# generated using pymatgen
data_Ba4IrPt3I2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.54448515
_cell_length_b   4.54448515
_cell_length_c   18.84599233
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998554
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4IrPt3I2
_chemical_formula_sum   'Ba4 Ir1 Pt3 I2'
_cell_volume   337.06920938
_cell_formula_units_Z   1
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
  Ba  Ba0  1  0.00000000  0.00000000  0.10819092  1.0
  Ba  Ba1  1  0.00000000  0.00000000  0.89170424  1.0
  Ba  Ba2  1  0.00000000  0.00000000  0.61022856  1.0
  Ba  Ba3  1  0.00000000  0.00000000  0.38980327  1.0
  Ir  Ir4  1  0.33333300  0.66666700  0.99963728  1.0
  Pt  Pt5  1  0.33333300  0.66666700  0.50038244  1.0
  Pt  Pt6  1  0.66666700  0.33333300  0.49966126  1.0
  Pt  Pt7  1  0.66666700  0.33333300  0.00035700  1.0
  I  I8  1  0.33333300  0.66666700  0.25130857  1.0
  I  I9  1  0.66666700  0.33333300  0.74872747  1.0