data_[La12Co6Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [11.7378]
_cell_length_b [4.0262]
_cell_length_c [12.2588]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.3739]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La6Co3Ni]
_chemical_formula_sum '[La12 Co6 Ni2]'
_cell_volume [535.7209]
_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
[
  La  La0  2  0.0634  0.2500  0.3978  1
  La  La1  2  0.0940  0.2500  0.9323  1
  La  La2  2  0.2487  0.7500  0.2339  1
  La  La3  2  0.2596  0.2500  0.7322  1
  La  La4  2  0.4062  0.7500  0.5661  1
  La  La5  2  0.4467  0.2500  0.1013  1
  Co  Co6  2  0.0875  0.2500  0.1626  1
  Co  Co7  2  0.1692  0.7500  0.5592  1
  Co  Co8  2  0.4976  0.7500  0.2769  1
  Ni  Ni9  2  0.3024  0.7500  0.9333  1
]