data_[La6Zn3Co9Ni36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.3619]
_cell_length_b [8.3619]
_cell_length_c [12.0656]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [La2Zn(CoNi4)3]
_chemical_formula_sum '[La6 Zn3 Co9 Ni36]'
_cell_volume [730.6279]
_cell_formula_units_Z [3]
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
[
  La  La0  6  0.0000  0.0000  0.2697  1
  Zn  Zn1  3  0.0000  0.0000  0.0000  1
  Co  Co2  9  0.0000  0.5000  0.5000  1
  Ni  Ni3  18  0.0194  0.5097  0.7089  1
  Ni  Ni4  18  0.0480  0.5240  0.1031  1
]