data_BaLa2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.38
_cell_length_b   7.38
_cell_length_c   7.38
_cell_angle_alpha   150.52
_cell_angle_beta   136.49
_cell_angle_gamma   53.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLa2W
_chemical_formula_sum   'Ba1 La2 W1'
_cell_volume   135.47
_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
  Ba  Ba0  1  0.0  0.0  0.21  1.0
  La  La1  1  0.88  0.0  0.04  1.0
  La  La2  1  0.0  0.0  0.27  1.0
  W  W3  1  0.88  0.0  0.25  1.0

data_BaLa2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.76
_cell_length_b   5.47
_cell_length_c   7.38
_cell_angle_alpha   111.76
_cell_angle_beta   104.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLa2W
_chemical_formula_sum   'Ba1 La2 W1'
_cell_volume   135.47
_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
  Ba  Ba0  1  0.79  0.79  0.79  1.0
  La  La1  1  0.73  0.73  0.73  1.0
  La  La2  1  0.84  0.96  0.84  1.0
  W  W3  1  0.63  0.75  0.63  1.0

Ba La La W