data_[Ba2Ho2P4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ho  1.2300  1.7500  1.0410
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.8237]
_cell_length_b [5.1787]
_cell_length_c [8.5543]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1396]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [BaHo(PO4)2]
_chemical_formula_sum '[Ba2 Ho2 P4 O16]'
_cell_volume [346.0678]
_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
[
  Ba  Ba0  2  0.0000  0.9922  0.5000  1.0
  Ho  Ho1  2  0.0000  0.9400  0.0000  1.0
  P  P2  4  0.1065  0.5023  0.7756  1.0
  O  O3  4  0.0531  0.6816  0.2187  1.0
  O  O4  4  0.0562  0.2175  0.8019  1.0
  O  O5  4  0.1786  0.5325  0.6127  1.0
  O  O6  4  0.2283  0.6001  0.9138  1.0
]