data_[P9W5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [8.6110]
_cell_length_b [8.6110]
_cell_length_c [19.1551]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [P9W5]
_chemical_formula_sum '[P9 W5]'
_cell_volume [1230.0364]
_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
[
  P  P0  6  0.1518  0.7382  0.4552  1
  P  P1  3  0.0000  0.2481  0.6154  1
  W  W2  3  0.0000  0.8263  0.5418  1
  W  W3  2  0.3333  0.6667  0.3985  1
]