data_[Li2In2P4]
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
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.9888]
_cell_length_b [3.7397]
_cell_length_c [3.8702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1144]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiInP2]
_chemical_formula_sum '[Li2 In2 P4]'
_cell_volume [150.2751]
_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  2  0.2373  0.5000  0.6020  1
  In  In1  2  0.4683  0.0000  0.6221  1
  P  P2  2  0.0537  0.0000  0.1800  1
  P  P3  2  0.2407  0.0000  0.0960  1
]