data_NaTeOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29
_cell_length_b   5.29
_cell_length_c   5.29
_cell_angle_alpha   136.51
_cell_angle_beta   136.51
_cell_angle_gamma   63.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTeOs2
_chemical_formula_sum   'Na1 Te1 Os2'
_cell_volume   69.3
_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  Te3  1  0.0  0.0  0.51  1.0
  Os  Os1  1  0.96  0.0  0.25  1.0
  Os  Os2  1  0.0  0.96  0.25  1.0

data_NaTeOs2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.55
_cell_length_b   5.55
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   121.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   NaTeOs2
_chemical_formula_sum   'Na2 Te2 Os4'
_cell_volume   138.59
_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  0.0  1.0
  Te  Te1  2  0.49  0.0  0.49  1.0
  Os  Os2  4  0.23  0.48  0.71  1.0

Na Te Os Os