data_[Sc1Ag1W2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.0853]
_cell_length_b [6.2311]
_cell_length_c [6.3022]
_cell_angle_alpha [118.4597]
_cell_angle_beta [109.7126]
_cell_angle_gamma [90.9854]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [ScAg(WO4)2]
_chemical_formula_sum '[Sc1 Ag1 W2 O8]'
_cell_volume [161.4105]
_cell_formula_units_Z [1]
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
[
  Sc  Sc0  1  0.4131  0.2760  0.0787  1.0
  Ag  Ag1  1  0.0243  0.8273  0.1547  1.0
  W  W2  1  0.2335  0.5623  0.6006  1.0
  W  W3  1  0.7262  0.2249  0.6052  1.0
  O  O4  1  0.1414  0.3789  0.7954  1.0
  O  O5  1  0.2180  0.8832  0.8203  1.0
  O  O6  1  0.2634  0.5825  0.3272  1.0
  O  O7  1  0.3375  0.1980  0.3661  1.0
  O  O8  1  0.6180  0.5888  0.7914  1.0
  O  O9  1  0.6658  0.1984  0.8641  1.0
  O  O10  1  0.7379  0.9132  0.3929  1.0
  O  O11  1  0.8211  0.3840  0.3997  1.0
]