# generated using pymatgen
data_Ce3Ho(BRu)16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.20928698
_cell_length_b   7.46396629
_cell_length_c   7.46396603
_cell_angle_alpha   89.76079454
_cell_angle_beta   114.01232430
_cell_angle_gamma   114.01232020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Ho(BRu)16
_chemical_formula_sum   'Ce3 Ho1 B16 Ru16'
_cell_volume   420.01017863
_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
  Ce  Ce0  1  0.75000000  0.87500000  0.12500000  1.0
  Ce  Ce1  1  0.24999900  0.62500000  0.37499900  1.0
  Ce  Ce2  1  0.75000000  0.37500000  0.62499900  1.0
  Ho  Ho3  1  0.24999900  0.12500000  0.87500000  1.0
  B  B4  1  0.91374278  0.28944850  0.06476347  1.0
  B  B5  1  0.41389627  0.56421804  0.12360779  1.0
  B  B6  1  0.08610373  0.20971252  0.15032177  1.0
  B  B7  1  0.58397254  0.14885446  0.20812426  1.0
  B  B8  1  0.41189531  0.06346554  0.28782218  1.0
  B  B9  1  0.91374278  0.62429528  0.34897931  1.0
  B  B10  1  0.58625622  0.65101969  0.37570572  1.0
  B  B11  1  0.08610373  0.87639221  0.43578196  1.0
  B  B12  1  0.91602646  0.12415173  0.56488193  1.0
  B  B13  1  0.41189531  0.34842976  0.62407313  1.0
  B  B14  1  0.08810469  0.37592687  0.65157024  1.0
  B  B15  1  0.58625622  0.93523553  0.71055150  1.0
  B  B16  1  0.41389627  0.84967823  0.79028748  1.0
  B  B17  1  0.91602646  0.79187474  0.85114454  1.0
  B  B18  1  0.58397254  0.43511807  0.87584727  1.0
  B  B19  1  0.08810469  0.71217782  0.93653446  1.0
  Ru  Ru20  1  0.87185125  0.55019660  0.03616052  1.0
  Ru  Ru21  1  0.37256543  0.83333562  0.05049026  1.0
  Ru  Ru22  1  0.12743457  0.94950974  0.16666438  1.0
  Ru  Ru23  1  0.62728030  0.46239717  0.17799859  1.0
  Ru  Ru24  1  0.37294014  0.33541078  0.32175308  1.0
  Ru  Ru25  1  0.87185125  0.32165465  0.33569173  1.0
  Ru  Ru26  1  0.62814975  0.96384048  0.44980340  1.0
  Ru  Ru27  1  0.12743457  0.17792383  0.46076819  1.0
  Ru  Ru28  1  0.87272070  0.82200341  0.53760283  1.0
  Ru  Ru29  1  0.37294014  0.03752936  0.55118506  1.0
  Ru  Ru30  1  0.12705986  0.67824792  0.66458922  1.0
  Ru  Ru31  1  0.62814975  0.66430927  0.67834535  1.0
  Ru  Ru32  1  0.37256543  0.53923181  0.82207617  1.0
  Ru  Ru33  1  0.87272070  0.05071829  0.83511787  1.0
  Ru  Ru34  1  0.62728030  0.16488213  0.94928071  1.0
  Ru  Ru35  1  0.12705986  0.44881494  0.96247064  1.0