data_[Cs3Tm1Bi2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tm  1.2500  1.7500  1.0950
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.4453]
_cell_length_b [6.4453]
_cell_length_c [8.5607]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Cs3Tm(BiO4)2]
_chemical_formula_sum '[Cs3 Tm1 Bi2 O8]'
_cell_volume [307.9840]
_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
[
  Cs  Cs0  2  0.3333  0.6667  0.7023  1
  Cs  Cs1  1  0.0000  0.0000  0.0000  1
  Tm  Tm2  1  0.0000  0.0000  0.5000  1
  Bi  Bi3  2  0.3333  0.6667  0.2609  1
  O  O4  6  0.1614  0.3228  0.3448  1
  O  O5  2  0.3333  0.6667  0.0278  1
]