data_BaNa2La
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03
_cell_length_b   6.41
_cell_length_c   6.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNa2La
_chemical_formula_sum   'Ba1 Na2 La1'
_cell_volume   167.84
_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  0.02  0.0  0.25  1.0
  Na  Na2  1  0.0  0.0  0.0  1.0
  Na  Na3  1  0.02  0.2  0.0  1.0
  La  La1  1  0.0  0.2  0.25  1.0

data_BaNa2La
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.03
_cell_length_b   6.41
_cell_length_c   6.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNa2La
_chemical_formula_sum   'Ba1 Na2 La1'
_cell_volume   167.84
_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  0.02  0.0  0.25  1.0
  Na  Na1  1  0.0  0.0  0.0  1.0
  Na  Na2  1  0.02  0.2  0.0  1.0
  La  La3  1  -0.0  0.2  0.25  1.0

Ba Na Na La
Ba Na Na La 0 3 o o o 1 2 o o o 