# generated using pymatgen
data_Zr2ReB2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.47940929
_cell_length_b   9.47940929
_cell_length_c   3.01312881
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2ReB2Ru5
_chemical_formula_sum   'Zr4 Re2 B4 Ru10'
_cell_volume   270.75734558
_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  0.67631591  0.17631591  0.00000000  1.0
  Zr  Zr1  1  0.32368409  0.82368409  0.00000000  1.0
  Zr  Zr2  1  0.17631591  0.32368409  0.00000000  1.0
  Zr  Zr3  1  0.82368409  0.67631591  0.00000000  1.0
  Re  Re4  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.12065364  0.62065364  0.00000000  1.0
  B  B7  1  0.87934636  0.37934636  0.00000000  1.0
  B  B8  1  0.62065364  0.87934636  0.00000000  1.0
  B  B9  1  0.37934636  0.12065364  0.00000000  1.0
  Ru  Ru10  1  0.21825967  0.07076989  0.50000000  1.0
  Ru  Ru11  1  0.78174033  0.92923011  0.50000000  1.0
  Ru  Ru12  1  0.07076989  0.78174033  0.50000000  1.0
  Ru  Ru13  1  0.71825967  0.42923011  0.50000000  1.0
  Ru  Ru14  1  0.92923011  0.21825967  0.50000000  1.0
  Ru  Ru15  1  0.28174033  0.57076989  0.50000000  1.0
  Ru  Ru16  1  0.57076989  0.71825967  0.50000000  1.0
  Ru  Ru17  1  0.42923011  0.28174033  0.50000000  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0