data_[Ca4Te2W2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Te  2.1000  1.4000  1.2933
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.7425]
_cell_length_b [6.1699]
_cell_length_c [9.3867]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.3519]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ca2TeWO6]
_chemical_formula_sum '[Ca4 Te2 W2 O12]'
_cell_volume [280.9537]
_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
[
  Ca  Ca0  4  0.2231  0.0217  0.7344  1
  Te  Te1  2  0.0000  0.0000  0.0000  1
  W  W2  2  0.5000  0.0000  0.5000  1
  O  O3  4  0.1843  0.1145  0.2810  1
  O  O4  4  0.2181  0.6712  0.0201  1
  O  O5  4  0.4730  0.2261  0.6251  1
]