data_[P32Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.1901]
_cell_length_b [10.8322]
_cell_length_c [11.4660]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0781]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [P4Ru]
_chemical_formula_sum '[P32 Ru8]'
_cell_volume [644.6146]
_cell_formula_units_Z [8]
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  8  0.0430  0.0892  0.4539  1
  P  P1  8  0.0658  0.4011  0.4742  1
  P  P2  8  0.1951  0.4217  0.2853  1
  P  P3  8  0.1974  0.7345  0.2897  1
  Ru  Ru4  4  0.0000  0.0727  0.2500  1
  Ru  Ru5  4  0.2500  0.2500  0.0000  1
]