data_[K8Li4H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.6926]
_cell_length_b [3.7209]
_cell_length_c [14.7731]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [K2LiH3]
_chemical_formula_sum '[K8 Li4 H12]'
_cell_volume [422.8542]
_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
[
  K  K0  4  0.0834  0.7500  0.2868  1
  K  K1  4  0.2357  0.7500  0.5481  1
  Li  Li2  4  0.1320  0.7500  0.8683  1
  H  H3  4  0.0246  0.2500  0.8946  1
  H  H4  4  0.1478  0.2500  0.4252  1
  H  H5  4  0.1716  0.7500  0.7401  1
]