data_[Pm4Re4W4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Re  1.9000  1.3500  0.7125
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.9067]
_cell_length_b [3.1304]
_cell_length_c [8.4530]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.0524]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PmReW]
_chemical_formula_sum '[Pm4 Re4 W4]'
_cell_volume [256.3654]
_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
[
  Pm  Pm0  4  0.1594  0.0000  0.6372  1
  Re  Re1  4  0.1394  0.5000  0.9515  1
  W  W2  4  0.0840  0.0000  0.1758  1
]