data_PRu2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   4.51
_cell_angle_alpha   92.57
_cell_angle_beta   92.57
_cell_angle_gamma   34.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PRu2W
_chemical_formula_sum   'P1 Ru2 W1'
_cell_volume   57.18
_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  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.84  0.0  0.13  1.0
  Ru  Ru2  1  0.93  0.0  0.38  1.0
  W  W3  1  0.39  0.0  0.25  1.0

data_PRu2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.51
_cell_length_c   4.71
_cell_angle_alpha   92.57
_cell_angle_beta   107.45
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PRu2W
_chemical_formula_sum   'P1 Ru2 W1'
_cell_volume   57.18
_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  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.0  0.13  0.84  1.0
  Ru  Ru2  1  0.0  0.38  0.93  1.0
  W  W3  1  0.0  0.25  0.39  1.0

P Ru Ru W