data_[In2Re4Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Re  1.9000  1.3500  0.7125
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.6295]
_cell_length_b [2.8888]
_cell_length_c [5.4802]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.8401]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [InRe2Cl]
_chemical_formula_sum '[In2 Re4 Cl2]'
_cell_volume [145.9672]
_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
[
  In  In0  2  0.2261  0.5000  0.2631  1
  Re  Re1  2  0.2623  0.0000  0.8340  1
  Re  Re2  2  0.4670  0.5000  0.8387  1
  Cl  Cl3  2  0.0446  0.5000  0.5642  1
]