data_[Pr4In5Cu2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.8798]
_cell_length_b [3.7243]
_cell_length_c [10.0227]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.3689]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Pr4In5Cu2]
_chemical_formula_sum '[Pr4 In5 Cu2]'
_cell_volume [293.2763]
_cell_formula_units_Z [1]
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  0.1785  0.5000  0.8624  1.0
  Pr  Pr1  2  0.2373  0.5000  0.4392  1.0
  In  In2  2  0.1798  0.0000  0.1573  1.0
  In  In3  2  0.4474  0.0000  0.6848  1.0
  In  In4  1  0.5000  0.0000  0.0000  1.0
  Cu  Cu5  2  0.0641  0.0000  0.6273  1.0
]