# generated using pymatgen
data_YbIClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.72879907
_cell_length_b   8.72879996
_cell_length_c   7.16746521
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   129.30682434
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbIClO3
_chemical_formula_sum   'Yb4 I4 Cl4 O12'
_cell_volume   422.55532545
_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
  Yb  Yb0  1  0.34197689  0.15802311  0.75000000  1.0
  Yb  Yb1  1  0.15802311  0.34197689  0.25000000  1.0
  Yb  Yb2  1  0.65802311  0.84197689  0.25000000  1.0
  Yb  Yb3  1  0.84197689  0.65802311  0.75000000  1.0
  I  I4  1  0.60332272  0.39667728  0.27632173  1.0
  I  I5  1  0.39667728  0.60332272  0.72367827  1.0
  I  I6  1  0.89667728  0.10332272  0.77632173  1.0
  I  I7  1  0.10332272  0.89667728  0.22367827  1.0
  Cl  Cl8  1  0.20943456  0.79056544  0.66156796  1.0
  Cl  Cl9  1  0.79056544  0.20943456  0.33843204  1.0
  Cl  Cl10  1  0.29056544  0.70943456  0.16156796  1.0
  Cl  Cl11  1  0.70943456  0.29056544  0.83843204  1.0
  O  O12  1  0.41204195  0.21651697  0.43853470  1.0
  O  O13  1  0.21651697  0.41204195  0.56146530  1.0
  O  O14  1  0.71651797  0.91204195  0.93853470  1.0
  O  O15  1  0.91204195  0.71651697  0.06146530  1.0
  O  O16  1  0.58795805  0.78348303  0.56146530  1.0
  O  O17  1  0.78348303  0.58795805  0.43853470  1.0
  O  O18  1  0.28348303  0.08795805  0.06146530  1.0
  O  O19  1  0.08795805  0.28348303  0.93853470  1.0
  O  O20  1  0.49039016  0.50960984  0.21584407  1.0
  O  O21  1  0.50960984  0.49039016  0.78415593  1.0
  O  O22  1  0.00960984  0.99039016  0.71584407  1.0
  O  O23  1  0.99039016  0.00960984  0.28415593  1.0