data_[Ta4Zn2Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.9816]
_cell_length_b [2.9946]
_cell_length_c [5.0130]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.8031]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ta2ZnSb]
_chemical_formula_sum '[Ta4 Zn2 Sb2]'
_cell_volume [147.6529]
_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
[
  Ta  Ta0  2  0.0026  0.0000  0.0138  1
  Ta  Ta1  2  0.2442  0.0000  0.7237  1
  Zn  Zn2  2  0.0028  0.5000  0.5307  1
  Sb  Sb3  2  0.2504  0.5000  0.2318  1
]