data_[Ca1In1Ag2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.3882]
_cell_length_b [7.8398]
_cell_length_c [6.6918]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8030]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CaIn(AgCl4)2]
_chemical_formula_sum '[Ca1 In1 Ag2 Cl8]'
_cell_volume [332.7809]
_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
[
  Ca  Ca0  1  0.0000  0.5000  0.0000  1.0
  In  In1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.5000  0.2490  0.5000  1.0
  Cl  Cl3  4  0.2086  0.2303  0.8506  1.0
  Cl  Cl4  2  0.2799  0.0000  0.3345  1.0
  Cl  Cl5  2  0.2803  0.5000  0.3477  1.0
]