data_[La4Ge4H8Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ge  2.0100  1.2500  0.7700
  H  2.2000  0.2500  0.0000
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.0695]
_cell_length_b [11.0613]
_cell_length_c [6.0553]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [LaGeH2Ru]
_chemical_formula_sum '[La4 Ge4 H8 Ru4]'
_cell_volume [272.5677]
_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
[
  La  La0  4  0.0000  0.2966  0.2500  1.0
  Ge  Ge1  4  0.0000  0.4263  0.7500  1.0
  H  H2  8  0.0000  0.1539  0.5554  1.0
  Ru  Ru3  4  0.0000  0.0000  0.0000  1.0
]