data_[Cs6Cu2H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [6.4170]
_cell_length_b [8.9951]
_cell_length_c [6.7678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Cs3CuH4]
_chemical_formula_sum '[Cs6 Cu2 H8]'
_cell_volume [390.6501]
_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
[
  Cs  Cs0  4  0.0000  0.2405  0.4406  1.0
  Cs  Cs1  2  0.0000  0.0000  0.9572  1.0
  Cu  Cu2  2  0.0000  0.5000  0.9911  1.0
  H  H3  4  0.0000  0.3401  0.8677  1.0
  H  H4  4  0.2083  0.5000  0.1420  1.0
]