 Atom sites¶

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Edit a site¶

On Structure → Main, expand Atom sites. Select a row and edit its label, atom type, fractional coordinates and occupancy. Check its Wyckoff position and any coordinates controlled by symmetry.

Use the add or duplicate controls for another site, and the remove control to delete one. Each row represents an independent crystallographic site, rather than every symmetry-generated atom shown in the picture.

Choose the displacement representation for the site, then edit its values in Atomic displacement. See coordinates and symmetry and occupancy and scattering.