6	C5	H51	H52	117.3°	120.0°
C5	C6	C7	H61	120.5°	120.0°
C5	C6	C7	H62	120.5°	120.0°
C5	C6	H61	H62	118.3°	120.0°
C5	C6	C7	C8	152.1°	NaN°
C5	C6	C7	H71	87.5°	60.0°
C5	C6	C7	H72	31.7°	60.0°
H51	C5	C6	C7	174.9°	60.0°
H51	C5	C6	H61	64.5°	180.0°
H51	C5	C6	H62	54.4°	60.0°
H52	C5	C6	C7	56.7°	60.0°
H52	C5	C6	H61	177.2°	60.0°
H52	C5	C6	H62	63.8°	180.0°
C7	C6	H61	H62	118.3°	120.0°
C6	C7	C8	H71	120.4°	120.0°
C6	C7	C8	H72	120.4°	120.0°
C6	C7	H71	H72	118.8°	120.0°
C6	C7	C8	C9	159.0°	65.0°
C6	C7	C8	C10	79.7°	175.0°
C6	C7	C8	H8	39.0°	55.0°
H61	C6	C7	C8	31.6°	60.0°
H61	C6	C7	H71	151.9°	180.0°
H61	C6	C7	H72	88.8°	60.0°
H62	C6	C7	C8	87.4°	60.0°
H62	C6	C7	H71	33.0°	60.0°
H62	C6	C7	H72	152.3°	180.0°
C8	C7	H71	H72	118.9°	120.0°
C7	C8	C9	C10	119.8°	119.9°
C7	C8	C9	H8	120.0°	120.0°
C7	C8	C10	H8	118.5°	120.0°
C7	C8	C9	H91	180.0°	60.0°
C7	C8	C9	H92	60.0°	180.0°
C7	C8	C9	H93	60.0°	60.0°
C7	C8	C10	C11	140.8°	175.0°
C7	C8	C10	H101	19.4°	55.0°
C7	C8	C10	H102	97.9°	65.0°
H71	C7	C8	C9	80.6°	175.0°
H71	C7	C8	C10	40.6°	55.0°
H71	C7	C8	H8	159.3°	65.0°
H72	C7	C8	C9	38.7°	55.0°
H72	C7	C8	C10	159.9°	65.0°
H72	C7	C8	H8	81.4°	175.0°
C9	C8	C10	H8	120.2°	120.0°
C8	C9	H91	H92	120.0°	119.9°
C8	C9	H91	H93	120.0°	120.0°
C8	C9	H92	H93	120.0°	120.0°
C9	C8	C10	C11	97.9°	65.0°
C9	C8	C10	H101	140.8°	175.0°
C9	C8	C10	H102	23.4°	54.9°
C10	C8	C9	H91	60.2°	180.0°
C10	C8	C9	H92	59.8°	60.1°
C10	C8	C9	H93	179.8°	60.0°
C8	C10	C11	H101	121.4°	120.0°
C8	C10	C11	H102	121.3°	120.0°
C8	C10	H101	H102	115.7°	120.0°
C8	C10	C11	C12	165.6°	180.0°
C8	C10	C11	H111	75.5°	60.0°
C8	C10	C11	H112	46.8°	60.1°
H8	C8	C9	H91	60.0°	60.0°
H8	C8	C9	H92	179.9°	60.0°
H8	C8	C9	H93	60.0°	NaN°
H8	C8	C10	C11	22.3°	55.0°
H8	C8	C10	H101	99.1°	65.0°
H8	C8	C10	H102	143.6°	175.0°
H91	C9	H92	H93	120.0°	120.1°
C11	C10	H101	H102	115.7°	120.0°
C10	C11	C12	H111	118.9°	120.0°
C10	C11	C12	H112	118.9°	119.9°
C10	C11	H111	H112	123.3°	120.0°
C10	C11	C12	C13	132.7°	180.0°
C10	C11	C12	H121	105.8°	60.0°
C10	C11	C12	H122	11.2°	60.0°
H101	C10	C11	C12	44.3°	60.0°
H101	C10	C11	H111	163.1°	180.0°
H101	C10	C11	H112	74.6°	59.9°
H102	C10	C11	C12	73.0°	60.0°
H102	C10	C11	H111	45.8°	60.0°
H102	C10	C11	H112	168.1°	180.0°
C12	C11	H111	H112	123.2°	120.1°
C11	C12	C13	H121	121.5°	120.0°
C11	C12	C13	H122	121.5°	120.0°
C11	C12	H121	H122	115.2°	120.0°
C11	C12	C13	C14	75.1°	65.0°
C11	C12	C13	C15	49.4°	175.0°
C11	C12	C13	H13	166.6°	54.9°
H111	C11	C12	C13	13.8°	60.1°
H111	C11	C12	H121	135.3°	180.0°
H111	C11	C12	H122	107.7°	59.9°
H112	C11	C12	C13	108.4°	60.0°
H112	C11	C12	H121	13.1°	59.9°
H112	C11	C12	H122	130.1°	180.0°
C13	C12	H121	H122	115.1°	120.0°
C12	C13	C14	C15	123.7°	119.9°
C12	C13	C14	H13	118.2°	120.0°
C12	C13	C15	H13	117.2°	120.1°
C12	C13	C14	H141	180.0°	60.0°
C12	C13	C14	H142	60.0°	60.1°
C12	C13	C14	H143	60.0°	180.0°
C12	C13	C15	C16	64.7°	175.0°
C12	C13	C15	H151	56.5°	55.0°
C12	C13	C15	H152	174.1°	65.0°
H121	C12	C13	C14	46.4°	175.0°
H121	C12	C13	C15	170.9°	55.1°
H121	C12	C13	H13	71.8°	65.0°
H122	C12	C13	C14	163.4°	55.0°
H122	C12	C13	C15	72.1°	65.0°
H122	C12	C13	H13	45.1°	174.9°
C14	C13	C15	H13	118.2°	120.0°
C13	C14	H141	H142	120.0°	120.0°
C13	C14	H141	H143	120.0°	120.0°
C13	C14	H142	H143	120.0°	119.9°
C14	C13	C15	C16	170.7°	65.1°
C14	C13	C15	H151	68.1°	175.0°
C14	C13	C15	H152	49.5°	55.0°
C15	C13	C14	H141	56.2°	60.0°
C15	C13	C14	H142	63.7°	180.0°
C15	C13	C14	H143	176.3°	60.1°
C13	C15	C16	H151	121.2°	119.9°
C13	C15	C16	H152	121.2°	120.0°
C13	C15	H151	H152	116.2°	120.0°
C13	C15	C16	C17	72.3°	180.0°
C13	C15	C16	H161	48.6°	60.0°
C13	C15	C16	H162	166.9°	60.0°
H13	C13	C14	H141	61.8°	179.9°
H13	C13	C14	H142	178.2°	59.9°
H13	C13	C14	H143	58.2°	60.0°
H13	C13	C15	C16	52.5°	55.0°
H13	C13	C15	H151	173.7°	65.0°
H13	C13	C15	H152	68.7°	175.0°
H141	C14	H142	H143	120.0°	120.0°
C16	C15	H151	H152	116.2°	120.1°
C15	C16	C17	H161	120.9°	120.0°
C15	C16	C17	H162	120.9°	120.1°
C15	C16	H161	H162	117.3°	120.0°
C15	C16	C17	C18	134.4°	180.0°
C15	C16	C17	H171	13.8°	60.0°
C15	C16	C17	H172	105.1°	60.0°
H151	C15	C16	C17	166.5°	60.1°
H151	C15	C16	H161	72.7°	179.9°
H151	C15	C16	H162	45.6°	59.9°
H152	C15	C16	C17	48.9°	60.0°
H152	C15	C16	H161	169.8°	60.0°
H152	C15	C16	H162	72.0°	180.0°
C17	C16	H161	H162	117.3°	120.0°
C16	C17	C18	H171	120.5°	120.0°
C16	C17	C18	H172	120.5°	120.0°
C16	C17	H171	H172	118.3°	120.0°
C16	C17	C18	C19	89.2°	65.0°
C16	C17	C18	C20	148.7°	175.0°
C16	C17	C18	H18	30.4°	55.0°
H161	C16	C17	C18	104.8°	60.0°
H161	C16	C17	H171	134.7°	180.0°
H161	C16	C17	H172	15.8°	60.0°
H162	C16	C17	C18	13.5°	60.0°
H162	C16	C17	H171	107.1°	60.1°
H162	C16	C17	H172	134.0°	179.9°
C18	C17	H171	H172	118.4°	119.9°
C17	C18	C19	C20	122.0°	120.0°
C17	C18	C19	H18	119.5°	120.0°
C17	C18	C20	H18	118.1°	120.0°
C17	C18	C19	H191	180.0°	60.0°
C17	C18	C19	H192	60.0°	180.0°
C17	C18	C19	H193	60.0°	60.1°
C17	C18	C20	H201	180.0°	60.0°
C17	C18	C20	H202	60.0°	179.9°
C17	C18	C20	H203	60.0°	60.0°
H171	C17	C18	C19	31.3°	55.0°
H171	C17	C18	C20	90.8°	65.0°
H171	C17	C18	H18	150.9°	175.1°
H172	C17	C18	C19	150.3°	175.0°
H172	C17	C18	C20	28.2°	55.0°
H172	C17	C18	H18	90.2°	65.0°
C19	C18	C20	H18	118.5°	120.1°
C18	C19	H191	H192	120.0°	120.0°
C18	C19	H191	H193	120.0°	120.0°
C18	C19	H192	H193	120.0°	119.9°
C19	C18	C20	H201	56.6°	179.9°
C19	C18	C20	H202	63.3°	60.0°
C19	C18	C20	H203	176.7°	60.0°
C20	C18	C19	H191	58.0°	60.0°
C20	C18	C19	H192	178.0°	60.1°
C20	C18	C19	H193	62.0°	180.0°
C18	C20	H201	H202	120.0°	120.0°
C18	C20	H201	H203	120.0°	120.0°
C18	C20	H202	H203	120.0°	120.0°
H18	C18	C19	H191	60.6°	180.0°
H18	C18	C19	H192	59.4°	60.0°
H18	C18	C19	H193	179.4°	59.9°
H18	C18	C20	H201	61.9°	60.0°
H18	C18	C20	H202	178.2°	60.1°
H18	C18	C20	H203	58.1°	180.0°
H191	C19	H192	H193	120.0°	120.0°
H201	C20	H202	H203	120.0°	120.0°

Definition date:	1999-07-08
Last modified:	2021-06-25
Release status:	REL
Processing site:	RCSB
Derived from:	1JB0