# generated using pymatgen
data_Hf18Re8SiIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.56902841
_cell_length_b   8.56902840
_cell_length_c   8.57424143
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000769
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18Re8SiIr
_chemical_formula_sum   'Hf18 Re8 Si1 Ir1'
_cell_volume   545.24221158
_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
  Hf  Hf0  1  0.19614840  0.80385160  0.44741804  1.0
  Hf  Hf1  1  0.19614840  0.39229680  0.44741804  1.0
  Hf  Hf2  1  0.60770320  0.80385160  0.44741804  1.0
  Hf  Hf3  1  0.80638403  0.19361597  0.54869099  1.0
  Hf  Hf4  1  0.80638403  0.61276707  0.54869099  1.0
  Hf  Hf5  1  0.38723293  0.19361597  0.54869099  1.0
  Hf  Hf6  1  0.80638403  0.19361597  0.95130901  1.0
  Hf  Hf7  1  0.80638403  0.61276707  0.95130901  1.0
  Hf  Hf8  1  0.38723293  0.19361597  0.95130901  1.0
  Hf  Hf9  1  0.19614840  0.80385160  0.05258196  1.0
  Hf  Hf10  1  0.19614840  0.39229680  0.05258196  1.0
  Hf  Hf11  1  0.60770320  0.80385160  0.05258196  1.0
  Hf  Hf12  1  0.54093003  0.45906997  0.25000000  1.0
  Hf  Hf13  1  0.54093003  0.08185907  0.25000000  1.0
  Hf  Hf14  1  0.91814093  0.45906997  0.25000000  1.0
  Hf  Hf15  1  0.46053729  0.53946271  0.75000000  1.0
  Hf  Hf16  1  0.46053729  0.92107557  0.75000000  1.0
  Hf  Hf17  1  0.07892443  0.53946271  0.75000000  1.0
  Re  Re18  1  0.88953517  0.11046483  0.25000000  1.0
  Re  Re19  1  0.88953517  0.77906934  0.25000000  1.0
  Re  Re20  1  0.22093066  0.11046483  0.25000000  1.0
  Re  Re21  1  0.10941390  0.89058610  0.75000000  1.0
  Re  Re22  1  0.10941390  0.21882880  0.75000000  1.0
  Re  Re23  1  0.78117120  0.89058610  0.75000000  1.0
  Re  Re24  1  0.00000000  0.00000000  0.49885787  1.0
  Re  Re25  1  0.00000000  0.00000000  0.00114213  1.0
  Si  Si26  1  0.66666700  0.33333300  0.75000000  1.0
  Ir  Ir27  1  0.33333300  0.66666700  0.25000000  1.0