data_[In2Ni2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ni  1.9100  1.3500  0.7400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [14.8990]
_cell_length_b [3.5267]
_cell_length_c [19.0811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [InNiCl5]
_chemical_formula_sum '[In2 Ni2 Cl10]'
_cell_volume [1002.6116]
_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  0.2500  0.0000  0.5119  1
  Ni  Ni1  2  0.0000  0.5000  0.5000  1
  Cl  Cl2  4  0.0517  0.0000  0.5734  1
  Cl  Cl3  4  0.1456  0.5000  0.4427  1
  Cl  Cl4  2  0.2500  0.5000  0.6069  1
]