data_[Tm4W4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [6.9189]
_cell_length_b [10.9510]
_cell_length_c [5.1170]
_cell_angle_alpha [90.0000]
_cell_angle_beta [130.2899]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [TmWO4]
_chemical_formula_sum '[Tm4 W4 O16]'
_cell_volume [295.7397]
_cell_formula_units_Z [4]
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
[
  Tm  Tm0  2  0.0000  0.3659  0.0000  1.0
  Tm  Tm1  2  0.0000  0.6398  0.5000  1.0
  W  W2  2  0.0000  0.0926  0.5000  1.0
  W  W3  2  0.0000  0.9015  0.0000  1.0
  O  O4  4  0.1527  0.2090  0.4214  1.0
  O  O5  4  0.1629  0.7846  0.8926  1.0
  O  O6  4  0.2374  0.0323  0.9645  1.0
  O  O7  4  0.2459  0.9742  0.4881  1.0
]