data_[Zn2Sb2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2685]
_cell_length_b [6.1950]
_cell_length_c [6.2915]
_cell_angle_alpha [75.1983]
_cell_angle_beta [88.9210]
_cell_angle_gamma [88.3456]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [ZnSbCl]
_chemical_formula_sum '[Zn2 Sb2 Cl2]'
_cell_volume [198.4334]
_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  1  0.1227  0.9991  0.4951  1
  Zn  Zn1  1  0.5615  0.5995  0.7647  1
  Sb  Sb2  1  0.0619  0.5682  0.6455  1
  Sb  Sb3  1  0.0666  0.4140  0.2501  1
  Cl  Cl4  1  0.5137  0.9949  0.7185  1
  Cl  Cl5  1  0.5551  0.4649  0.1774  1
]