data_[Dy1Hf1Cr2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Hf  1.3000  1.5500  0.8500
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.3267]
_cell_length_b [5.4159]
_cell_length_c [5.6967]
_cell_angle_alpha [63.3242]
_cell_angle_beta [89.9005]
_cell_angle_gamma [60.9310]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [DyHfCr2O6]
_chemical_formula_sum '[Dy1 Hf1 Cr2 O6]'
_cell_volume [123.3288]
_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
[
  Dy  Dy0  1  0.7967  0.4037  0.4091  1.0
  Hf  Hf1  1  0.3153  0.3728  0.9473  1.0
  Cr  Cr2  1  0.0127  0.9750  0.0347  1.0
  Cr  Cr3  1  0.5197  0.9543  0.5647  1.0
  O  O4  1  0.1203  0.5112  0.2255  1.0
  O  O5  1  0.2308  0.8437  0.7687  1.0
  O  O6  1  0.3767  0.8992  0.2468  1.0
  O  O7  1  0.6205  0.1555  0.7655  1.0
  O  O8  1  0.7244  0.1323  0.2480  1.0
  O  O9  1  0.9444  0.4290  0.7745  1.0
]