data_KYOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.17
_cell_length_b   4.17
_cell_length_c   8.8
_cell_angle_alpha   102.97
_cell_angle_beta   102.97
_cell_angle_gamma   60.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KYOs2
_chemical_formula_sum   'K1 Y1 Os2'
_cell_volume   128.17
_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  0.16  0.0  0.07  1.0
  Y  Y3  1  0.4  0.0  0.11  1.0
  Os  Os1  1  0.02  0.0  0.12  1.0
  Os  Os2  1  0.82  0.0  0.44  1.0

data_KYOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.17
_cell_length_b   4.17
_cell_length_c   8.8
_cell_angle_alpha   77.03
_cell_angle_beta   77.03
_cell_angle_gamma   60.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KYOs2
_chemical_formula_sum   'K1 Y1 Os2'
_cell_volume   128.17
_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  0.84  0.0  0.07  1.0
  Y  Y1  1  0.6  0.0  0.11  1.0
  Os  Os2  1  0.18  0.0  0.44  1.0
  Os  Os3  1  0.98  0.0  0.12  1.0

K Y Os Os