data_[Ni10As4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  As  2.1800  1.1500  0.6600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.4083]
_cell_length_b [8.8599]
_cell_length_c [5.1193]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.7899]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni5(AsO6)2]
_chemical_formula_sum '[Ni10 As4 O24]'
_cell_volume [423.7305]
_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
[
  Ni  Ni0  4  0.0000  0.1771  0.0000  1.0
  Ni  Ni1  4  0.0000  0.3377  0.5000  1.0
  Ni  Ni2  2  0.0000  0.0000  0.5000  1.0
  As  As3  4  0.1839  0.5000  0.0533  1.0
  O  O4  8  0.0902  0.1674  0.3588  1.0
  O  O5  8  0.1303  0.3410  0.8765  1.0
  O  O6  4  0.1233  0.5000  0.3631  1.0
  O  O7  4  0.1278  0.0000  0.8900  1.0
]