data_[Er8In4H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.9734]
_cell_length_b [6.6974]
_cell_length_c [8.9397]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4674]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Er4In2H]
_chemical_formula_sum '[Er8 In4 H2]'
_cell_volume [346.3044]
_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
[
  Er  Er0  4  0.2729  0.0011  0.7322  1.0
  Er  Er1  2  0.1782  0.7500  0.0662  1.0
  Er  Er2  2  0.2672  0.2500  0.3744  1.0
  In  In3  2  0.2141  0.7500  0.4198  1.0
  In  In4  2  0.3466  0.2500  0.0421  1.0
  H  H5  2  0.0781  0.7500  0.7992  1.0
]