data_Ba2LaTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.77
_cell_length_b   7.77
_cell_length_c   6.14
_cell_angle_alpha   113.01
_cell_angle_beta   113.01
_cell_angle_gamma   31.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LaTe
_chemical_formula_sum   'Ba2 La1 Te1'
_cell_volume   178.67
_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  0.6  0.0  0.29  1.0
  Ba  Ba1  1  0.78  0.0  0.17  1.0
  La  La2  1  0.53  0.0  0.52  1.0
  Te  Te3  1  0.75  0.0  0.44  1.0

data_Ba2LaTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   6.14
_cell_length_c   7.77
_cell_angle_alpha   113.01
_cell_angle_beta   105.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LaTe
_chemical_formula_sum   'Ba2 La1 Te1'
_cell_volume   178.67
_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  0.17  0.78  1.0
  Ba  Ba1  1  0.0  0.29  0.6  1.0
  La  La2  1  0.0  0.52  0.53  1.0
  Te  Te3  1  0.0  0.44  0.75  1.0

Ba Ba La Te