data_[Zn2Ga4Cu8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.8269]
_cell_length_b [6.3762]
_cell_length_c [6.5800]
_cell_angle_alpha [93.9507]
_cell_angle_beta [103.5697]
_cell_angle_gamma [101.5999]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Zn(GaCu2)2]
_chemical_formula_sum '[Zn2 Ga4 Cu8]'
_cell_volume [191.4046]
_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
[
  Zn  Zn0  1  0.0324  0.1780  0.9914  1.0
  Zn  Zn1  1  0.4809  0.6487  0.5055  1.0
  Ga  Ga2  1  0.0324  0.4935  0.6933  1.0
  Ga  Ga3  1  0.5309  0.3389  0.8185  1.0
  Ga  Ga4  1  0.5791  0.2821  0.2903  1.0
  Ga  Ga5  1  0.7701  0.8970  0.2447  1.0
  Cu  Cu6  1  0.0885  0.8679  0.5795  1.0
  Cu  Cu7  1  0.1378  0.2439  0.4349  1.0
  Cu  Cu8  1  0.2730  0.9136  0.2478  1.0
  Cu  Cu9  1  0.3902  0.5722  0.0675  1.0
  Cu  Cu10  1  0.4408  0.9511  0.9146  1.0
  Cu  Cu11  1  0.6728  0.0572  0.6125  1.0
  Cu  Cu12  1  0.8647  0.7634  0.8871  1.0
  Cu  Cu13  1  0.9565  0.5424  0.2123  1.0
]