data_TaIr2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.87
_cell_angle_alpha   98.68
_cell_angle_beta   98.68
_cell_angle_gamma   33.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaIr2W
_chemical_formula_sum   'Ta1 Ir2 W1'
_cell_volume   63.34
_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
  Ta  Ta2  1  0.22  0.0  0.27  1.0
  Ir  Ir0  1  0.26  0.0  0.68  1.0
  Ir  Ir1  1  0.73  0.0  0.3  1.0
  W  W3  1  0.79  0.0  0.78  1.0

data_TaIr2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.84
_cell_length_b   4.85
_cell_length_c   4.87
_cell_angle_alpha   98.68
_cell_angle_beta   90.0
_cell_angle_gamma   106.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaIr2W
_chemical_formula_sum   'Ta1 Ir2 W1'
_cell_volume   63.34
_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
  Ta  Ta0  1  0.0  0.78  0.73  1.0
  Ir  Ir1  1  0.0  0.27  0.7  1.0
  Ir  Ir2  1  0.0  0.74  0.32  1.0
  W  W3  1  0.0  0.21  0.22  1.0

Ta Ir Ir W