data_[Zr14In4Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1957]
_cell_length_b [8.9166]
_cell_length_c [5.7229]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3639]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr7(InBi)2]
_chemical_formula_sum '[Zr14 In4 Bi4]'
_cell_volume [548.1582]
_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
[
  Zr  Zr0  8  0.2281  0.1704  0.2720  1
  Zr  Zr1  4  0.0047  0.5000  0.2628  1
  Zr  Zr2  2  0.0000  0.0000  0.0000  1
  In  In3  4  0.0000  0.1910  0.5000  1
  Bi  Bi4  4  0.2464  0.0000  0.8217  1
]