data_[Zn4Ga16Ni4]
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
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.6993]
_cell_length_b [8.6553]
_cell_length_c [5.1677]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.2365]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [ZnGa4Ni]
_chemical_formula_sum '[Zn4 Ga16 Ni4]'
_cell_volume [388.4789]
_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
[
  Zn  Zn0  4  0.0000  0.4953  0.2500  1.0
  Ga  Ga1  8  0.0989  0.2320  0.5099  1.0
  Ga  Ga2  8  0.2284  0.0972  0.0233  1.0
  Ni  Ni3  4  0.0000  0.0024  0.7500  1.0
]