CFC

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	0.00Å	1.39Å
C1	C5	sing	0.00Å	1.39Å
C1	C11	sing	0.00Å	1.52Å
C1	FE	sing	0.00Å	2.01Å
C2	C3	sing	0.00Å	1.39Å
C2	FE	sing	0.00Å	2.01Å
C2	H2	sing	0.00Å	1.11Å
C3	C4	sing	0.00Å	1.39Å
C3	FE	sing	0.00Å	2.02Å
C3	H3	sing	0.00Å	1.11Å
C4	C5	sing	0.00Å	1.39Å
C4	FE	sing	0.00Å	2.02Å
C4	H4	sing	0.00Å	1.12Å
C5	FE	sing	0.00Å	2.02Å
C5	H5	sing	0.00Å	1.12Å
C6	C7	sing	0.00Å	1.39Å
C6	C10	sing	0.00Å	1.39Å
C6	FE	sing	0.00Å	2.02Å
C6	C14	sing	0.00Å	1.46Å
C7	C8	sing	0.00Å	1.39Å
C7	FE	sing	0.00Å	2.01Å
C7	H7	sing	0.00Å	1.11Å
C8	C9	sing	0.00Å	1.39Å
C8	FE	sing	0.00Å	2.01Å
C8	H8	sing	0.00Å	1.11Å
C9	C10	sing	0.00Å	1.39Å
C9	FE	sing	0.00Å	2.02Å
C9	H9	sing	0.00Å	1.12Å
C10	FE	sing	0.00Å	2.02Å
C10	H10	sing	0.00Å	1.11Å
O1	C11	doub	0.00Å	1.27Å
O2	C14	sing	0.00Å	1.31Å
O2	HO2	sing	0.00Å	0.95Å
C11	N1	sing	0.00Å	1.31Å
O3	C14	doub	0.00Å	1.22Å
N1	C12	sing	0.00Å	1.47Å
N1	C13	sing	0.00Å	1.47Å
C12	H121	sing	0.00Å	1.11Å
C12	H122	sing	0.00Å	1.11Å
C12	H123	sing	0.00Å	1.12Å
C13	H131	sing	0.00Å	1.11Å
C13	H132	sing	0.00Å	1.12Å
C13	H133	sing	0.00Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	C5	107.9°	90.0°
C2	C1	C11	135.7°	90.0°
C2	C1	FE	69.7°	90.0°
C1	C2	C3	108.0°	90.0°
C1	C2	FE	69.8°	90.0°
C1	C2	H2	122.4°	90.0°
C5	C1	C11	116.3°	90.0°
C5	C1	FE	70.2°	90.0°
C1	C5	C4	108.0°	90.0°
C1	C5	FE	69.4°	90.0°
C1	C5	H5	122.5°	90.0°
C11	C1	FE	122.9°	90.0°
C1	C11	O1	117.6°	90.0°
C1	C11	N1	120.3°	90.0°
C1	FE	C2	40.5°	90.0°
C1	FE	C3	67.9°	90.0°
C1	FE	C4	67.9°	90.0°
C1	FE	C5	40.4°	90.0°
C1	FE	C6	112.8°	90.0°
C1	FE	C7	141.4°	90.0°
C1	FE	C8	177.8°	90.0°
C1	FE	C9	137.7°	90.0°
C1	FE	C10	111.3°	90.0°
C3	C2	FE	70.2°	90.0°
C3	C2	H2	122.1°	90.0°
C2	C3	C4	108.0°	90.0°
C2	C3	FE	69.4°	90.0°
C2	C3	H3	122.5°	90.0°
FE	C2	H2	150.5°	90.0°
C2	FE	C3	40.4°	90.0°
C2	FE	C4	67.8°	90.0°
C2	FE	C5	67.9°	90.0°
C2	FE	C6	109.6°	90.0°
C2	FE	C7	111.8°	90.0°
C2	FE	C8	141.5°	90.0°
C2	FE	C9	176.5°	90.0°
C2	FE	C10	136.3°	90.0°
C4	C3	FE	70.0°	90.0°
C4	C3	H3	122.1°	90.0°
C3	C4	C5	108.1°	90.0°
C3	C4	FE	69.8°	90.0°
C3	C4	H4	122.3°	90.0°
FE	C3	H3	150.8°	90.0°
C3	FE	C4	40.2°	90.0°
C3	FE	C5	67.7°	90.0°
C3	FE	C6	135.6°	90.0°
C3	FE	C7	109.9°	90.0°
C3	FE	C8	113.2°	90.0°
C3	FE	C9	143.1°	90.0°
C3	FE	C10	175.5°	90.0°
C5	C4	FE	69.8°	90.0°
C5	C4	H4	122.2°	90.0°
C4	C5	FE	69.9°	90.0°
C4	C5	H5	122.1°	90.0°
FE	C4	H4	150.7°	90.0°
C4	FE	C5	40.3°	90.0°
C4	FE	C6	175.5°	90.0°
C4	FE	C7	136.4°	90.0°
C4	FE	C8	111.6°	90.0°
C4	FE	C9	114.9°	90.0°
C4	FE	C10	144.0°	90.0°
FE	C5	H5	150.8°	90.0°
C5	FE	C6	142.9°	90.0°
C5	FE	C7	176.7°	90.0°
C5	FE	C8	137.9°	90.0°
C5	FE	C9	112.6°	90.0°
C5	FE	C10	114.8°	90.0°
C7	C6	C10	108.1°	90.0°
C7	C6	FE	69.7°	90.0°
C7	C6	C14	121.5°	90.0°
C6	C7	C8	107.9°	90.0°
C6	C7	FE	69.9°	90.0°
C6	C7	H7	122.3°	90.0°
C10	C6	FE	70.1°	90.0°
C10	C6	C14	130.4°	90.0°
C6	C10	C9	108.0°	90.0°
C6	C10	FE	69.7°	90.0°
C6	C10	H10	122.4°	90.0°
FE	C6	C14	125.5°	90.0°
C6	FE	C7	40.4°	90.0°
C6	FE	C8	67.8°	90.0°
C6	FE	C9	67.8°	90.0°
C6	FE	C10	40.3°	90.0°
C6	C14	O2	123.2°	90.0°
C6	C14	O3	117.4°	90.0°
C8	C7	FE	69.9°	90.0°
C8	C7	H7	122.3°	90.0°
C7	C8	C9	108.0°	90.0°
C7	C8	FE	69.8°	90.0°
C7	C8	H8	122.3°	90.0°
FE	C7	H7	150.5°	90.0°
C7	FE	C8	40.4°	90.0°
C7	FE	C9	67.8°	90.0°
C7	FE	C10	67.8°	90.0°
C9	C8	FE	70.0°	90.0°
C9	C8	H8	122.2°	90.0°
C8	C9	C10	108.0°	90.0°
C8	C9	FE	69.7°	90.0°
C8	C9	H9	122.3°	90.0°
FE	C8	H8	150.6°	90.0°
C8	FE	C9	40.3°	90.0°
C8	FE	C10	67.8°	90.0°
C10	C9	FE	70.0°	90.0°
C10	C9	H9	122.2°	90.0°
C9	C10	FE	69.7°	90.0°
C9	C10	H10	122.3°	90.0°
FE	C9	H9	150.5°	90.0°
C9	FE	C10	40.3°	90.0°
FE	C10	H10	150.7°	90.0°
O1	C11	N1	121.7°	90.0°
C14	O2	HO2	123.2°	90.0°
O2	C14	O3	119.4°	90.0°
C11	N1	C12	112.0°	90.0°
C11	N1	C13	134.5°	90.0°
C12	N1	C13	113.5°	90.0°
N1	C12	H121	112.0°	90.0°
N1	C12	H122	111.3°	90.0°
N1	C12	H123	111.2°	90.0°
N1	C13	H131	134.5°	90.0°
N1	C13	H132	103.6°	90.0°
N1	C13	H133	103.6°	90.0°
H121	C12	H122	111.3°	90.0°
H121	C12	H123	111.2°	90.0°
H122	C12	H123	99.1°	90.0°
H131	C13	H132	103.6°	90.0°
H131	C13	H133	103.7°	90.0°
H132	C13	H133	105.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	C5	C11	177.5°	90.0°
C2	C1	C5	FE	59.7°	90.0°
C2	C1	C11	FE	94.1°	90.0°
C1	C2	C3	FE	59.8°	90.0°
C1	C2	C3	H2	150.2°	90.0°
C1	C2	FE	H2	120.4°	90.0°
C1	C2	C3	C4	0.2°	90.0°
C1	C2	C3	H3	150.2°	90.0°
C2	C1	C5	C4	0.2°	90.0°
C1	C2	FE	C4	81.4°	90.0°
C2	C1	C5	H5	150.2°	90.0°
C1	C2	FE	C6	102.5°	90.0°
C1	C2	FE	C7	145.8°	90.0°
C1	C2	FE	C8	178.7°	90.0°
C1	C2	FE	C9	61.7°	90.0°
C1	C2	FE	C10	65.6°	90.0°
C2	C1	C11	O1	149.0°	90.0°
C2	C1	C11	N1	23.7°	90.0°
C5	C1	C11	FE	82.5°	90.0°
C5	C1	C2	C3	0.0°	90.0°
C5	C1	C2	H2	150.1°	90.0°
C1	C5	C4	C3	0.3°	90.0°
C1	C5	FE	C3	81.7°	90.0°
C1	C5	C4	FE	59.2°	90.0°
C1	C5	C4	H5	150.6°	90.0°
C1	C5	C4	H4	150.8°	90.0°
C1	C5	FE	H5	120.3°	90.0°
C1	C5	FE	C6	55.8°	90.0°
C1	C5	FE	C7	124.1°	90.0°
C1	C5	FE	C8	177.9°	90.0°
C1	C5	FE	C9	138.4°	90.0°
C1	C5	FE	C10	94.3°	90.0°
C5	C1	C11	O1	27.7°	90.0°
C5	C1	C11	N1	159.7°	90.0°
C11	C1	C2	C3	176.8°	90.0°
C11	C1	C2	H2	33.0°	90.0°
C11	C1	FE	C3	169.8°	90.0°
C11	C1	C5	C4	177.3°	90.0°
C11	C1	FE	C4	146.7°	90.0°
C11	C1	C5	H5	32.2°	90.0°
C11	C1	FE	C6	38.1°	90.0°
C11	C1	FE	C7	75.2°	90.0°
C11	C1	FE	C8	69.4°	90.0°
C11	C1	FE	C9	43.5°	90.0°
C11	C1	FE	C10	5.5°	90.0°
C1	C11	O1	N1	172.5°	90.0°
C1	C11	N1	C12	171.9°	90.0°
C1	C11	N1	C13	7.6°	90.0°
C1	FE	C4	C3	81.6°	90.0°
C1	FE	C3	C6	100.7°	90.0°
C1	FE	C3	C7	138.6°	90.0°
C1	FE	C3	C8	178.0°	90.0°
C1	FE	C3	C9	142.2°	90.0°
C1	FE	C3	C10	81.1°	90.0°
C1	FE	C3	H3	158.1°	90.0°
C1	FE	C4	C6	99.9°	90.0°
C1	FE	C4	C7	142.8°	90.0°
C1	FE	C4	C8	177.7°	90.0°
C1	FE	C4	C9	133.8°	90.0°
C1	FE	C4	C10	96.2°	90.0°
C1	FE	C4	H4	158.0°	90.0°
C1	FE	C7	C6	59.2°	90.0°
C1	FE	C10	C6	100.6°	90.0°
C1	FE	C6	C8	177.8°	90.0°
C1	FE	C6	C9	134.0°	90.0°
C1	FE	C6	C14	29.6°	90.0°
C1	FE	C8	C7	146.1°	90.0°
C1	FE	C7	C9	140.4°	90.0°
C1	FE	C7	C10	96.8°	90.0°
C1	FE	C7	H7	61.5°	90.0°
C1	FE	C9	C8	178.5°	90.0°
C1	FE	C8	C10	64.7°	90.0°
C1	FE	C8	H8	93.5°	90.0°
C1	FE	C10	C9	140.2°	90.0°
C1	FE	C9	H9	58.2°	90.0°
C1	FE	C10	H10	19.8°	90.0°
FE	C1	C11	O1	54.9°	90.0°
FE	C1	C11	N1	117.8°	90.0°
C3	C2	FE	H2	120.7°	90.0°
C2	C3	C4	FE	59.2°	90.0°
C2	C3	C4	H3	150.5°	90.0°
C2	C3	FE	H3	120.2°	90.0°
C2	C3	C4	C5	0.3°	90.0°
C2	C3	C4	H4	150.7°	90.0°
C2	C3	FE	C5	81.7°	90.0°
C2	C3	FE	C6	62.8°	90.0°
C2	C3	FE	C7	100.7°	90.0°
C2	C3	FE	C8	144.1°	90.0°
C2	C3	FE	C9	179.9°	90.0°
C2	C3	FE	C10	43.2°	90.0°
C2	FE	C5	C4	81.3°	90.0°
C2	FE	C4	C6	56.0°	90.0°
C2	FE	C4	C7	98.9°	90.0°
C2	FE	C4	C8	138.3°	90.0°
C2	FE	C4	C9	177.7°	90.0°
C2	FE	C4	C10	140.1°	90.0°
C2	FE	C4	H4	158.1°	90.0°
C2	FE	C5	C6	93.7°	90.0°
C2	FE	C5	C7	86.2°	90.0°
C2	FE	C5	C8	144.1°	90.0°
C2	FE	C5	C9	176.3°	90.0°
C2	FE	C5	C10	132.2°	90.0°
C2	FE	C5	H5	158.2°	90.0°
C2	FE	C7	C6	95.0°	90.0°
C2	FE	C10	C6	61.2°	90.0°
C2	FE	C6	C8	138.7°	90.0°
C2	FE	C6	C9	177.6°	90.0°
C2	FE	C6	C14	13.9°	90.0°
C2	FE	C8	C7	56.3°	90.0°
C2	FE	C7	C9	176.3°	90.0°
C2	FE	C7	C10	132.6°	90.0°
C2	FE	C7	H7	25.6°	90.0°
C2	FE	C9	C8	123.2°	90.0°
C2	FE	C8	C10	137.7°	90.0°
C2	FE	C8	H8	64.2°	90.0°
C2	FE	C10	C9	179.6°	90.0°
C2	FE	C9	H9	116.5°	90.0°
C2	FE	C10	H10	59.3°	90.0°
H2	C2	C3	C4	150.4°	90.0°
H2	C2	C3	H3	0.0°	90.0°
H2	C2	FE	C4	158.2°	90.0°
H2	C2	FE	C5	158.2°	90.0°
H2	C2	FE	C6	17.9°	90.0°
H2	C2	FE	C7	25.3°	90.0°
H2	C2	FE	C8	60.8°	90.0°
H2	C2	FE	C9	58.8°	90.0°
H2	C2	FE	C10	54.9°	90.0°
C4	C3	FE	H3	120.5°	90.0°
C3	C4	C5	FE	59.5°	90.0°
C3	C4	C5	H4	150.4°	90.0°
C3	C4	FE	H4	120.5°	90.0°
C3	C4	C5	H5	150.3°	90.0°
C3	C4	FE	C6	18.4°	90.0°
C3	C4	FE	C7	61.2°	90.0°
C3	C4	FE	C8	100.7°	90.0°
C3	C4	FE	C9	144.7°	90.0°
C3	C4	FE	C10	177.7°	90.0°
C3	FE	C5	C6	137.5°	90.0°
C3	FE	C5	C7	42.4°	90.0°
C3	FE	C5	C8	100.4°	90.0°
C3	FE	C5	C9	139.9°	90.0°
C3	FE	C5	C10	176.0°	90.0°
C3	FE	C5	H5	158.0°	90.0°
C3	FE	C7	C6	138.3°	90.0°
C3	FE	C10	C6	21.2°	90.0°
C3	FE	C6	C8	101.0°	90.0°
C3	FE	C6	C9	144.7°	90.0°
C3	FE	C6	C14	51.7°	90.0°
C3	FE	C8	C7	93.9°	90.0°
C3	FE	C7	C9	140.4°	90.0°
C3	FE	C7	C10	175.9°	90.0°
C3	FE	C7	H7	17.7°	90.0°
C3	FE	C9	C8	56.2°	90.0°
C3	FE	C8	C10	175.3°	90.0°
C3	FE	C8	H8	26.6°	90.0°
C3	FE	C10	C9	140.4°	90.0°
C3	FE	C9	H9	64.1°	90.0°
C3	FE	C10	H10	99.2°	90.0°
H3	C3	C4	C5	150.2°	90.0°
H3	C3	C4	H4	0.2°	90.0°
H3	C3	FE	C5	158.1°	90.0°
H3	C3	FE	C6	57.5°	90.0°
H3	C3	FE	C7	19.5°	90.0°
H3	C3	FE	C8	23.9°	90.0°
H3	C3	FE	C9	59.7°	90.0°
H3	C3	FE	C10	77.0°	90.0°
C5	C4	FE	H4	120.4°	90.0°
C4	C5	FE	H5	120.4°	90.0°
C4	C5	FE	C6	175.0°	90.0°
C4	C5	FE	C7	4.8°	90.0°
C4	C5	FE	C8	62.8°	90.0°
C4	C5	FE	C9	102.4°	90.0°
C4	C5	FE	C10	146.5°	90.0°
C4	FE	C7	C6	175.3°	90.0°
C4	FE	C10	C6	178.1°	90.0°
C4	FE	C6	C8	84.1°	90.0°
C4	FE	C6	C9	127.9°	90.0°
C4	FE	C6	C14	68.5°	90.0°
C4	FE	C8	C7	137.5°	90.0°
C4	FE	C7	C9	103.4°	90.0°
C4	FE	C7	C10	147.1°	90.0°
C4	FE	C7	H7	54.6°	90.0°
C4	FE	C9	C8	94.7°	90.0°
C4	FE	C8	C10	141.1°	90.0°
C4	FE	C8	H8	17.0°	90.0°
C4	FE	C10	C9	58.9°	90.0°
C4	FE	C9	H9	25.7°	90.0°
C4	FE	C10	H10	61.5°	90.0°
H4	C4	C5	H5	0.2°	90.0°
H4	C4	FE	C6	102.1°	90.0°
H4	C4	FE	C7	59.2°	90.0°
H4	C4	FE	C8	19.7°	90.0°
H4	C4	FE	C9	24.2°	90.0°
H4	C4	FE	C10	61.8°	90.0°
C5	FE	C7	C6	179.9°	90.0°
C5	FE	C10	C6	144.5°	90.0°
C5	FE	C6	C8	142.2°	90.0°
C5	FE	C6	C9	98.5°	90.0°
C5	FE	C6	C14	65.1°	90.0°
C5	FE	C8	C7	175.7°	90.0°
C5	FE	C7	C9	98.9°	90.0°
C5	FE	C7	C10	142.5°	90.0°
C5	FE	C7	H7	59.2°	90.0°
C5	FE	C9	C8	138.8°	90.0°
C5	FE	C8	C10	102.9°	90.0°
C5	FE	C8	H8	55.2°	90.0°
C5	FE	C10	C9	96.3°	90.0°
C5	FE	C9	H9	18.4°	90.0°
C5	FE	C10	H10	24.1°	90.0°
H5	C5	FE	C6	64.6°	90.0°
H5	C5	FE	C7	115.6°	90.0°
H5	C5	FE	C8	57.6°	90.0°
H5	C5	FE	C9	18.1°	90.0°
H5	C5	FE	C10	26.1°	90.0°
C7	C6	C10	FE	59.6°	90.0°
C7	C6	C10	C14	179.8°	90.0°
C7	C6	FE	C14	114.9°	90.0°
C6	C7	C8	FE	59.8°	90.0°
C6	C7	C8	H7	150.4°	90.0°
C6	C7	FE	H7	120.7°	90.0°
C6	C7	C8	C9	0.1°	90.0°
C6	C7	C8	H8	150.3°	90.0°
C7	C6	C10	C9	0.1°	90.0°
C6	C7	FE	C9	81.3°	90.0°
C7	C6	C10	H10	150.4°	90.0°
C7	C6	C14	O2	0.5°	90.0°
C7	C6	C14	O3	179.9°	90.0°
C10	C6	FE	C14	126.0°	90.0°
C10	C6	C7	C8	0.0°	90.0°
C10	C6	C7	H7	150.3°	90.0°
C6	C10	C9	C8	0.2°	90.0°
C6	C10	FE	C8	81.5°	90.0°
C6	C10	C9	FE	59.4°	90.0°
C6	C10	C9	H10	150.6°	90.0°
C6	C10	C9	H9	150.6°	90.0°
C6	C10	FE	H10	120.5°	90.0°
C10	C6	C14	O2	179.7°	90.0°
C10	C6	C14	O3	0.3°	90.0°
C6	FE	C9	C8	81.5°	90.0°
C6	FE	C8	H8	158.2°	90.0°
C6	FE	C9	H9	158.2°	90.0°
FE	C6	C14	O2	87.0°	90.0°
FE	C6	C14	O3	93.6°	90.0°
C14	C6	C7	C8	179.8°	90.0°
C14	C6	C7	H7	29.9°	90.0°
C14	C6	FE	C8	152.7°	90.0°
C14	C6	C10	C9	179.7°	90.0°
C14	C6	FE	C9	163.6°	90.0°
C14	C6	C10	H10	29.8°	90.0°
C6	C14	O2	O3	179.4°	90.0°
C6	C14	O2	HO2	180.0°	90.0°
C8	C7	FE	H7	120.4°	90.0°
C7	C8	C9	FE	59.6°	90.0°
C7	C8	C9	H8	150.4°	90.0°
C7	C8	FE	H8	120.5°	90.0°
C7	C8	C9	C10	0.2°	90.0°
C7	C8	C9	H9	150.6°	90.0°
C7	C8	FE	C10	81.4°	90.0°
C7	FE	C10	C9	81.5°	90.0°
C7	FE	C9	H9	158.1°	90.0°
C7	FE	C10	H10	158.2°	90.0°
H7	C7	C8	C9	150.4°	90.0°
H7	C7	C8	H8	0.1°	90.0°
H7	C7	FE	C9	158.1°	90.0°
H7	C7	FE	C10	158.3°	90.0°
C9	C8	FE	H8	120.5°	90.0°
C8	C9	C10	FE	59.6°	90.0°
C8	C9	C10	H9	150.4°	90.0°
C8	C9	FE	H9	120.4°	90.0°
C8	C9	C10	H10	150.4°	90.0°
C8	FE	C10	H10	158.1°	90.0°
H8	C8	C9	C10	150.3°	90.0°
H8	C8	C9	H9	0.1°	90.0°
H8	C8	FE	C10	158.1°	90.0°
C10	C9	FE	H9	120.6°	90.0°
C9	C10	FE	H10	120.4°	90.0°
H9	C9	C10	H10	0.1°	90.0°
O1	C11	N1	C12	0.4°	90.0°
O1	C11	N1	C13	179.9°	90.0°
HO2	O2	C14	O3	0.7°	90.0°
C11	N1	C12	C13	179.6°	90.0°
C11	N1	C12	H121	180.0°	90.0°
C11	N1	C12	H122	54.7°	90.0°
C11	N1	C12	H123	54.8°	90.0°
C11	N1	C13	H131	179.9°	90.0°
C11	N1	C13	H132	54.7°	90.0°
C11	N1	C13	H133	54.7°	90.0°
N1	C12	H121	H122	125.3°	90.0°
N1	C12	H121	H123	125.2°	90.0°
N1	C12	H122	H123	117.1°	90.0°
C12	N1	C13	H131	0.6°	90.0°
C12	N1	C13	H132	125.9°	90.0°
C12	N1	C13	H133	124.7°	90.0°
C13	N1	C12	H121	0.5°	90.0°
C13	N1	C12	H122	124.9°	90.0°
C13	N1	C12	H123	125.7°	90.0°
N1	C13	H131	H132	125.2°	90.0°
N1	C13	H131	H133	125.3°	90.0°
N1	C13	H132	H133	108.4°	90.0°
H121	C12	H122	H123	117.2°	90.0°
H131	C13	H132	H133	108.4°	90.0°

Definition date:	1999-07-08
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1A3L