data_[Cu2Sb4Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Sb  2.0500  1.4500  0.8300
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.4764]
_cell_length_b [3.3068]
_cell_length_c [6.5873]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0662]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CuSb2Os]
_chemical_formula_sum '[Cu2 Sb4 Os2]'
_cell_volume [175.5369]
_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
[
  Cu  Cu0  2  0.4984  0.0000  0.5323  1
  Sb  Sb1  2  0.0088  0.0000  0.8948  1
  Sb  Sb2  2  0.2389  0.5000  0.3682  1
  Os  Os3  2  0.2539  0.0000  0.7047  1
]