data_NaLaTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34
_cell_length_b   4.64
_cell_length_c   4.64
_cell_angle_alpha   89.95
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLaTe2
_chemical_formula_sum   'Na1 La1 Te2'
_cell_volume   136.72
_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
  Na  Na1  1  0.0  0.0  0.65  1.0
  La  La0  1  0.17  0.0  0.56  1.0
  Te  Te2  1  0.17  0.0  0.83  1.0
  Te  Te3  1  0.0  0.0  0.41  1.0

data_NaLaTe2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.64
_cell_length_b   4.64
_cell_length_c   6.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   NaLaTe2
_chemical_formula_sum   'Na1 La1 Te2'
_cell_volume   136.72
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Na  Na0  1  0.65  0.0  0.0  1.0
  La  La1  1  0.56  0.0  0.17  1.0
  Te  Te2  1  0.41  0.0  0.0  1.0
  Te  Te3  1  0.83  0.0  0.17  1.0

Na La Te Te
Na La Te Te 0 3 o o o 0 1 o o o 0 2 o o o 1 3 o o o 1 2 o o o 