data_[Pr12Co4Cu4]
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
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2742]
_cell_length_b [3.8783]
_cell_length_c [8.4348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.7454]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3CoCu]
_chemical_formula_sum '[Pr12 Co4 Cu4]'
_cell_volume [529.6981]
_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  0.0603  0.0000  0.3155  1.0
  Pr  Pr1  4  0.1003  0.5000  0.9492  1.0
  Pr  Pr2  4  0.2340  0.0000  0.6939  1.0
  Co  Co3  4  0.2223  0.0000  0.0564  1.0
  Cu  Cu4  4  0.0805  0.5000  0.5807  1.0
]