data_[Zn3Cd1O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Cd  1.6900  1.5500  1.0900
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.3643]
_cell_length_b [3.3643]
_cell_length_c [11.0241]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Zn3CdO4]
_chemical_formula_sum '[Zn3 Cd1 O4]'
_cell_volume [108.0597]
_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
[
  Zn  Zn0  1  0.0000  0.0000  0.7495  1.0
  Zn  Zn1  1  0.3333  0.6667  0.5129  1.0
  Zn  Zn2  1  0.3333  0.6667  0.9862  1.0
  Cd  Cd3  1  0.0000  0.0000  0.2447  1.0
  O  O4  1  0.0000  0.0000  0.0411  1.0
  O  O5  1  0.0000  0.0000  0.5681  1.0
  O  O6  1  0.3333  0.6667  0.3332  1.0
  O  O7  1  0.3333  0.6667  0.8044  1.0
]