data_BaNa2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65
_cell_length_b   4.62
_cell_length_c   7.94
_cell_angle_alpha   90.0
_cell_angle_beta   106.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNa2Te
_chemical_formula_sum   'Ba1 Na2 Te1'
_cell_volume   163.32
_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  0.67  0.31  0.42  1.0
  Na  Na1  1  0.93  0.0  0.2  1.0
  Na  Na2  1  0.24  0.31  0.81  1.0
  Te  Te3  1  0.36  0.0  0.57  1.0

data_BaNa2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.62
_cell_length_b   4.65
_cell_length_c   7.94
_cell_angle_alpha   106.88
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNa2Te
_chemical_formula_sum   'Ba1 Na2 Te1'
_cell_volume   163.32
_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  0.69  0.33  0.58  1.0
  Na  Na1  1  0.0  0.07  0.8  1.0
  Na  Na2  1  0.69  0.76  0.19  1.0
  Te  Te3  1  0.0  0.64  0.43  1.0

Ba Na Na Te