data_[Zn4Co8B4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8311]
_cell_length_b [2.6883]
_cell_length_c [6.0913]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8612]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ZnCo2B]
_chemical_formula_sum '[Zn4 Co8 B4]'
_cell_volume [160.6197]
_cell_formula_units_Z [4]
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  0.1298  0.5000  0.9760  1.0
  Co  Co1  4  0.0353  0.0000  0.3020  1.0
  Co  Co2  4  0.2304  0.0000  0.6629  1.0
  B  B3  4  0.0924  0.5000  0.5471  1.0
]