data_[Li3Ga1Te3]
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 [Pm]
_cell_length_a [7.1470]
_cell_length_b [11.5027]
_cell_length_c [17.0050]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Li3GaTe3]
_chemical_formula_sum '[Li3 Ga1 Te3]'
_cell_volume [1397.9755]
_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
[
  Li  Li0  2  0.4241  0.2945  0.4556  1
  Li  Li1  1  0.9534  0.5000  0.5300  1
  Ga  Ga2  1  0.5548  0.5000  0.5255  1
  Te  Te3  2  0.7157  0.3069  0.5504  1
  Te  Te4  1  0.2591  0.5000  0.4325  1
]