# generated using pymatgen
data_Zr2B4Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.00063139
_cell_length_b   8.85794658
_cell_length_c   9.86888978
_cell_angle_alpha   89.99825782
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2B4Ru5
_chemical_formula_sum   'Zr4 B8 Ru10'
_cell_volume   262.30949003
_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
  Zr  Zr0  1  0.50000000  0.83304860  0.18153386  1.0
  Zr  Zr1  1  0.50000000  0.16695140  0.81846614  1.0
  Zr  Zr2  1  0.50000000  0.66687334  0.68151413  1.0
  Zr  Zr3  1  0.50000000  0.33312666  0.31848587  1.0
  B  B4  1  0.50000000  0.96995079  0.58361806  1.0
  B  B5  1  0.50000000  0.03004921  0.41638194  1.0
  B  B6  1  0.50000000  0.85716028  0.89780787  1.0
  B  B7  1  0.50000000  0.14283972  0.10219213  1.0
  B  B8  1  0.50000000  0.64281728  0.39781856  1.0
  B  B9  1  0.50000000  0.35718272  0.60218144  1.0
  B  B10  1  0.50000000  0.46995304  0.91636574  1.0
  B  B11  1  0.50000000  0.53004696  0.08363426  1.0
  Ru  Ru12  1  0.00000000  0.68104349  0.94418720  1.0
  Ru  Ru13  1  0.00000000  0.31895651  0.05581280  1.0
  Ru  Ru14  1  0.00000000  0.81883392  0.44419425  1.0
  Ru  Ru15  1  0.00000000  0.18116608  0.55580575  1.0
  Ru  Ru16  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru17  1  0.00000000  0.41523578  0.76664824  1.0
  Ru  Ru18  1  0.00000000  0.58476422  0.23335176  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru20  1  0.00000000  0.91516251  0.73333025  1.0
  Ru  Ru21  1  0.00000000  0.08483749  0.26666975  1.0