data_[Hf4Zr4In8Cu8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zr  1.3300  1.5500  0.8600
  In  1.7800  1.5500  0.9400
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [8.7843]
_cell_length_b [4.3923]
_cell_length_c [13.1751]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4538]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [HfZr(InCu)2]
_chemical_formula_sum '[Hf4 Zr4 In8 Cu8]'
_cell_volume [479.3139]
_cell_formula_units_Z [4]
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
[
  Hf  Hf0  1  0.0627  0.0000  0.6252  1
  Hf  Hf1  1  0.3123  0.0000  0.1247  1
  Hf  Hf2  1  0.8125  0.0000  0.1251  1
  Hf  Hf3  1  0.9377  0.5000  0.8752  1
  Zr  Zr4  1  0.1875  0.5000  0.3748  1
  Zr  Zr5  1  0.4375  0.5000  0.8749  1
  Zr  Zr6  1  0.5623  0.0000  0.6250  1
  Zr  Zr7  1  0.6874  0.5000  0.3751  1
  In  In8  1  0.0620  0.5000  0.1240  1
  In  In9  1  0.1868  0.0000  0.8750  1
  In  In10  1  0.3119  0.5000  0.6256  1
  In  In11  1  0.4373  0.0000  0.3745  1
  In  In12  1  0.5626  0.5000  0.1250  1
  In  In13  1  0.6887  0.0000  0.8760  1
  In  In14  1  0.8135  0.5000  0.6255  1
  In  In15  1  0.9372  0.0000  0.3744  1
  Cu  Cu16  1  0.0000  0.0000  0.0000  1
  Cu  Cu17  1  0.1230  0.5000  0.7495  1
  Cu  Cu18  1  0.2484  0.0000  0.5008  1
  Cu  Cu19  1  0.3738  0.5000  0.2479  1
  Cu  Cu20  1  0.5006  0.0000  0.0017  1
  Cu  Cu21  1  0.6274  0.5000  0.7512  1
  Cu  Cu22  1  0.7524  0.0000  0.5009  1
  Cu  Cu23  1  0.8742  0.5000  0.2480  1
]