data_[Gd8Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [12.1083]
_cell_length_b [4.3456]
_cell_length_c [11.8760]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Gd2Te3]
_chemical_formula_sum '[Gd8 Te12]'
_cell_volume [624.8850]
_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
[
  Gd  Gd0  4  0.0170  0.7500  0.6881  1.0
  Gd  Gd1  4  0.1958  0.7500  0.9980  1.0
  Te  Te2  4  0.0431  0.2500  0.8766  1.0
  Te  Te3  4  0.1185  0.7500  0.4432  1.0
  Te  Te4  4  0.2240  0.2500  0.1970  1.0
]