BondingComposite

class emmet.core.molecules.summary.BondingComposite(**data)

Bases: BaseModel

Summary information obtained from MoleculeBondingDocs

Parameters:

• property_id (str | None)

• level_of_theory (str | None)

• bond_types (dict[str, list[float]] | None)

• bonds (list[tuple[int, int]] | None)

• bonds_nometal (list[tuple[int, int]] | None)

model_config: ClassVar[ConfigDict] = {}

Configuration for the model, should be a dictionary conforming to [ConfigDict][pydantic.config.ConfigDict].