data_[Cu4Ag2Se4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Ag  1.9300  1.6000  1.0867
  Se  2.5500  1.1500  1.0133
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.4992]
_cell_length_b [6.1310]
_cell_length_c [8.2022]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.7735]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu2Ag(SeO5)2]
_chemical_formula_sum '[Cu4 Ag2 Se4 O20]'
_cell_volume [406.1035]
_cell_formula_units_Z [2]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
[
  Cu  Cu0  4  0.2500  0.2500  0.0000  1.0
  Ag  Ag1  2  0.0000  0.5000  0.5000  1.0
  Se  Se2  4  0.0780  0.0000  0.2995  1.0
  O  O3  8  0.0465  0.2295  0.7562  1.0
  O  O4  4  0.1715  0.0000  0.1762  1.0
  O  O5  4  0.1766  0.5000  0.0422  1.0
  O  O6  4  0.2082  0.0000  0.5310  1.0
]