# generated using pymatgen
data_Hf18Re8IrSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.59296255
_cell_length_b   8.59296279
_cell_length_c   8.57416401
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000288
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18Re8IrSe
_chemical_formula_sum   'Hf18 Re8 Ir1 Se1'
_cell_volume   548.28738844
_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  0.19520738  0.80479262  0.44566828  1.0
  Hf  Hf1  1  0.19520738  0.39041575  0.44566828  1.0
  Hf  Hf2  1  0.60958425  0.80479262  0.44566828  1.0
  Hf  Hf3  1  0.80824148  0.19175852  0.54796489  1.0
  Hf  Hf4  1  0.80824148  0.61648395  0.54796489  1.0
  Hf  Hf5  1  0.38351605  0.19175852  0.54796489  1.0
  Hf  Hf6  1  0.80824148  0.19175852  0.95203511  1.0
  Hf  Hf7  1  0.80824148  0.61648395  0.95203511  1.0
  Hf  Hf8  1  0.38351605  0.19175852  0.95203511  1.0
  Hf  Hf9  1  0.19520738  0.80479262  0.05433172  1.0
  Hf  Hf10  1  0.19520738  0.39041575  0.05433172  1.0
  Hf  Hf11  1  0.60958425  0.80479262  0.05433172  1.0
  Hf  Hf12  1  0.54148646  0.45851354  0.25000000  1.0
  Hf  Hf13  1  0.54148646  0.08297193  0.25000000  1.0
  Hf  Hf14  1  0.91702807  0.45851354  0.25000000  1.0
  Hf  Hf15  1  0.45481709  0.54518291  0.75000000  1.0
  Hf  Hf16  1  0.45481709  0.90963417  0.75000000  1.0
  Hf  Hf17  1  0.09036583  0.54518291  0.75000000  1.0
  Re  Re18  1  0.88939870  0.11060130  0.25000000  1.0
  Re  Re19  1  0.88939870  0.77879541  0.25000000  1.0
  Re  Re20  1  0.22120459  0.11060130  0.25000000  1.0
  Re  Re21  1  0.10986255  0.89013745  0.75000000  1.0
  Re  Re22  1  0.10986255  0.21972411  0.75000000  1.0
  Re  Re23  1  0.78027589  0.89013745  0.75000000  1.0
  Re  Re24  1  0.00000000  0.00000000  0.49896691  1.0
  Re  Re25  1  0.00000000  0.00000000  0.00103309  1.0
  Ir  Ir26  1  0.33333300  0.66666700  0.25000000  1.0
  Se  Se27  1  0.66666700  0.33333300  0.75000000  1.0