data_[Li4In2Ni10B4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Ni  1.9100  1.3500  0.7400
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.8881]
_cell_length_b [8.8881]
_cell_length_c [2.9049]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2InNi5B2]
_chemical_formula_sum '[Li4 In2 Ni10 B4]'
_cell_volume [229.4812]
_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
[
  Li  Li0  4  0.1757  0.6757  0.0000  1.0
  In  In1  2  0.0000  0.0000  0.0000  1.0
  Ni  Ni2  8  0.0713  0.2328  0.5000  1.0
  Ni  Ni3  2  0.0000  0.5000  0.5000  1.0
  B  B4  4  0.1183  0.3817  0.0000  1.0
]