7MV

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CL	C15	sing	1.74Å	1.80Å
F	C23	sing	1.35Å	1.31Å
C15	C23	doub	1.39Å	1.42Å	Aromatic
C15	C8	sing	1.38Å	1.41Å	Aromatic
C23	C21	sing	1.38Å	1.38Å	Aromatic
C21	C20	doub	1.38Å	1.41Å	Aromatic
C8	C22	doub	1.38Å	1.37Å	Aromatic
C22	C20	sing	1.38Å	1.42Å	Aromatic
C20	C19	sing	1.51Å	1.49Å
C19	N2	sing	1.46Å	1.41Å
C18	N2	sing	1.37Å	1.31Å	Aromatic
C18	C17	doub	1.34Å	1.41Å	Aromatic
N2	C14	sing	1.37Å	1.38Å	Aromatic
C17	C13	sing	1.47Å	1.45Å	Aromatic
C14	C13	doub	1.41Å	1.38Å	Aromatic
C14	C16	sing	1.39Å	1.44Å	Aromatic
C13	C12	sing	1.39Å	1.41Å	Aromatic
C16	C11	doub	1.36Å	1.39Å	Aromatic
C12	C10	doub	1.39Å	1.42Å	Aromatic
C11	C10	sing	1.40Å	1.40Å	Aromatic
C10	C9	sing	1.48Å	1.57Å
C5	C6	doub	1.38Å	1.39Å	Aromatic
C5	C3	sing	1.38Å	1.38Å	Aromatic
C6	C7	sing	1.38Å	1.41Å	Aromatic
C3	C1	doub	1.38Å	1.41Å	Aromatic
C7	C2	doub	1.38Å	1.38Å	Aromatic
N1	C9	sing	1.35Å	1.43Å
N1	C4	sing	1.46Å	1.41Å
C9	O	doub	1.21Å	1.21Å
C1	C2	sing	1.38Å	1.40Å	Aromatic
C1	C4	sing	1.51Å	1.51Å
C4	H1	sing	1.09Å	1.10Å
C4	H2	sing	1.09Å	1.10Å
C5	H3	sing	1.08Å	1.08Å
C6	H4	sing	1.08Å	1.08Å
C3	H5	sing	1.08Å	1.08Å
C2	H6	sing	1.08Å	1.08Å
C19	H7	sing	1.09Å	1.10Å
C19	H8	sing	1.09Å	1.10Å
C18	H9	sing	1.08Å	1.08Å
C21	H10	sing	1.08Å	1.08Å
C22	H11	sing	1.08Å	1.08Å
C17	H12	sing	1.08Å	1.08Å
C16	H13	sing	1.08Å	1.08Å
C7	H14	sing	1.08Å	1.08Å
C8	H15	sing	1.08Å	1.08Å
C11	H16	sing	1.08Å	1.08Å
C12	H17	sing	1.08Å	1.08Å
N1	H18	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CL	C15	C23	119.0°	120.0°
CL	C15	C8	120.7°	120.0°
F	C23	C15	119.5°	120.0°
F	C23	C21	120.3°	120.0°
C23	C15	C8	120.3°	119.9°
C15	C23	C21	120.2°	119.9°
C15	C8	C22	119.5°	120.1°
C15	C8	H15	120.3°	120.0°
C23	C21	C20	119.7°	120.0°
C23	C21	H10	120.2°	120.0°
C21	C20	C22	119.9°	120.1°
C21	C20	C19	120.0°	120.0°
C20	C21	H10	120.2°	120.0°
C8	C22	C20	120.4°	120.0°
C8	C22	H11	119.8°	120.0°
C22	C8	H15	120.2°	120.0°
C22	C20	C19	120.0°	120.0°
C20	C22	H11	119.8°	120.0°
C20	C19	N2	110.8°	109.5°
C20	C19	H7	109.1°	109.5°
C20	C19	H8	109.1°	109.5°
C19	N2	C18	123.8°	125.0°
C19	N2	C14	125.5°	125.0°
N2	C19	H7	109.1°	109.5°
N2	C19	H8	109.1°	109.5°
N2	C18	C17	109.0°	110.0°
C18	N2	C14	110.7°	110.0°
N2	C18	H9	125.5°	125.0°
C18	C17	C13	106.0°	106.9°
C17	C18	H9	125.5°	125.0°
C18	C17	H12	127.0°	126.5°
N2	C14	C13	108.5°	107.1°
N2	C14	C16	131.4°	133.3°
C17	C13	C14	105.9°	106.0°
C17	C13	C12	133.8°	133.9°
C13	C17	H12	127.0°	126.6°
C13	C14	C16	120.0°	119.6°
C14	C13	C12	120.4°	120.0°
C14	C16	C11	119.8°	120.3°
C14	C16	H13	120.1°	119.9°
C13	C12	C10	119.2°	119.4°
C13	C12	H17	120.4°	120.3°
C16	C11	C10	119.9°	120.6°
C11	C16	H13	120.1°	119.8°
C16	C11	H16	120.1°	119.7°
C12	C10	C11	120.7°	120.0°
C12	C10	C9	119.3°	120.0°
C10	C12	H17	120.4°	120.3°
C11	C10	C9	120.0°	120.0°
C10	C11	H16	120.1°	119.7°
C10	C9	N1	120.0°	120.0°
C10	C9	O	118.8°	120.0°
C6	C5	C3	120.1°	120.0°
C5	C6	C7	120.0°	120.0°
C6	C5	H3	119.9°	120.0°
C5	C6	H4	120.0°	120.0°
C5	C3	C1	120.1°	119.9°
C3	C5	H3	120.0°	120.0°
C5	C3	H5	120.0°	120.0°
C6	C7	C2	119.8°	119.9°
C7	C6	H4	120.0°	120.0°
C6	C7	H14	120.1°	120.0°
C3	C1	C2	119.5°	120.0°
C3	C1	C4	121.1°	120.0°
C1	C3	H5	120.0°	120.1°
C7	C2	C1	120.5°	120.0°
C7	C2	H6	119.7°	119.9°
C2	C7	H14	120.1°	120.1°
C9	N1	C4	120.3°	120.0°
N1	C9	O	121.2°	120.0°
C9	N1	H18	119.9°	120.0°
N1	C4	C1	113.4°	109.5°
N1	C4	H1	108.5°	109.5°
N1	C4	H2	108.5°	109.5°
C4	N1	H18	119.9°	120.0°
C2	C1	C4	119.4°	120.0°
C1	C2	H6	119.8°	120.0°
C1	C4	H1	108.5°	109.4°
C1	C4	H2	108.5°	109.5°
H1	C4	H2	109.5°	109.5°
H7	C19	H8	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CL	C15	C23	F	0.0°	0.0°
CL	C15	C23	C8	179.9°	179.7°
CL	C15	C23	C21	179.9°	180.0°
CL	C15	C8	C22	180.0°	180.0°
CL	C15	C8	H15	0.0°	0.4°
F	C23	C15	C21	179.9°	180.0°
F	C23	C15	C8	179.9°	179.7°
F	C23	C21	C20	179.7°	180.0°
F	C23	C21	H10	0.2°	0.0°
C15	C23	C21	C20	0.4°	0.0°
C23	C15	C8	C22	0.1°	0.3°
C15	C23	C21	H10	179.6°	180.0°
C23	C15	C8	H15	179.9°	180.0°
C8	C15	C23	C21	0.0°	0.3°
C15	C8	C22	H15	180.0°	179.7°
C15	C8	C22	C20	0.1°	0.1°
C15	C8	C22	H11	179.9°	180.0°
C23	C21	C20	H10	180.0°	180.0°
C23	C21	C20	C22	0.7°	0.2°
C23	C21	C20	C19	179.8°	179.9°
C21	C20	C22	C8	0.5°	0.2°
C21	C20	C22	C19	179.2°	179.8°
C21	C20	C19	N2	41.2°	89.9°
C21	C20	C19	H7	79.0°	150.0°
C21	C20	C19	H8	161.4°	30.1°
C21	C20	C22	H11	179.5°	179.7°
C8	C22	C20	H11	180.0°	180.0°
C8	C22	C20	C19	179.7°	180.0°
C22	C20	C19	N2	139.7°	90.2°
C22	C20	C19	H7	100.2°	29.8°
C22	C20	C19	H8	19.4°	149.7°
C22	C20	C21	H10	179.4°	179.8°
C20	C22	C8	H15	179.9°	179.7°
C20	C19	N2	H7	120.2°	120.0°
C20	C19	N2	H8	120.2°	120.1°
C20	C19	N2	C18	100.5°	95.0°
C20	C19	N2	C14	79.8°	85.0°
C20	C19	H7	H8	119.4°	120.0°
C19	C20	C21	H10	0.2°	0.0°
C19	C20	C22	H11	0.3°	0.1°
C19	N2	C18	C14	179.7°	180.0°
C19	N2	C18	C17	179.9°	179.9°
C19	N2	C14	C13	179.7°	179.9°
C19	N2	C14	C16	0.0°	0.0°
N2	C19	H7	H8	119.4°	120.0°
C19	N2	C18	H9	0.1°	0.2°
N2	C18	C17	H9	180.0°	179.7°
N2	C18	C17	C13	0.2°	0.0°
C18	N2	C14	C13	0.0°	0.1°
C18	N2	C14	C16	179.7°	180.0°
C18	N2	C19	H7	19.7°	145.0°
C18	N2	C19	H8	139.3°	25.1°
N2	C18	C17	H12	179.8°	179.9°
C17	C18	N2	C14	0.1°	0.1°
C18	C17	C13	H12	180.0°	179.9°
C18	C17	C13	C14	0.2°	0.0°
C18	C17	C13	C12	179.7°	179.9°
N2	C14	C13	C17	0.1°	0.0°
N2	C14	C13	C16	179.7°	179.9°
N2	C14	C13	C12	179.8°	180.0°
N2	C14	C16	C11	179.9°	180.0°
C14	N2	C19	H7	160.0°	35.0°
C14	N2	C19	H8	40.4°	155.0°
C14	N2	C18	H9	179.9°	179.7°
N2	C14	C16	H13	0.2°	0.1°
C17	C13	C14	C12	179.9°	179.9°
C17	C13	C14	C16	179.9°	180.0°
C17	C13	C12	C10	179.9°	180.0°
C13	C17	C18	H9	179.8°	179.7°
C17	C13	C12	H17	0.1°	0.1°
C13	C14	C16	C11	0.2°	0.1°
C14	C13	C12	C10	0.1°	0.1°
C14	C13	C17	H12	179.8°	179.9°
C13	C14	C16	H13	179.8°	180.0°
C14	C13	C12	H17	179.8°	180.0°
C16	C14	C13	C12	0.1°	0.1°
C14	C16	C11	H13	180.0°	179.9°
C14	C16	C11	C10	0.1°	0.0°
C14	C16	C11	H16	179.9°	180.0°
C13	C12	C10	H17	180.0°	179.9°
C13	C12	C10	C11	0.3°	0.0°
C13	C12	C10	C9	179.8°	179.9°
C12	C13	C17	H12	0.3°	0.0°
C16	C11	C10	C12	0.1°	0.0°
C16	C11	C10	H16	180.0°	180.0°
C16	C11	C10	C9	180.0°	179.9°
C12	C10	C11	C9	179.9°	179.9°
C12	C10	C9	N1	32.2°	180.0°
C12	C10	C9	O	148.3°	0.0°
C12	C10	C11	H16	179.8°	180.0°
C11	C10	C9	N1	147.9°	0.1°
C11	C10	C9	O	31.6°	180.0°
C10	C11	C16	H13	179.9°	179.9°
C11	C10	C12	H17	179.7°	179.9°
C10	C9	N1	O	179.5°	179.9°
C10	C9	N1	C4	160.5°	180.0°
C9	C10	C11	H16	0.1°	0.1°
C9	C10	C12	H17	0.2°	0.0°
C10	C9	N1	H18	19.5°	0.1°
C6	C5	C3	H3	180.0°	179.9°
C5	C6	C7	H4	180.0°	180.0°
C6	C5	C3	C1	0.4°	0.1°
C5	C6	C7	C2	0.5°	0.0°
C6	C5	C3	H5	179.7°	180.0°
C5	C6	C7	H14	179.5°	180.0°
C3	C5	C6	C7	0.6°	0.1°
C5	C3	C1	H5	180.0°	179.9°
C5	C3	C1	C2	0.1°	0.1°
C5	C3	C1	C4	179.5°	179.9°
C3	C5	C6	H4	179.3°	180.0°
C6	C7	C2	H14	180.0°	180.0°
C6	C7	C2	C1	0.0°	0.0°
C7	C6	C5	H3	179.4°	179.8°
C6	C7	C2	H6	180.0°	180.0°
C3	C1	C2	C7	0.3°	0.0°
C3	C1	C4	N1	42.5°	90.0°
C3	C1	C2	C4	179.4°	180.0°
C3	C1	C4	H1	163.0°	30.0°
C3	C1	C4	H2	78.1°	150.0°
C1	C3	C5	H3	179.6°	179.8°
C3	C1	C2	H6	179.7°	180.0°
C7	C2	C1	H6	180.0°	180.0°
C7	C2	C1	C4	179.7°	180.0°
C2	C7	C6	H4	179.5°	180.0°
C9	N1	C4	H18	180.0°	180.0°
C9	N1	C4	C1	93.4°	179.9°
C9	N1	C4	H1	146.1°	60.0°
C9	N1	C4	H2	27.2°	60.0°
C4	N1	C9	O	19.0°	0.0°
N1	C4	C1	C2	138.2°	90.0°
N1	C4	C1	H1	120.6°	120.0°
N1	C4	C1	H2	120.6°	120.0°
N1	C4	H1	H2	118.3°	120.0°
O	C9	N1	H18	161.0°	180.0°
C2	C1	C4	H1	17.6°	150.0°
C2	C1	C4	H2	101.2°	30.0°
C2	C1	C3	H5	179.9°	179.9°
C1	C2	C7	H14	180.0°	180.0°
C1	C4	H1	H2	118.2°	120.0°
C4	C1	C3	H5	0.5°	0.0°
C4	C1	C2	H6	0.4°	0.0°
C1	C4	N1	H18	86.7°	0.0°
H1	C4	N1	H18	33.9°	120.0°
H2	C4	N1	H18	152.8°	120.0°
H3	C5	C6	H4	0.7°	0.2°
H3	C5	C3	H5	0.3°	0.1°
H4	C6	C7	H14	0.5°	0.0°
H6	C2	C7	H14	0.0°	0.1°
H9	C18	C17	H12	0.2°	0.4°
H11	C22	C8	H15	0.1°	0.3°
H13	C16	C11	H16	0.1°	0.1°

Release date:	2017-02-08
Definition date:	2016-11-16
Last modified:	2017-02-03
Release status:	REL
Processing site:	RCSB
Derived from:	5TWO