data_NaGeTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46
_cell_length_b   6.46
_cell_length_c   5.69
_cell_angle_alpha   91.66
_cell_angle_beta   91.66
_cell_angle_gamma   30.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaGeTe2
_chemical_formula_sum   'Na1 Ge1 Te2'
_cell_volume   121.26
_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  0.98  0.0  0.94  1.0
  Ge  Ge0  1  0.08  0.0  0.5  1.0
  Te  Te2  1  0.3  0.0  0.72  1.0
  Te  Te3  1  0.36  0.0  0.06  1.0

data_NaGeTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   5.69
_cell_length_c   6.46
_cell_angle_alpha   91.66
_cell_angle_beta   105.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaGeTe2
_chemical_formula_sum   'Na1 Ge1 Te2'
_cell_volume   121.26
_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  0.94  0.98  1.0
  Ge  Ge1  1  0.0  0.5  0.08  1.0
  Te  Te2  1  0.0  0.06  0.36  1.0
  Te  Te3  1  0.0  0.72  0.3  1.0

Na Ge Te Te