data_[Cs6Ni4Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ni  1.9100  1.3500  0.7400
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9297]
_cell_length_b [4.2550]
_cell_length_c [10.5959]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.8206]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3(NiSb2)2]
_chemical_formula_sum '[Cs6 Ni4 Sb8]'
_cell_volume [656.3301]
_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
[
  Cs  Cs0  4  0.1133  0.5000  0.3971  1.0
  Cs  Cs1  2  0.0000  0.0000  0.0000  1.0
  Ni  Ni2  4  0.1885  0.5000  0.8391  1.0
  Sb  Sb3  4  0.1210  0.0000  0.7065  1.0
  Sb  Sb4  4  0.2137  0.5000  0.0899  1.0
]