data_[Yb12Ge4H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Yb  1.1000  1.7500  1.0840
  Ge  2.0100  1.2500  0.7700
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [8.6203]
_cell_length_b [11.3027]
_cell_length_c [4.9246]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Yb3GeH2]
_chemical_formula_sum '[Yb12 Ge4 H8]'
_cell_volume [479.8197]
_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
[
  Yb  Yb0  8  0.1994  0.3806  0.2500  1.0
  Yb  Yb1  4  0.0000  0.1114  0.2500  1.0
  Ge  Ge2  4  0.0000  0.2972  0.7500  1.0
  H  H3  8  0.1563  0.0000  0.0000  1.0
]