data_K2BaOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.39
_cell_length_b   7.39
_cell_length_c   4.29
_cell_angle_alpha   105.31
_cell_angle_beta   105.31
_cell_angle_gamma   128.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2BaOs
_chemical_formula_sum   'K2 Ba1 Os1'
_cell_volume   147.07
_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  K1  1  0.33  0.32  0.71  1.0
  K  K2  1  0.33  0.68  0.71  1.0
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.24  0.0  0.0  1.0

data_K2BaOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.29
_cell_length_b   5.18
_cell_length_c   7.39
_cell_angle_alpha   109.21
_cell_angle_beta   105.31
_cell_angle_gamma   94.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2BaOs
_chemical_formula_sum   'K2 Ba1 Os1'
_cell_volume   147.07
_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  0.03  0.32  0.65  1.0
  K  K1  1  0.39  0.68  0.01  1.0
  Ba  Ba2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.24  1.0

K K Ba Os