data_OsRuW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24
_cell_length_b   5.24
_cell_length_c   5.24
_cell_angle_alpha   145.51
_cell_angle_beta   129.95
_cell_angle_gamma   62.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsRuW2
_chemical_formula_sum   'Os1 Ru1 W2'
_cell_volume   61.89
_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
  Os  Os0  1  0.55  0.0  0.35  1.0
  Ru  Ru1  1  0.0  0.0  0.86  1.0
  W  W2  1  0.55  0.0  0.08  1.0
  W  W3  1  0.0  0.0  0.18  1.0

data_OsRuW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   4.44
_cell_length_c   5.24
_cell_angle_alpha   115.03
_cell_angle_beta   107.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsRuW2
_chemical_formula_sum   'Os1 Ru1 W2'
_cell_volume   61.89
_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
  Ru  Ru0  1  0.14  0.14  0.14  1.0
  Os  Os1  1  0.21  0.65  0.21  1.0
  W  W2  1  0.47  0.92  0.47  1.0
  W  W3  1  0.82  0.82  0.82  1.0

Os Ru W W
Os Ru W W 0 2 o o o 1 3 o o + 