data_[Re3Ni6Pd3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [2.7078]
_cell_length_b [2.7078]
_cell_length_c [25.1071]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [ReNi2Pd]
_chemical_formula_sum '[Re3 Ni6 Pd3]'
_cell_volume [159.4280]
_cell_formula_units_Z [3]
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
[
  Re  Re0  3  0.0000  0.0000  0.5001  1.0
  Ni  Ni1  3  0.0000  0.0000  0.0867  1.0
  Ni  Ni2  3  0.0000  0.0000  0.2467  1.0
  Pd  Pd3  3  0.0000  0.0000  0.6665  1.0
]