# generated using pymatgen
data_HfSc(B4Ir3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.58498993
_cell_length_b   7.58498926
_cell_length_c   3.49181165
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000292
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc(B4Ir3)2
_chemical_formula_sum   'Hf1 Sc1 B8 Ir6'
_cell_volume   173.97682752
_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  0.33333300  0.66666700  0.75000000  1.0
  Sc  Sc1  1  0.66666700  0.33333300  0.25000000  1.0
  B  B2  1  0.60144621  0.54851595  0.75000000  1.0
  B  B3  1  0.04909238  0.59949392  0.25000000  1.0
  B  B4  1  0.55040154  0.95090762  0.25000000  1.0
  B  B5  1  0.45148405  0.05293026  0.75000000  1.0
  B  B6  1  0.00000000  0.00000000  0.99952661  1.0
  B  B7  1  0.40050608  0.44959846  0.25000000  1.0
  B  B8  1  0.00000000  0.00000000  0.50047339  1.0
  B  B9  1  0.94706974  0.39855379  0.75000000  1.0
  Ir  Ir10  1  0.74581211  0.07584349  0.75000000  1.0
  Ir  Ir11  1  0.33003138  0.25418789  0.75000000  1.0
  Ir  Ir12  1  0.66840219  0.74618695  0.25000000  1.0
  Ir  Ir13  1  0.07778476  0.33159781  0.25000000  1.0
  Ir  Ir14  1  0.25381305  0.92221524  0.25000000  1.0
  Ir  Ir15  1  0.92415651  0.66996862  0.75000000  1.0