data_[Co2Cu1Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [2.7325]
_cell_length_b [2.7325]
_cell_length_c [20.0165]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Co2CuPd6]
_chemical_formula_sum '[Co2 Cu1 Pd6]'
_cell_volume [129.4316]
_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
[
  Co  Co0  2  0.3333  0.6667  0.6705  1.0
  Cu  Cu1  1  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  2  0.0000  0.0000  0.2263  1.0
  Pd  Pd3  2  0.0000  0.0000  0.4326  1.0
  Pd  Pd4  2  0.3333  0.6667  0.1072  1.0
]