data_[Ba1Zn1Cr2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  Cr  1.6600  1.4000  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9942]
_cell_length_b [6.0161]
_cell_length_c [9.1277]
_cell_angle_alpha [85.1411]
_cell_angle_beta [83.3477]
_cell_angle_gamma [83.6270]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaZn(CrCl4)2]
_chemical_formula_sum '[Ba1 Zn1 Cr2 Cl8]'
_cell_volume [324.0623]
_cell_formula_units_Z [1]
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
[
  Ba  Ba0  1  0.0000  0.0000  0.5000  1
  Zn  Zn1  1  0.0000  0.0000  0.0000  1
  Cr  Cr2  2  0.4901  0.4945  0.1962  1
  Cl  Cl3  2  0.2155  0.8152  0.1975  1
  Cl  Cl4  2  0.2381  0.8285  0.7906  1
  Cl  Cl5  2  0.2731  0.3227  0.9920  1
  Cl  Cl6  2  0.3061  0.3684  0.4263  1
]