data_[Zr8Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.4517]
_cell_length_b [5.9232]
_cell_length_c [11.8117]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [ZrSb]
_chemical_formula_sum '[Zr8 Sb8]'
_cell_volume [381.4202]
_cell_formula_units_Z [8]
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
[
  Zr  Zr0  4  0.0000  0.2503  0.5697  1
  Zr  Zr1  2  0.0000  0.0000  0.2972  1
  Zr  Zr2  2  0.0000  0.0000  0.8437  1
  Sb  Sb3  4  0.0000  0.2563  0.0730  1
  Sb  Sb4  2  0.0000  0.5000  0.3511  1
  Sb  Sb5  2  0.0000  0.5000  0.7844  1
]