data_[Co2Re2Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Re  1.9000  1.3500  0.7125
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.7990]
_cell_length_b [2.6930]
_cell_length_c [4.6868]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.6276]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CoReOs2]
_chemical_formula_sum '[Co2 Re2 Os4]'
_cell_volume [109.4924]
_cell_formula_units_Z [2]
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
[
  Co  Co0  2  0.0000  0.5000  0.0000  1
  Re  Re1  2  0.0000  0.0000  0.5000  1
  Os  Os2  4  0.2497  0.0000  0.2379  1
]