data_[La36In8Co12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.4894]
_cell_length_b [8.5753]
_cell_length_c [12.5969]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.0446]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La9In2Co3]
_chemical_formula_sum '[La36 In8 Co12]'
_cell_volume [1600.3541]
_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
[
  La  La0  8  0.0494  0.4625  0.4175  1
  La  La1  8  0.1194  0.0708  0.5504  1
  La  La2  8  0.1547  0.2319  0.2696  1
  La  La3  8  0.2410  0.3993  0.0729  1
  La  La4  4  0.0000  0.1491  0.7500  1
  In  In5  8  0.1585  0.3928  0.7433  1
  Co  Co6  8  0.0671  0.2327  0.9915  1
  Co  Co7  4  0.2500  0.2500  0.5000  1
]