data_KNa2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.69
_cell_length_b   5.3
_cell_length_c   6.76
_cell_angle_alpha   90.0
_cell_angle_beta   95.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KNa2Os
_chemical_formula_sum   'K1 Na2 Os1'
_cell_volume   96.11
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Na  Na1  1  0.95  0.65  0.05  1.0
  Na  Na2  1  0.14  0.65  0.68  1.0
  Os  Os3  1  0.04  0.0  0.37  1.0

data_KNa2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.69
_cell_length_b   5.3
_cell_length_c   6.76
_cell_angle_alpha   90.0
_cell_angle_beta   95.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KNa2Os
_chemical_formula_sum   'K1 Na2 Os1'
_cell_volume   96.11
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Na  Na1  1  0.14  0.65  0.68  1.0
  Na  Na2  1  0.95  0.65  0.05  1.0
  Os  Os3  1  0.04  0.0  0.37  1.0

K Na Na Os
K Na Na Os 0 1 - - o 0 2 o - - 0 3 o o o 1 2 + o - 1 2 o o - 1 3 + + o 2 3 o + o 2 2 + o o 3 3 + o o 