data_Ta2GaW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26
_cell_length_b   5.26
_cell_length_c   4.5
_cell_angle_alpha   113.8
_cell_angle_beta   113.8
_cell_angle_gamma   37.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2GaW
_chemical_formula_sum   'Ta2 Ga1 W1'
_cell_volume   68.14
_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  Ta1  1  0.0  0.0  0.04  1.0
  Ta  Ta2  1  0.98  0.0  0.03  1.0
  Ga  Ga0  1  0.04  0.0  0.07  1.0
  W  W3  1  0.09  0.0  0.03  1.0

data_Ta2GaW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   4.5
_cell_length_c   5.26
_cell_angle_alpha   113.8
_cell_angle_beta   108.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2GaW
_chemical_formula_sum   'Ta2 Ga1 W1'
_cell_volume   68.14
_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  0.03  0.98  1.0
  Ta  Ta1  1  0.0  0.04  0.0  1.0
  Ga  Ga2  1  0.0  0.07  0.04  1.0
  W  W3  1  0.0  0.03  0.09  1.0

Ta Ta Ga W