data_[Ce6Tl2Tc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Tl  1.6200  1.9000  1.3325
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7547]
_cell_length_b [5.3274]
_cell_length_c [7.2607]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9471]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ce3TlTc]
_chemical_formula_sum '[Ce6 Tl2 Tc2]'
_cell_volume [261.1243]
_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
[
  Ce  Ce0  2  0.0337  0.7500  0.1349  1
  Ce  Ce1  2  0.1520  0.7500  0.5512  1
  Ce  Ce2  2  0.4000  0.2500  0.8259  1
  Tl  Tl3  2  0.3094  0.2500  0.2993  1
  Tc  Tc4  2  0.2972  0.7500  0.8623  1
]