data_KIn2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05
_cell_length_b   5.05
_cell_length_c   5.05
_cell_angle_alpha   121.72
_cell_angle_beta   121.72
_cell_angle_gamma   87.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KIn2Os
_chemical_formula_sum   'K1 In2 Os1'
_cell_volume   88.69
_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  K2  1  0.0  0.0  0.0  1.0
  In  In0  1  0.0  0.46  0.83  1.0
  In  In1  1  0.46  0.0  0.83  1.0
  Os  Os3  1  0.0  0.0  0.66  1.0

data_KIn2Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.96
_cell_length_b   6.96
_cell_length_c   5.05
_cell_angle_alpha   90.0
_cell_angle_beta   133.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   KIn2Os
_chemical_formula_sum   'K2 In4 Os2'
_cell_volume   177.38
_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
  K  K0  2  0.0  0.0  0.0  1.0
  In  In1  4  0.27  0.27  0.37  1.0
  Os  Os2  2  0.0  0.0  0.66  1.0

K In In Os
K In In Os 0 3 o o - 0 1 o - - 0 2 - o - 1 3 o o o 2 3 o o o 