data_[Sr4Fe8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Fe  1.8300  1.4000  0.8525
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.3141]
_cell_length_b [12.1825]
_cell_length_c [7.0841]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9984]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Sr(FeCl3)2]
_chemical_formula_sum '[Sr4 Fe8 Cl24]'
_cell_volume [1114.9097]
_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
[
  Sr  Sr0  4  0.0000  0.1218  0.7500  1.0
  Fe  Fe1  8  0.2007  0.4226  0.7666  1.0
  Cl  Cl2  8  0.1184  0.0693  0.1470  1.0
  Cl  Cl3  8  0.1405  0.2625  0.6251  1.0
  Cl  Cl4  8  0.1438  0.4382  0.0466  1.0
]