data_Ba2LaTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.08
_cell_length_b   10.08
_cell_length_c   4.61
_cell_angle_alpha   102.74
_cell_angle_beta   102.74
_cell_angle_gamma   25.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LaTe
_chemical_formula_sum   'Ba2 La1 Te1'
_cell_volume   194.82
_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  0.7  0.0  0.72  1.0
  Ba  Ba1  1  0.92  0.0  0.77  1.0
  La  La2  1  0.31  0.0  0.24  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

data_Ba2LaTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.41
_cell_length_b   4.61
_cell_length_c   10.08
_cell_angle_alpha   102.74
_cell_angle_beta   102.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LaTe
_chemical_formula_sum   'Ba2 La1 Te1'
_cell_volume   194.82
_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  0.72  0.7  1.0
  Ba  Ba1  1  0.0  0.77  0.92  1.0
  La  La2  1  0.0  0.24  0.31  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

Ba Ba La Te