data_[Pr2Ga4Cu3Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.2674]
_cell_length_b [4.2674]
_cell_length_c [10.2455]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Pr2Ga4Cu3Pd]
_chemical_formula_sum '[Pr2 Ga4 Cu3 Pd1]'
_cell_volume [186.5743]
_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  0.0000  0.5000  0.7526  1.0
  Ga  Ga1  2  0.0000  0.5000  0.3674  1.0
  Ga  Ga2  1  0.0000  0.0000  0.0000  1.0
  Ga  Ga3  1  0.5000  0.5000  0.0000  1.0
  Cu  Cu4  2  0.0000  0.5000  0.1291  1.0
  Cu  Cu5  1  0.0000  0.0000  0.5000  1.0
  Pd  Pd6  1  0.5000  0.5000  0.5000  1.0
]