data_[Ba10Sn4H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sn  1.9600  1.4500  0.8300
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.9791]
_cell_length_b [5.6760]
_cell_length_c [8.2631]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.7682]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba5(SnH)2]
_chemical_formula_sum '[Ba10 Sn4 H4]'
_cell_volume [639.4262]
_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
[
  Ba  Ba0  4  0.1439  0.0000  0.5328  1.0
  Ba  Ba1  4  0.1740  0.5000  0.8640  1.0
  Ba  Ba2  2  0.0000  0.0000  0.0000  1.0
  Sn  Sn3  4  0.1070  0.5000  0.2700  1.0
  H  H4  4  0.1615  0.0000  0.8744  1.0
]