data_[Sr4Li4H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.2172]
_cell_length_b [12.5524]
_cell_length_c [5.0550]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [SrLiH3]
_chemical_formula_sum '[Sr4 Li4 H12]'
_cell_volume [267.5904]
_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
[
  Sr  Sr0  4  0.0000  0.3705  0.0997  1.0
  Li  Li1  4  0.0000  0.0760  0.0764  1.0
  H  H2  4  0.0000  0.0593  0.4287  1.0
  H  H3  4  0.0000  0.1971  0.8580  1.0
  H  H4  4  0.0000  0.4284  0.5841  1.0
]