data_[Cs4La8V4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  La  1.1000  1.9500  1.1720
  V  1.6300  1.3500  0.7775
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [8.2115]
_cell_length_b [8.2115]
_cell_length_c [10.4528]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [122]
_chemical_formula_structural [CsLa2V]
_chemical_formula_sum '[Cs4 La8 V4]'
_cell_volume [704.8224]
_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
[
  Cs  Cs0  4  0.0000  0.0000  0.0000  1
  La  La1  8  0.0717  0.2500  0.6250  1
  V  V2  4  0.0000  0.0000  0.5000  1
]