data_NaPOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93
_cell_length_b   3.69
_cell_length_c   5.82
_cell_angle_alpha   90.0
_cell_angle_beta   104.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPOs2
_chemical_formula_sum   'Na1 P1 Os2'
_cell_volume   60.95
_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
  P  P3  1  0.29  0.0  0.82  1.0
  Os  Os1  1  0.48  0.84  0.65  1.0
  Os  Os2  1  0.02  0.84  1.0  1.0

data_NaPOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   3.69
_cell_length_c   5.82
_cell_angle_alpha   90.0
_cell_angle_beta   104.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPOs2
_chemical_formula_sum   'Na1 P1 Os2'
_cell_volume   60.95
_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
  P  P1  1  0.29  0.0  0.82  1.0
  Os  Os2  1  0.02  0.84  1.0  1.0
  Os  Os3  1  0.48  0.84  0.65  1.0

Na P Os Os
Na P Os Os 0 3 o - - 0 1 o o - 1 3 o - o 1 2 o - o 