data_[Al2Zn6Cu1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [2.6821]
_cell_length_b [6.6088]
_cell_length_c [8.2933]
_cell_angle_alpha [82.1203]
_cell_angle_beta [87.1622]
_cell_angle_gamma [79.4749]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Al2Zn6Cu]
_chemical_formula_sum '[Al2 Zn6 Cu1]'
_cell_volume [143.1202]
_cell_formula_units_Z [1]
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
[
  Al  Al0  2  0.4991  0.0665  0.7343  1
  Zn  Zn1  2  0.1470  0.7894  0.5808  1
  Zn  Zn2  2  0.1889  0.5559  0.3209  1
  Zn  Zn3  2  0.3344  0.3351  0.9835  1
  Cu  Cu4  1  0.0000  0.0000  0.0000  1
]