data_FeRuW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   144.62
_cell_angle_beta   129.16
_cell_angle_gamma   63.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRuW2
_chemical_formula_sum   'Fe1 Ru1 W2'
_cell_volume   58.59
_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
  Fe  Fe0  1  0.0  0.0  0.25  1.0
  Ru  Ru1  1  0.0  0.19  0.16  1.0
  W  W2  1  0.0  0.0  0.05  1.0
  W  W3  1  0.55  0.0  0.2  1.0

data_FeRuW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.09
_cell_length_b   4.37
_cell_length_c   5.09
_cell_angle_alpha   115.42
_cell_angle_beta   107.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRuW2
_chemical_formula_sum   'Fe1 Ru1 W2'
_cell_volume   58.59
_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
  Fe  Fe0  1  0.0  0.25  0.25  1.0
  Ru  Ru1  1  0.81  0.98  0.98  1.0
  W  W2  1  0.0  0.05  0.05  1.0
  W  W3  1  0.0  0.2  0.65  1.0

Fe Ru W W