# generated using pymatgen
data_HfB4Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.60016138
_cell_length_b   7.60016125
_cell_length_c   3.50286183
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999681
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfB4Ir3
_chemical_formula_sum   'Hf2 B8 Ir6'
_cell_volume   175.22629309
_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  0.33333300  0.66666700  0.75000000  1.0
  Hf  Hf1  1  0.66666700  0.33333300  0.25000000  1.0
  B  B2  1  0.00000000  0.00000000  0.50000000  1.0
  B  B3  1  0.00000000  0.00000000  0.00000000  1.0
  B  B4  1  0.60199572  0.55125321  0.75000000  1.0
  B  B5  1  0.05074251  0.60199572  0.25000000  1.0
  B  B6  1  0.39800428  0.44874679  0.25000000  1.0
  B  B7  1  0.44874679  0.05074251  0.75000000  1.0
  B  B8  1  0.94925749  0.39800428  0.75000000  1.0
  B  B9  1  0.55125321  0.94925749  0.25000000  1.0
  Ir  Ir10  1  0.66653450  0.74349078  0.25000000  1.0
  Ir  Ir11  1  0.25650922  0.92304473  0.25000000  1.0
  Ir  Ir12  1  0.92304473  0.66653450  0.75000000  1.0
  Ir  Ir13  1  0.33346550  0.25650922  0.75000000  1.0
  Ir  Ir14  1  0.74349078  0.07695527  0.75000000  1.0
  Ir  Ir15  1  0.07695527  0.33346550  0.25000000  1.0