data_[Cs3Er6V3Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Er  1.2400  1.7500  1.0300
  V  1.6300  1.3500  0.7775
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [6.9455]
_cell_length_b [6.9455]
_cell_length_c [26.1633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [CsEr2VCl8]
_chemical_formula_sum '[Cs3 Er6 V3 Cl24]'
_cell_volume [1093.0270]
_cell_formula_units_Z [3]
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
[
  Cs  Cs0  3  -0.0000  0.0000  0.5000  1
  Er  Er1  6  0.0000  0.0000  0.3033  1
  V  V2  3  0.0000  0.0000  0.0000  1
  Cl  Cl3  18  0.0297  0.6318  0.2877  1
  Cl  Cl4  6  0.0000  0.0000  0.2067  1
]