data_[Pr8Co56B4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Co  1.8800  1.3500  0.7683
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [8.6114]
_cell_length_b [8.6114]
_cell_length_c [11.8854]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [136]
_chemical_formula_structural [Pr2Co14B]
_chemical_formula_sum '[Pr8 Co56 B4]'
_cell_volume [881.3820]
_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
[
  Pr  Pr0  4  0.1446  0.8554  0.0000  1
  Pr  Pr1  4  0.2249  0.7751  0.5000  1
  Co  Co2  16  0.0358  0.3606  0.1795  1
  Co  Co3  16  0.0700  0.2753  0.3724  1
  Co  Co4  8  0.0988  0.0988  0.2077  1
  Co  Co5  8  0.1820  0.8180  0.2528  1
  Co  Co6  4  0.0000  0.0000  0.3836  1
  Co  Co7  4  0.0000  0.5000  0.0000  1
  B  B8  4  0.1214  0.1214  0.5000  1
]