data_[Pr6Te2Pb2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.9409]
_cell_length_b [4.6015]
_cell_length_c [9.8045]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.3145]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr3TePbCl]
_chemical_formula_sum '[Pr6 Te2 Pb2 Cl2]'
_cell_volume [398.0509]
_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  0.1012  0.7500  0.8705  1
  Pr  Pr1  2  0.2548  0.2500  0.5106  1
  Pr  Pr2  2  0.4083  0.2500  0.1622  1
  Te  Te3  2  0.1669  0.7500  0.2162  1
  Pb  Pb4  2  0.3433  0.2500  0.8359  1
  Cl  Cl5  2  0.0926  0.7500  0.5779  1
]