data_[Mn2Zn2Co4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [3.5407]
_cell_length_b [3.5407]
_cell_length_c [7.5084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [MnZnCo2]
_chemical_formula_sum '[Mn2 Zn2 Co4]'
_cell_volume [94.1282]
_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
[
  Mn  Mn0  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn1  2  0.0000  0.5000  0.7500  1.0
  Co  Co2  2  0.0000  0.0000  0.0000  1.0
  Co  Co3  2  0.0000  0.5000  0.2500  1.0
]