data_[Ce2V4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8484]
_cell_length_b [3.8061]
_cell_length_c [6.9560]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.6279]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeV2O6]
_chemical_formula_sum '[Ce2 V4 O12]'
_cell_volume [228.8601]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1.0
  V  V1  4  0.1790  0.0000  0.6096  1.0
  O  O2  4  0.0307  0.0000  0.6921  1.0
  O  O3  4  0.1487  0.5000  0.1067  1.0
  O  O4  4  0.2293  0.5000  0.5970  1.0
]