# generated using pymatgen
data_Pt(I2O)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19372000
_cell_length_b   5.19372000
_cell_length_c   13.39394500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt(I2O)2
_chemical_formula_sum   'Pt2 I8 O4'
_cell_volume   361.29801570
_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
  Pt  Pt0  1  0.50000000  0.50000000  0.50000000  1.0
  Pt  Pt1  1  0.00000000  0.00000000  0.00000000  1.0
  I  I2  1  0.23572700  0.76427300  0.35585000  1.0
  I  I3  1  0.76427300  0.23572700  0.35585000  1.0
  I  I4  1  0.26427300  0.26427300  0.85585000  1.0
  I  I5  1  0.73572700  0.73572700  0.85585000  1.0
  I  I6  1  0.76427300  0.23572700  0.64415000  1.0
  I  I7  1  0.23572700  0.76427300  0.64415000  1.0
  I  I8  1  0.73572700  0.73572700  0.14415000  1.0
  I  I9  1  0.26427300  0.26427300  0.14415000  1.0
  O  O10  1  0.75714000  0.75714000  0.50000000  1.0
  O  O11  1  0.24286000  0.24286000  0.50000000  1.0
  O  O12  1  0.74286000  0.25714000  0.00000000  1.0
  O  O13  1  0.25714000  0.74286000  0.00000000  1.0