data_[Ca1Cr1Cd2H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Cr  1.6600  1.4000  0.9400
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.6662]
_cell_length_b [4.6662]
_cell_length_c [6.3123]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [CaCr(CdH4)2]
_chemical_formula_sum '[Ca1 Cr1 Cd2 H8]'
_cell_volume [119.0248]
_cell_formula_units_Z [1]
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
[
  Ca  Ca0  1  0.0000  0.0000  0.5000  1
  Cr  Cr1  1  0.0000  0.0000  0.0000  1
  Cd  Cd2  2  0.3333  0.6667  0.1717  1
  H  H3  6  0.1587  0.3173  0.8257  1
  H  H4  2  0.3333  0.6667  0.4711  1
]