data_[Li4Mg4In8Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [9.1636]
_cell_length_b [10.1859]
_cell_length_c [12.2301]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [LiMg(InTe2)2]
_chemical_formula_sum '[Li4 Mg4 In8 Te16]'
_cell_volume [1141.5564]
_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
[
  Li  Li0  4  0.0000  0.0000  0.5078  1.0
  Mg  Mg1  4  0.0000  0.0000  0.0032  1.0
  In  In2  8  0.2500  0.2500  0.2598  1.0
  Te  Te3  8  0.0000  0.2484  0.1112  1.0
  Te  Te4  8  0.2459  0.0000  0.3737  1.0
]