data_[Rb8Li4Ca4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Ca  1.0000  1.8000  1.1400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.2424]
_cell_length_b [18.7468]
_cell_length_c [13.8236]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Rb2LiCaCl5]
_chemical_formula_sum '[Rb8 Li4 Ca4 Cl20]'
_cell_volume [1099.4132]
_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
[
  Rb  Rb0  4  0.0000  0.1018  0.6749  1.0
  Rb  Rb1  4  0.0000  0.1283  0.3214  1.0
  Li  Li2  4  0.0000  0.4405  0.4364  1.0
  Ca  Ca3  4  0.0000  0.2039  0.0242  1.0
  Cl  Cl4  4  0.0000  0.0576  0.0240  1.0
  Cl  Cl5  4  0.0000  0.2892  0.6565  1.0
  Cl  Cl6  4  0.0000  0.3119  0.3920  1.0
  Cl  Cl7  4  0.0000  0.3463  0.0042  1.0
  Cl  Cl8  4  0.0000  0.4985  0.2905  1.0
]