data_[Nd2Zn6O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.5697]
_cell_length_b [7.7270]
_cell_length_c [8.3263]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [NdZn3O4]
_chemical_formula_sum '[Nd2 Zn6 O8]'
_cell_volume [229.6665]
_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
[
  Nd  Nd0  2  0.0000  0.0000  0.4899  1
  Zn  Zn1  4  0.5000  0.2079  0.8109  1
  Zn  Zn2  2  0.0000  0.0000  0.0912  1
  O  O3  4  0.0000  0.2014  0.9330  1
  O  O4  2  0.5000  0.0000  0.2656  1
  O  O5  2  0.5000  0.0000  0.6654  1
]