data_[La6Tl6Co4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.9688]
_cell_length_b [4.7561]
_cell_length_c [5.0575]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.2500]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Tl3Co2]
_chemical_formula_sum '[La6 Tl6 Co4]'
_cell_volume [402.8584]
_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  4  0.1703  0.0000  0.5860  1.0
  La  La1  2  0.0000  0.0000  0.0000  1.0
  Tl  Tl2  4  0.1390  0.5000  0.0635  1.0
  Tl  Tl3  2  0.0000  0.5000  0.5000  1.0
  Co  Co4  4  0.2110  0.0000  0.0899  1.0
]