data_[Pr2Mg2Cd2Bi6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7527]
_cell_length_b [4.8594]
_cell_length_c [11.1416]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.4721]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PrMgCdBi3]
_chemical_formula_sum '[Pr2 Mg2 Cd2 Bi6]'
_cell_volume [362.4996]
_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  0.2084  0.2500  0.3067  1.0
  Mg  Mg1  2  0.3308  0.7500  0.8281  1.0
  Cd  Cd2  2  0.1079  0.2500  0.6054  1.0
  Bi  Bi3  2  0.0674  0.2500  0.8692  1.0
  Bi  Bi4  2  0.3272  0.7500  0.5315  1.0
  Bi  Bi5  2  0.3938  0.7500  0.1241  1.0
]