# generated using pymatgen
data_Zr3B2IrRu4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56131616
_cell_length_b   9.55468500
_cell_length_c   3.11450535
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.95509661
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3B2IrRu4
_chemical_formula_sum   'Zr6 B4 Ir2 Ru8'
_cell_volume   284.52668253
_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  0.67499131  0.17894239  0.00000000  1.0
  Zr  Zr1  1  0.32500869  0.82105761  0.00000000  1.0
  Zr  Zr2  1  0.17476072  0.32892446  0.00000000  1.0
  Zr  Zr3  1  0.82523928  0.67107554  0.00000000  1.0
  Zr  Zr4  1  0.00000000  0.00000000  0.00000000  1.0
  Zr  Zr5  1  0.50000000  0.50000000  0.00000000  1.0
  B  B6  1  0.12087421  0.62140175  0.00000000  1.0
  B  B7  1  0.87912579  0.37859825  0.00000000  1.0
  B  B8  1  0.61445421  0.87495565  0.00000000  1.0
  B  B9  1  0.38554579  0.12504435  0.00000000  1.0
  Ir  Ir10  1  0.22343386  0.07175232  0.50000000  1.0
  Ir  Ir11  1  0.77656614  0.92824768  0.50000000  1.0
  Ru  Ru12  1  0.07053166  0.77913624  0.50000000  1.0
  Ru  Ru13  1  0.72202624  0.42729825  0.50000000  1.0
  Ru  Ru14  1  0.92946834  0.22086376  0.50000000  1.0
  Ru  Ru15  1  0.27797376  0.57270175  0.50000000  1.0
  Ru  Ru16  1  0.57240622  0.72124172  0.50000000  1.0
  Ru  Ru17  1  0.42759378  0.27875828  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