data_NaLiTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.1
_cell_length_b   9.1
_cell_length_c   9.1
_cell_angle_alpha   23.25
_cell_angle_beta   23.25
_cell_angle_gamma   23.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLiTe2
_chemical_formula_sum   'Na1 Li1 Te2'
_cell_volume   103.08
_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  0.27  1.0
  Li  Li0  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.0  0.0  0.82  1.0
  Te  Te3  1  0.0  0.0  0.73  1.0

data_NaLiTe2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.35
_cell_length_b   3.67
_cell_length_c   9.1
_cell_angle_alpha   90.0
_cell_angle_beta   103.46
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   NaLiTe2
_chemical_formula_sum   'Na2 Li2 Te4'
_cell_volume   206.16
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.73  1.0
  Li  Li1  2  0.0  0.0  0.0  1.0
  Te  Te2  2  0.0  0.0  0.18  1.0
  Te  Te3  2  0.0  0.0  0.27  1.0

Na Li Te Te
Na Li Te Te 0 1 o o o 1 2 o o - 2 3 o o o 