data_NaTe2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   131.99
_cell_angle_beta   113.83
_cell_angle_gamma   85.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTe2Ru
_chemical_formula_sum   'Na1 Te2 Ru1'
_cell_volume   93.16
_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
  Te  Te2  1  0.13  0.0  0.2  1.0
  Te  Te3  1  0.0  0.86  0.63  1.0
  Ru  Ru1  1  0.0  0.0  0.83  1.0

data_NaTe2Ru
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   66.17
_cell_angle_beta   65.99
_cell_angle_gamma   65.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTe2Ru
_chemical_formula_sum   'Na1 Te2 Ru1'
_cell_volume   93.16
_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
  Te  Te1  1  0.0  0.87  0.2  1.0
  Te  Te2  1  0.86  0.0  0.78  1.0
  Ru  Ru3  1  0.0  0.0  0.83  1.0

Na Te Te Ru