data_[Y1Hf1B2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Hf  1.3000  1.5500  0.8500
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8566]
_cell_length_b [4.9193]
_cell_length_c [5.9000]
_cell_angle_alpha [111.7848]
_cell_angle_beta [95.2254]
_cell_angle_gamma [114.9617]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [YHf(BO3)2]
_chemical_formula_sum '[Y1 Hf1 B2 O6]'
_cell_volume [113.4128]
_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
[
  Y  Y0  1  0.0000  0.0000  0.0000  1
  Hf  Hf1  1  0.5000  0.0000  0.5000  1
  B  B2  2  0.2320  0.4822  0.7350  1
  O  O3  2  0.0554  0.5237  0.2631  1
  O  O4  2  0.2705  0.2182  0.7365  1
  O  O5  2  0.4869  0.7584  0.7404  1
]