data_NaRe2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11
_cell_length_b   5.11
_cell_length_c   4.94
_cell_angle_alpha   103.38
_cell_angle_beta   103.38
_cell_angle_gamma   31.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaRe2Os
_chemical_formula_sum   'Na1 Re2 Os1'
_cell_volume   64.94
_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  0.29  0.0  0.34  1.0
  Re  Re2  1  0.89  0.0  0.78  1.0
  Re  Re3  1  0.76  0.0  0.8  1.0
  Os  Os1  1  0.86  0.0  0.07  1.0

data_NaRe2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.75
_cell_length_b   4.94
_cell_length_c   5.11
_cell_angle_alpha   103.38
_cell_angle_beta   105.61
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaRe2Os
_chemical_formula_sum   'Na1 Re2 Os1'
_cell_volume   64.94
_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  0.34  0.29  1.0
  Re  Re1  1  0.0  0.78  0.89  1.0
  Re  Re2  1  0.0  0.8  0.76  1.0
  Os  Os3  1  0.0  0.07  0.86  1.0

Na Re Re Os