data_[Ti10In4Fe4Tc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  In  1.7800  1.5500  0.9400
  Fe  1.8300  1.4000  0.8525
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.2771]
_cell_length_b [10.2771]
_cell_length_c [3.0948]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Ti5In2Fe2Tc]
_chemical_formula_sum '[Ti10 In4 Fe4 Tc2]'
_cell_volume [326.8728]
_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
[
  Ti  Ti0  8  0.0658  0.8010  0.5000  1
  Ti  Ti1  2  0.0000  0.5000  0.5000  1
  In  In2  4  0.1754  0.3246  0.0000  1
  Fe  Fe3  4  0.1280  0.6280  0.0000  1
  Tc  Tc4  2  0.0000  0.0000  0.0000  1
]