Struct SmallCifStructure 

pub struct SmallCifStructure {
    pub name: Box<str>,
    pub cell: Option<UnitCell>,
    pub space_group_name: Option<Box<str>>,
    pub space_group_number: Option<i32>,
    pub symmetry_operations: Vec<Box<str>>,
    pub atoms: Vec<SmallCifAtom>,
    pub bonds: Vec<SmallCifBond>,
}

One core-CIF crystal model.

Fields

name: Box<str>

Data-block identifier.

cell: Option<UnitCell>

Unit cell.

space_group_name: Option<Box<str>>

Hermann-Mauguin space-group name.

space_group_number: Option<i32>

International Tables space-group number.

symmetry_operations: Vec<Box<str>>

Explicit symmetry operations in source order.

atoms: Vec<SmallCifAtom>

Atom sites in source order.

bonds: Vec<SmallCifBond>

Resolved geometric bonds.

Trait Implementations

impl Clone for SmallCifStructure

fn clone(&self) -> Self

Returns a duplicate of the value.

fn clone_from(&mut self, source: &Self)

Performs copy-assignment from source.

impl Debug for SmallCifStructure

fn fmt(&self, f: &mut Formatter<'_>) -> Result

Formats the value using the given formatter.

impl PartialEq for SmallCifStructure

fn eq(&self, other: &Self) -> bool

Equality operator ==.

fn ne(&self, other: &Rhs) -> bool

Inequality operator !=.

impl StructuralPartialEq for SmallCifStructure