data_[Li4Pr8Ga4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3069]
_cell_length_b [19.5033]
_cell_length_c [12.9061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LiPr2GaTe5]
_chemical_formula_sum '[Li4 Pr8 Ga4 Te20]'
_cell_volume [1084.0804]
_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  0.2115  0.0188  1.0
  Pr  Pr1  4  0.0000  0.1179  0.6814  1.0
  Pr  Pr2  4  0.0000  0.1314  0.3042  1.0
  Ga  Ga3  4  0.0000  0.4266  0.4567  1.0
  Te  Te4  4  0.0000  0.0439  0.0724  1.0
  Te  Te5  4  0.0000  0.2887  0.6668  1.0
  Te  Te6  4  0.0000  0.3125  0.3456  1.0
  Te  Te7  4  0.0000  0.3558  0.9966  1.0
  Te  Te8  4  0.0000  0.4997  0.2815  1.0
]