data_[Pr2Nd10Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8255]
_cell_length_b [13.5039]
_cell_length_c [7.7896]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6579]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PrNd5Te6]
_chemical_formula_sum '[Pr2 Nd10 Te12]'
_cell_volume [775.1848]
_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
[
  Pr  Pr0  2  0.0000  0.0000  0.0000  1.0
  Nd  Nd1  4  0.0000  0.1649  0.5000  1.0
  Nd  Nd2  4  0.0000  0.3333  0.0000  1.0
  Nd  Nd3  2  0.0000  0.5000  0.5000  1.0
  Te  Te4  8  0.2485  0.3323  0.7486  1.0
  Te  Te5  4  0.2480  0.5000  0.2497  1.0
]