# generated using pymatgen
data_Ce3B2(ClO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22250422
_cell_length_b   9.22250422
_cell_length_c   5.85296500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000155
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3B2(ClO2)3
_chemical_formula_sum   'Ce6 B4 Cl6 O12'
_cell_volume   431.12606170
_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  1  0.33657900  0.38641600  0.75000000  1.0
  Ce  Ce1  1  0.04983700  0.66342100  0.75000000  1.0
  Ce  Ce2  1  0.66342100  0.61358400  0.25000000  1.0
  Ce  Ce3  1  0.38641600  0.04983700  0.25000000  1.0
  Ce  Ce4  1  0.61358400  0.95016300  0.75000000  1.0
  Ce  Ce5  1  0.95016300  0.33657900  0.25000000  1.0
  B  B6  1  0.66666700  0.33333300  0.51339400  1.0
  B  B7  1  0.66666700  0.33333300  0.98660600  1.0
  B  B8  1  0.33333300  0.66666700  0.01339400  1.0
  B  B9  1  0.33333300  0.66666700  0.48660600  1.0
  Cl  Cl10  1  0.03689300  0.79778100  0.25000000  1.0
  Cl  Cl11  1  0.23911200  0.03689300  0.75000000  1.0
  Cl  Cl12  1  0.76088800  0.96310700  0.25000000  1.0
  Cl  Cl13  1  0.96310700  0.20221900  0.75000000  1.0
  Cl  Cl14  1  0.79778100  0.76088800  0.75000000  1.0
  Cl  Cl15  1  0.20221900  0.23911200  0.25000000  1.0
  O  O16  1  0.17083700  0.53654900  0.50085900  1.0
  O  O17  1  0.82916300  0.46345100  0.00085900  1.0
  O  O18  1  0.36571200  0.82916300  0.50085900  1.0
  O  O19  1  0.53654900  0.36571200  0.00085900  1.0
  O  O20  1  0.63428800  0.17083700  0.00085900  1.0
  O  O21  1  0.46345100  0.63428800  0.99914100  1.0
  O  O22  1  0.46345100  0.63428800  0.50085900  1.0
  O  O23  1  0.53654900  0.36571200  0.49914100  1.0
  O  O24  1  0.36571200  0.82916300  0.99914100  1.0
  O  O25  1  0.63428800  0.17083700  0.49914100  1.0
  O  O26  1  0.17083700  0.53654900  0.99914100  1.0
  O  O27  1  0.82916300  0.46345100  0.49914100  1.0