data_[Li2In3Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [8.2075]
_cell_length_b [5.9047]
_cell_length_c [18.4581]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Li2In3Te4]
_chemical_formula_sum '[Li2 In3 Te4]'
_cell_volume [894.5401]
_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  1  0.4365  0.0000  0.4763  1
  Li  Li1  1  0.6388  0.5000  0.4378  1
  In  In2  2  0.0067  0.2442  0.4601  1
  In  In3  1  0.3399  0.5000  0.5617  1
  Te  Te4  2  0.6866  0.2460  0.5617  1
  Te  Te5  1  0.1951  0.0000  0.5840  1
  Te  Te6  1  0.3250  0.5000  0.3966  1
]