PDBx/mmCIF
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Data Category space_group_Wyckoff

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General

Category name
space_group_Wyckoff
Required in PDB entries
no
Category group membership
symmetry_group
Used in current PDB entries
No

Category Relationship Diagrams

70
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Category Description 

               Contains information about Wyckoff positions of a space group.
               Only one site can be given for each special position but the
               remainder can be generated by applying the symmetry operations
               stored in _space_group_symop.operation_xyz.

Category Example

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     loop_
    _space_group_Wyckoff.id
    _space_group_Wyckoff.multiplicity
    _space_group_Wyckoff.letter
    _space_group_Wyckoff.site_symmetry
    _space_group_Wyckoff.coord_xyz
        1  192 h  1    x,y,z
        2   96 g  ..2  1/4,y,-y
        3   96 f  2..  x,1/8,1/8
        4   32 b  .32  1/4,1/4,1/4

Key Data Items

Category Data Items

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