# generated using pymatgen
data_Hf6Zr3Re4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68581833
_cell_length_b   8.68581878
_cell_length_c   8.48432132
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000205
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6Zr3Re4Ir
_chemical_formula_sum   'Hf12 Zr6 Re8 Ir2'
_cell_volume   554.33108854
_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
  Hf  Hf0  1  0.19446805  0.80553195  0.44297405  1.0
  Hf  Hf1  1  0.19446805  0.38893511  0.44297405  1.0
  Hf  Hf2  1  0.61106489  0.80553195  0.44297405  1.0
  Hf  Hf3  1  0.80553195  0.19446805  0.55702595  1.0
  Hf  Hf4  1  0.80553195  0.61106489  0.55702595  1.0
  Hf  Hf5  1  0.38893511  0.19446805  0.55702595  1.0
  Hf  Hf6  1  0.80553195  0.19446805  0.94297405  1.0
  Hf  Hf7  1  0.80553195  0.61106489  0.94297405  1.0
  Hf  Hf8  1  0.38893511  0.19446805  0.94297405  1.0
  Hf  Hf9  1  0.19446805  0.80553195  0.05702595  1.0
  Hf  Hf10  1  0.19446805  0.38893511  0.05702595  1.0
  Hf  Hf11  1  0.61106489  0.80553195  0.05702595  1.0
  Zr  Zr12  1  0.54146973  0.45853027  0.25000000  1.0
  Zr  Zr13  1  0.54146973  0.08293846  0.25000000  1.0
  Zr  Zr14  1  0.91706154  0.45853027  0.25000000  1.0
  Zr  Zr15  1  0.45853027  0.54146973  0.75000000  1.0
  Zr  Zr16  1  0.45853027  0.91706154  0.75000000  1.0
  Zr  Zr17  1  0.08293846  0.54146973  0.75000000  1.0
  Re  Re18  1  0.89073984  0.10926016  0.25000000  1.0
  Re  Re19  1  0.89073984  0.78147768  0.25000000  1.0
  Re  Re20  1  0.21852232  0.10926016  0.25000000  1.0
  Re  Re21  1  0.10926016  0.89073984  0.75000000  1.0
  Re  Re22  1  0.10926016  0.21852232  0.75000000  1.0
  Re  Re23  1  0.78147768  0.89073984  0.75000000  1.0
  Re  Re24  1  0.00000000  0.00000000  0.50000000  1.0
  Re  Re25  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir26  1  0.33333300  0.66666700  0.25000000  1.0
  Ir  Ir27  1  0.66666700  0.33333300  0.75000000  1.0