data_[La6Tl2Co2]
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 [P-1]
_cell_length_a [6.2444]
_cell_length_b [7.1115]
_cell_length_c [7.2631]
_cell_angle_alpha [108.3904]
_cell_angle_beta [102.6642]
_cell_angle_gamma [92.2172]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La3TlCo]
_chemical_formula_sum '[La6 Tl2 Co2]'
_cell_volume [296.5800]
_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  0.1733  0.8924  0.1603  1.0
  La  La1  2  0.2911  0.8176  0.6681  1.0
  La  La2  2  0.3146  0.3632  0.7563  1.0
  Tl  Tl3  2  0.1880  0.4113  0.2531  1.0
  Co  Co4  2  0.4300  0.1845  0.0030  1.0
]