# generated using pymatgen
data_HoScB6Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.53938995
_cell_length_b   8.99251194
_cell_length_c   11.34454526
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HoScB6Ir
_chemical_formula_sum   'Ho4 Sc4 B24 Ir4'
_cell_volume   361.07425943
_cell_formula_units_Z   4
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
  Ho  Ho0  1  0.50000000  0.31958030  0.41412672  1.0
  Ho  Ho1  1  0.50000000  0.68041970  0.58587328  1.0
  Ho  Ho2  1  0.50000000  0.18041970  0.91412672  1.0
  Ho  Ho3  1  0.50000000  0.81958030  0.08587328  1.0
  Sc  Sc4  1  0.50000000  0.44505407  0.12403386  1.0
  Sc  Sc5  1  0.50000000  0.55494593  0.87596614  1.0
  Sc  Sc6  1  0.50000000  0.05494593  0.62403386  1.0
  Sc  Sc7  1  0.50000000  0.94505407  0.37596614  1.0
  B  B8  1  0.00000000  0.10146233  0.47267567  1.0
  B  B9  1  0.00000000  0.89853767  0.52732433  1.0
  B  B10  1  0.00000000  0.39853767  0.97267567  1.0
  B  B11  1  0.00000000  0.60146233  0.02732433  1.0
  B  B12  1  0.00000000  0.13012510  0.31841819  1.0
  B  B13  1  0.00000000  0.86987490  0.68158181  1.0
  B  B14  1  0.00000000  0.36987490  0.81841819  1.0
  B  B15  1  0.00000000  0.63012510  0.18158181  1.0
  B  B16  1  0.00000000  0.05495469  0.06572415  1.0
  B  B17  1  0.00000000  0.94504531  0.93427585  1.0
  B  B18  1  0.00000000  0.44504531  0.56572415  1.0
  B  B19  1  0.00000000  0.55495469  0.43427585  1.0
  B  B20  1  0.00000000  0.48163661  0.28502151  1.0
  B  B21  1  0.00000000  0.51836339  0.71497849  1.0
  B  B22  1  0.00000000  0.01836339  0.78502151  1.0
  B  B23  1  0.00000000  0.98163661  0.21497849  1.0
  B  B24  1  0.00000000  0.25372198  0.08022203  1.0
  B  B25  1  0.00000000  0.74627802  0.91977797  1.0
  B  B26  1  0.00000000  0.24627802  0.58022203  1.0
  B  B27  1  0.00000000  0.75372198  0.41977797  1.0
  B  B28  1  0.00000000  0.29551247  0.23565489  1.0
  B  B29  1  0.00000000  0.70448753  0.76434511  1.0
  B  B30  1  0.00000000  0.20448753  0.73565489  1.0
  B  B31  1  0.00000000  0.79551247  0.26434511  1.0
  Ir  Ir32  1  0.50000000  0.14084379  0.18133396  1.0
  Ir  Ir33  1  0.50000000  0.85915621  0.81866604  1.0
  Ir  Ir34  1  0.50000000  0.35915621  0.68133396  1.0
  Ir  Ir35  1  0.50000000  0.64084379  0.31866604  1.0