data_[Sr12Li4H24]
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 [9.4953]
_cell_length_b [12.1160]
_cell_length_c [5.7195]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sr3LiH6]
_chemical_formula_sum '[Sr12 Li4 H24]'
_cell_volume [657.9999]
_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  8  0.1937  0.1103  0.5287  1
  Sr  Sr1  4  0.0000  0.3910  0.5665  1
  Li  Li2  4  0.0000  0.1926  0.9983  1
  H  H3  8  0.1489  0.2591  0.8178  1
  H  H4  8  0.1585  0.4906  0.2967  1
  H  H5  4  0.0000  0.0394  0.8325  1
  H  H6  4  0.0000  0.2155  0.3308  1
]