data_[Li4Nd24Tc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nd  1.1400  1.8500  1.2765
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.9478]
_cell_length_b [10.0777]
_cell_length_c [10.4916]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li(Nd3Tc)2]
_chemical_formula_sum '[Li4 Nd24 Tc8]'
_cell_volume [1051.7903]
_cell_formula_units_Z [4]
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
[
  Li  Li0  2  0.0000  0.0000  0.0000  1
  Li  Li1  2  0.0000  0.0000  0.5000  1
  Nd  Nd2  8  0.0000  0.2954  0.3104  1
  Nd  Nd3  8  0.1905  0.2881  0.0000  1
  Nd  Nd4  8  0.2104  0.0000  0.2205  1
  Tc  Tc5  4  0.0000  0.5000  0.1128  1
  Tc  Tc6  4  0.1224  0.5000  0.5000  1
]