data_[Zn4Sn2Ir2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Sn  1.9600  1.4500  0.8300
  Ir  2.2000  1.3500  0.7650
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.3376]
_cell_length_b [5.3419]
_cell_length_c [9.4676]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3520]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Zn2SnIrO6]
_chemical_formula_sum '[Zn4 Sn2 Ir2 O12]'
_cell_volume [222.8696]
_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
[
  Zn  Zn0  4  0.2607  0.5288  0.7502  1
  Sn  Sn1  2  0.0000  0.0000  0.5000  1
  Ir  Ir2  2  0.5000  0.0000  0.0000  1
  O  O3  4  0.1075  0.6672  0.4312  1
  O  O4  4  0.2691  0.1758  0.4325  1
  O  O5  4  0.3782  0.5948  0.2567  1
]