data_[Li2Ga2Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [4.4240]
_cell_length_b [9.0666]
_cell_length_c [6.2044]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [LiGaTe2]
_chemical_formula_sum '[Li2 Ga2 Te4]'
_cell_volume [248.8635]
_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
[
  Li  Li0  2  0.0000  0.1212  0.6624  1.0
  Ga  Ga1  2  0.0000  0.6287  0.6143  1.0
  Te  Te2  2  0.0000  0.3765  0.3823  1.0
  Te  Te3  2  0.0000  0.8711  0.4075  1.0
]