data_[Ce6In6Tc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5518]
_cell_length_b [4.8899]
_cell_length_c [4.9817]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.9177]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3In3Tc2]
_chemical_formula_sum '[Ce6 In6 Tc4]'
_cell_volume [395.9042]
_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  4  0.1687  0.0000  0.5920  1
  Ce  Ce1  2  0.0000  0.0000  0.0000  1
  In  In2  4  0.1286  0.5000  0.0762  1
  In  In3  2  0.0000  0.5000  0.5000  1
  Tc  Tc4  4  0.2115  0.0000  0.0713  1
]