VF9

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C10	C11	doub	1.35Å	1.25Å	Aromatic
C10	C9	sing	1.41Å	1.40Å	Aromatic
C11	O1	sing	1.34Å	1.28Å	Aromatic
C9	C8	doub	1.35Å	1.27Å	Aromatic
O1	C8	sing	1.34Å	1.29Å	Aromatic
C8	C7	sing	1.51Å	1.50Å
C7	C6	sing	1.55Å	1.53Å
C7	N	sing	1.45Å	1.37Å
C6	C5	sing	1.47Å	1.47Å
N	C2	sing	1.48Å	1.39Å
N	C1	sing	1.35Å	1.37Å
C	C1	sing	1.51Å	1.50Å
C2	C3	sing	1.54Å	1.51Å
C1	O	doub	1.21Å	1.19Å
C5	C4	sing	1.53Å	1.46Å
C4	C3	sing	1.51Å	1.49Å
C7	H1	sing	1.09Å	1.10Å
C9	H2	sing	1.08Å	1.08Å
C5	H3	sing	1.09Å	1.10Å
C5	H4	sing	1.09Å	1.10Å
C6	H5	sing	1.09Å	1.10Å
C6	H6	sing	1.09Å	1.10Å
C4	H7	sing	1.09Å	1.10Å
C4	H8	sing	1.09Å	1.10Å
C3	H9	sing	1.09Å	1.10Å
C3	H10	sing	1.09Å	1.10Å
C2	H11	sing	1.09Å	1.10Å
C2	H12	sing	1.09Å	1.10Å
C	H13	sing	1.09Å	1.10Å
C	H14	sing	1.09Å	1.10Å
C	H15	sing	1.09Å	1.10Å
C11	H16	sing	1.08Å	1.08Å
C10	H17	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C11	C10	C9	107.1°	106.9°
C10	C11	O1	108.5°	108.4°
C10	C11	H16	125.7°	125.8°
C11	C10	H17	126.5°	126.5°
C10	C9	C8	106.0°	106.8°
C10	C9	H2	127.0°	126.6°
C9	C10	H17	126.4°	126.6°
C11	O1	C8	110.4°	109.5°
O1	C11	H16	125.7°	125.8°
C9	C8	O1	108.0°	108.4°
C9	C8	C7	132.5°	125.8°
C8	C9	H2	127.0°	126.6°
O1	C8	C7	119.5°	125.8°
C8	C7	C6	111.6°	109.4°
C8	C7	N	108.8°	109.5°
C8	C7	H1	107.9°	109.4°
C6	C7	N	111.3°	109.6°
C7	C6	C5	116.9°	110.3°
C6	C7	H1	107.5°	109.4°
C7	C6	H5	107.6°	109.3°
C7	C6	H6	107.6°	109.3°
C7	N	C2	117.8°	122.7°
C7	N	C1	115.6°	118.6°
N	C7	H1	109.7°	109.5°
C6	C5	C4	110.4°	114.3°
C6	C5	H3	109.3°	108.5°
C6	C5	H4	109.2°	108.5°
C5	C6	H5	107.6°	109.3°
C5	C6	H6	107.6°	109.3°
C2	N	C1	126.6°	118.6°
N	C2	C3	109.3°	112.1°
N	C2	H11	109.5°	109.0°
N	C2	H12	109.5°	108.8°
N	C1	C	116.8°	120.0°
N	C1	O	121.5°	120.0°
C	C1	O	121.7°	120.0°
C1	C	H13	109.5°	109.5°
C1	C	H14	109.5°	109.4°
C1	C	H15	109.5°	109.4°
C2	C3	C4	118.1°	110.1°
C2	C3	H9	107.3°	109.4°
C2	C3	H10	107.3°	109.3°
C3	C2	H11	109.5°	108.9°
C3	C2	H12	109.5°	109.0°
C5	C4	C3	111.9°	109.3°
C4	C5	H3	109.2°	108.5°
C4	C5	H4	109.3°	108.6°
C5	C4	H7	108.8°	109.5°
C5	C4	H8	108.9°	109.5°
C3	C4	H7	108.9°	109.5°
C3	C4	H8	108.8°	109.5°
C4	C3	H9	107.3°	109.3°
C4	C3	H10	107.3°	109.4°
H3	C5	H4	109.5°	108.3°
H5	C6	H6	109.5°	109.3°
H7	C4	H8	109.5°	109.6°
H9	C3	H10	109.5°	109.4°
H11	C2	H12	109.5°	109.0°
H13	C	H14	109.5°	109.4°
H13	C	H15	109.5°	109.5°
H14	C	H15	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C11	C10	C9	H17	180.0°	180.0°
C10	C11	O1	H16	180.0°	179.9°
C11	C10	C9	C8	0.3°	0.2°
C10	C11	O1	C8	1.2°	0.1°
C11	C10	C9	H2	179.7°	179.8°
C9	C10	C11	O1	0.9°	0.1°
C10	C9	C8	H2	180.0°	180.0°
C10	C9	C8	O1	0.4°	0.3°
C10	C9	C8	C7	179.6°	180.0°
C9	C10	C11	H16	179.1°	179.9°
C11	O1	C8	C9	1.0°	0.2°
C11	O1	C8	C7	179.7°	180.0°
O1	C11	C10	H17	179.1°	179.9°
C9	C8	O1	C7	179.3°	179.8°
C9	C8	C7	C6	3.4°	175.0°
C9	C8	C7	N	126.6°	54.9°
C9	C8	C7	H1	114.5°	65.1°
C8	C9	C10	H17	179.7°	179.8°
O1	C8	C7	C6	177.5°	5.3°
O1	C8	C7	N	54.3°	125.4°
O1	C8	C7	H1	64.6°	114.6°
O1	C8	C9	H2	179.6°	179.8°
C8	O1	C11	H16	178.8°	180.0°
C8	C7	C6	N	121.8°	120.1°
C8	C7	C6	H1	118.1°	119.9°
C8	C7	N	H1	117.8°	119.9°
C8	C7	C6	C5	139.2°	168.7°
C8	C7	N	C2	56.4°	149.3°
C8	C7	N	C1	125.3°	30.8°
C7	C8	C9	H2	0.4°	0.0°
C8	C7	C6	H5	18.2°	71.1°
C8	C7	C6	H6	99.7°	48.5°
C6	C7	N	H1	118.8°	120.0°
C7	C6	C5	H5	121.1°	120.2°
C7	C6	C5	H6	121.1°	120.2°
C6	C7	N	C2	67.0°	90.7°
C6	C7	N	C1	111.3°	89.3°
C7	C6	C5	C4	81.9°	62.8°
C7	C6	C5	H3	158.0°	176.0°
C7	C6	C5	H4	38.2°	58.5°
C7	C6	H5	H6	116.7°	119.6°
N	C7	C6	C5	17.4°	71.2°
C7	N	C2	C1	178.1°	180.0°
C7	N	C1	C	2.6°	174.2°
C7	N	C2	C3	94.2°	42.1°
C7	N	C1	O	177.1°	5.8°
N	C7	C6	H5	103.6°	49.0°
N	C7	C6	H6	138.5°	168.5°
C7	N	C2	H11	145.9°	162.8°
C7	N	C2	H12	25.8°	78.5°
C6	C5	C4	H3	120.2°	121.2°
C6	C5	C4	H4	120.1°	121.3°
C6	C5	C4	C3	79.9°	85.0°
C5	C6	C7	H1	102.6°	48.8°
C6	C5	H3	H4	119.6°	117.6°
C5	C6	H5	H6	116.6°	119.6°
C6	C5	C4	H7	40.5°	34.9°
C6	C5	C4	H8	159.8°	155.0°
C2	N	C1	C	179.3°	5.8°
N	C2	C3	H11	119.9°	120.7°
N	C2	C3	H12	120.0°	120.5°
C2	N	C1	O	1.0°	174.2°
N	C2	C3	C4	61.2°	40.6°
C2	N	C7	H1	174.2°	29.3°
N	C2	C3	H9	60.1°	160.8°
N	C2	C3	H10	177.6°	79.5°
N	C2	H11	H12	120.1°	118.6°
N	C1	C	O	179.7°	180.0°
C1	N	C2	C3	83.9°	137.9°
C1	N	C7	H1	7.5°	150.7°
C1	N	C2	H11	36.0°	17.2°
C1	N	C2	H12	156.1°	101.5°
N	C1	C	H13	179.7°	90.0°
N	C1	C	H14	59.7°	30.0°
N	C1	C	H15	60.2°	150.0°
C1	C	H13	H14	120.0°	119.9°
C1	C	H13	H15	120.0°	120.0°
C1	C	H14	H15	120.0°	120.0°
C2	C3	C4	C5	56.0°	91.9°
C2	C3	C4	H9	121.2°	120.2°
C2	C3	C4	H10	121.2°	120.1°
C2	C3	C4	H7	64.3°	28.0°
C2	C3	C4	H8	176.4°	148.2°
C2	C3	H9	H10	116.1°	119.7°
C3	C2	H11	H12	120.1°	118.8°
O	C1	C	H13	0.0°	90.0°
O	C1	C	H14	120.0°	150.0°
O	C1	C	H15	120.0°	30.0°
C5	C4	C3	H7	120.3°	119.9°
C5	C4	C3	H8	120.4°	119.9°
C4	C5	H3	H4	119.6°	117.7°
C4	C5	C6	H5	39.2°	57.4°
C4	C5	C6	H6	157.0°	176.9°
C5	C4	H7	H8	118.9°	120.1°
C5	C4	C3	H9	65.2°	147.9°
C5	C4	C3	H10	177.3°	28.2°
C3	C4	C5	H3	160.0°	153.8°
C3	C4	C5	H4	40.2°	36.2°
C3	C4	H7	H8	118.9°	120.1°
C4	C3	H9	H10	116.1°	119.7°
C4	C3	C2	H11	178.9°	80.1°
C4	C3	C2	H12	58.8°	161.2°
H1	C7	C6	H5	136.3°	169.1°
H1	C7	C6	H6	18.4°	71.4°
H2	C9	C10	H17	0.3°	0.2°
H3	C5	C6	H5	81.0°	63.8°
H3	C5	C6	H6	36.9°	55.7°
H3	C5	C4	H7	79.7°	86.3°
H3	C5	C4	H8	39.6°	33.8°
H4	C5	C6	H5	159.3°	178.7°
H4	C5	C6	H6	82.8°	61.7°
H4	C5	C4	H7	160.6°	156.1°
H4	C5	C4	H8	80.1°	83.7°
H7	C4	C3	H9	174.5°	92.2°
H7	C4	C3	H10	56.9°	148.1°
H8	C4	C3	H9	55.2°	28.0°
H8	C4	C3	H10	62.4°	91.7°
H9	C3	C2	H11	59.9°	40.1°
H9	C3	C2	H12	179.9°	78.7°
H10	C3	C2	H11	57.6°	159.8°
H10	C3	C2	H12	62.4°	41.0°
H13	C	H14	H15	120.0°	120.1°
H16	C11	C10	H17	0.9°	0.1°

Release date:	2022-11-02
Definition date:	2022-08-29
Last modified:	2022-10-28
Release status:	REL
Processing site:	RCSB
Derived from:	7FPD