data_NaCdTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.62
_cell_length_b   6.62
_cell_length_c   6.62
_cell_angle_alpha   141.36
_cell_angle_beta   141.36
_cell_angle_gamma   55.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCdTe2
_chemical_formula_sum   'Na1 Cd1 Te2'
_cell_volume   112.29
_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  0.0  1.0
  Cd  Cd0  1  0.0  0.19  0.93  1.0
  Te  Te2  1  0.19  0.0  0.93  1.0
  Te  Te3  1  0.0  0.0  0.85  1.0

data_NaCdTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   6.62
_cell_angle_alpha   109.32
_cell_angle_beta   109.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCdTe2
_chemical_formula_sum   'Na1 Cd1 Te2'
_cell_volume   112.29
_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  Na0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.74  0.93  0.74  1.0
  Te  Te2  1  0.85  0.85  0.85  1.0
  Te  Te3  1  0.93  0.74  0.74  1.0

Na Cd Te Te