data_[Mg1Te3W1O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  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]
_cell_length_a [5.2023]
_cell_length_b [8.7303]
_cell_length_c [5.2869]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9427]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [3]
_chemical_formula_structural [MgTe3WO12]
_chemical_formula_sum '[Mg1 Te3 W1 O12]'
_cell_volume [239.9808]
_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
[
  Mg  Mg0  1  0.5000  0.8072  0.0000  1.0
  Te  Te1  1  0.0000  0.9112  0.5000  1.0
  Te  Te2  1  0.5000  0.4105  0.0000  1.0
  Te  Te3  1  0.5000  0.5928  0.5000  1.0
  W  W4  1  0.0000  0.1071  0.0000  1.0
  O  O5  2  0.1865  0.0785  0.3178  1.0
  O  O6  2  0.2201  0.9479  0.8491  1.0
  O  O7  2  0.2471  0.2617  0.8921  1.0
  O  O8  2  0.2956  0.5786  0.8151  1.0
  O  O9  2  0.3052  0.7469  0.3231  1.0
  O  O10  2  0.3100  0.4267  0.3116  1.0
]