data_CdOs2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   5.27
_cell_angle_alpha   105.86
_cell_angle_beta   105.86
_cell_angle_gamma   31.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdOs2Se
_chemical_formula_sum   'Cd1 Os2 Se1'
_cell_volume   72.52
_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
  Cd  Cd0  1  0.47  0.0  0.81  1.0
  Os  Os1  1  0.12  0.0  0.48  1.0
  Os  Os2  1  0.19  0.0  0.1  1.0
  Se  Se3  1  0.02  0.0  0.19  1.0

data_CdOs2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   5.22
_cell_length_c   5.27
_cell_angle_alpha   105.86
_cell_angle_beta   90.0
_cell_angle_gamma   105.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdOs2Se
_chemical_formula_sum   'Cd1 Os2 Se1'
_cell_volume   72.52
_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
  Cd  Cd0  1  0.0  0.53  0.19  1.0
  Os  Os1  1  0.0  0.81  0.9  1.0
  Os  Os2  1  0.0  0.88  0.52  1.0
  Se  Se3  1  0.0  0.98  0.81  1.0

Cd Os Os Se