data_[Li2Er2Ga4Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Er  1.2400  1.7500  1.0300
  Ga  1.8100  1.3000  0.7600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9879]
_cell_length_b [7.3368]
_cell_length_c [12.1643]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.2213]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiEr(GaCl3)2]
_chemical_formula_sum '[Li2 Er2 Ga4 Cl12]'
_cell_volume [515.6766]
_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
[
  Li  Li0  2  0.5000  0.0000  0.0000  1.0
  Er  Er1  2  0.0000  0.0000  0.5000  1.0
  Ga  Ga2  4  0.2859  0.5794  0.7657  1.0
  Cl  Cl3  4  0.1473  0.5267  0.2514  1.0
  Cl  Cl4  4  0.2500  0.2042  0.0546  1.0
  Cl  Cl5  4  0.3526  0.6958  0.0458  1.0
]